<?xml version="1.0" encoding="UTF-8"?>
<module xmlns="http://www.xml-cml.org/schema" xmlns:cc="http://www.xml-cml.org/dictionary/compchem/" xmlns:cml="http://www.xml-cml.org/schema" xmlns:cmlx="http://www.xml-cml.org/schema/cmlx" xmlns:convention="http://www.xml-cml.org/convention/" xmlns:g="http://www.iochem-bd.org/dictionary/gaussian/" xmlns:nonsi="http://www.xml-cml.org/unit/nonSi/" xmlns:nonsi2="http://www.iochem-bd.org/unit/nonSi2/" xmlns:si="http://www.xml-cml.org/unit/si/" xmlns:xi="http://www.w3.org/2001/XInclude" xmlns:xsd="http://www.w3.org/2001/XMLSchema" convention="convention:compchem" id="grrm.log">
   <module dictRef="cc:jobList" id="jobList1">
      <module cmlx:templateRef="job" dictRef="cc:job" id="job">
         <module cmlx:templateRef="final-geometry"/>
         <module cmlx:templateRef="frequencies"/>
         <module dictRef="cc:environment" id="environment">
            <parameterList>
               <parameter dictRef="cc:program">
                  <scalar cmlx:templateRef="program.name" dataType="xsd:string">GRRM</scalar>
               </parameter>
               <parameter dictRef="cc:programVersion">
                  <scalar dataType="xsd:integer">23</scalar>
               </parameter>
               <parameter dictRef="cc:programDate">
                  <scalar dataType="xsd:string">January 23, 2023</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:jobtype">
                  <scalar dataType="xsd:string">Saddle</scalar>
               </parameter>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string">wB97XD</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">def2svpp</scalar>
               </parameter>
               <parameter dictRef="cc:charge">
                  <scalar dataType="xsd:integer">-1</scalar>
               </parameter>
               <parameter dictRef="cc:multiplicity">
                  <scalar dataType="xsd:integer">1</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:calculation" id="calculation">
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">1</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.10119609" y3="1.11371766" z3="3.91255228">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.46386638" y3="1.45009403" z3="2.92241204">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.06545896" y3="1.48151129" z3="4.03317017">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.73336773" y3="1.60275873" z3="4.67723397">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15517328" y3="-0.41073022" z3="4.01579958">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.76916621" y3="-0.72750754" z3="5.00097743">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47377306" y3="-0.85614439" z3="3.26404859">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5552802" y3="-0.99906333" z3="3.80208833">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.49683715" y3="-2.1024451" z3="3.87396845">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86234911" y3="-0.77490293" z3="2.76050081">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66721113" y3="-0.5002543" z3="4.73992495">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62808092" y3="-0.89339513" z3="4.36514947">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.71587767" y3="0.60573587" z3="4.73704433">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.56049235" y3="-0.96674416" z3="6.19107689">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.408668" y3="-0.75194011" z3="8.42487826">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.28130596" y3="-1.34930454" z3="8.746291">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.29389167" y3="0.07888575" z3="9.15305742">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.14702248" y3="-1.62817506" z3="8.51004394">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98211365" y3="-1.9545314" z3="9.5593944">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.27126766" y3="-1.00632294" z3="8.23894453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.20137635" y3="-2.86135187" z3="7.60840194">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31521947" y3="-2.53049477" z3="6.56009571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.1238766" y3="-3.42492637" z3="7.83289483">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.01142662" y3="-3.78928689" z3="7.7145524">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.17700488" y3="-4.6922328" z3="7.1035556">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.11760883" y3="-4.14280121" z3="8.75929111">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.325973" y3="-3.15326594" z3="7.26141893">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61681629" y3="-2.31111499" z3="7.91291294">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.15459784" y3="-3.88463456" z3="7.27112113">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23345375" y3="-2.75674219" z3="6.23367621">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.27697383" y3="-1.90528408" z3="6.57218317">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.70130934" y3="-0.19346313" z3="7.0529788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83832299" y3="0.26548939" z3="6.55608355">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.39022716" y3="1.12330441" z3="7.70956642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.42259128" y3="0.40167214" z3="8.54708299">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.20817887" y3="0.86164565" z3="7.01298214">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.6117162" y3="2.12467315" z3="8.12643486">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.03069846" y3="1.10020935" z3="7.01504291">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.85239286" y3="0.0964351" z3="6.59579637">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.01918819" y3="1.80804237" z3="6.168223">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.87671016" y3="1.46250161" z3="7.94326643">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7392025" y3="0.6912336" z3="8.72272935">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.12941324" y3="2.40896685" z3="8.47316217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.54527559" y3="1.70623541" z3="7.21120694">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.54897953" y3="2.30867908" z3="6.11196814">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.73278796" y3="1.94572475" z3="7.95270336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.1012,1.1137,3.9126;-1.4639,1.4501,2.9224;-.0655,1.4815,4.0332;-1.7334,1.6028,4.6772;-1.1552,-.4107,4.0158;-.7692,-.7275,5.001;-.4738,-.8561,3.264;-2.5553,-.9991,3.8021;-2.4968,-2.1024,3.874;-2.8623,-.7749,2.7605;-3.6672,-.5003,4.7399;-4.6281,-.8934,4.3651;-3.7159,.6057,4.737;-3.5605,-.9667,6.1911;-2.4087,-.7519,8.4249;-3.2813,-1.3493,8.7463;-2.2939,.0789,9.1531;-1.147,-1.6282,8.51;-.9821,-1.9545,9.5594;-.2713,-1.0063,8.2389;-1.2014,-2.8614,7.6084;-1.3152,-2.5305,6.5601;-2.1239,-3.4249,7.8329;.0114,-3.7893,7.7146;-.177,-4.6922,7.1036;.1176,-4.1428,8.7593;1.326,-3.1533,7.2614;1.6168,-2.3111,7.9129;2.1546,-3.8846,7.2711;1.2335,-2.7567,6.2337;-4.277,-1.9053,6.5722;-2.7013,-.1935,7.053;-1.8383,.2655,6.5561;-7.3902,1.1233,7.7096;-7.4226,.4017,8.5471;-8.2082,.8616,7.013;-7.6117,2.1247,8.1264;-6.0307,1.1002,7.015;-5.8524,.0964,6.5958;-6.0192,1.808,6.1682;-4.8767,1.4625,7.9433;-4.7392,.6912,8.7227;-5.1294,2.409,8.4732;-3.5453,1.7062,7.2112;-3.549,2.3087,6.112;-2.7328,1.9457,7.9527;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.726583834207</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.017582900479 0.001707507202 0.049470491213 0.008512563753</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015019039 0.000022045 0.000187685 0.000290125 0.000340295 0.000453253 0.000491273 0.000847180 0.001079410 0.001477078 0.002176971 0.002941501 0.003051610 0.003284188 0.004272355 0.005144834 0.005423089 0.005699069 0.006969236 0.007500878 0.009734775 0.010433297 0.010796291 0.012873755 0.017957239 0.019141001 0.021089405 0.023695057 0.027694333 0.030531861 0.032963463 0.033942847 0.034360204 0.037194300 0.038914819 0.043228166 0.045309524 0.048121591 0.049682170 0.049814555 0.050300831 0.051614733 0.052087986 0.052835317 0.053745924 0.054054243 0.056890201 0.058373039 0.061111093 0.061510991 0.065983181 0.068908479 0.072290088 0.075857460 0.076991031 0.078072872 0.078279995 0.081638390 0.083995568 0.087824104 0.096018514 0.098650641 0.102719028 0.104953998 0.107848338 0.111214473 0.113512316 0.113775293 0.116758125 0.118684201 0.130864736 0.134787066 0.137349027 0.143967364 0.145074625 0.153505494 0.154503981 0.165767530 0.170452758 0.173387274 0.180017975 0.188573511 0.193086913 0.201758030 0.207586804 0.213270680 0.216468503 0.237330055 0.254448593 0.263345134 0.312152234 0.322867378 0.351075228 0.358279055 0.413803763 0.448951916 0.501727622 0.534444549 0.562054020 0.597118235 0.615457625 0.631679079 0.684074229 0.728654345 0.745241877 0.746190682 0.751039432 0.759268978 0.766607710 0.771174422 0.784904255 0.785480403 0.790917607 0.797324773 0.807013148 0.809041221 0.814029895 0.824453036 0.832647613 0.851056334 0.861210064 0.867856451 0.876426040 0.891789287 0.897559258 0.902472954 0.910918202 0.920685741 0.922167852 0.954475416 1.260748441 1.489706600</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">2</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.09974196" y3="1.11219711" z3="3.90988552">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.46348063" y3="1.45012892" z3="2.92068403">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.06386528" y3="1.47971848" z3="4.03004184">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.72977926" y3="1.60164118" z3="4.67543942">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15446572" y3="-0.41228873" z3="4.01288098">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.76960643" y3="-0.72884857" z3="4.99838966">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47265259" y3="-0.85671266" z3="3.26089888">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5546902" y3="-1.00065845" z3="3.79979619">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.49588334" y3="-2.10388771" z3="3.87297138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86197957" y3="-0.77766324" z3="2.75781317">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66525622" y3="-0.50056542" z3="4.73854865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62691512" y3="-0.89222207" z3="4.3642953">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.7138292" y3="0.60468614" z3="4.72844036">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.56197196" y3="-0.96688353" z3="6.19240374">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.40190666" y3="-0.76033678" z3="8.42264386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.27502199" y3="-1.35754858" z3="8.74361617">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.28941389" y3="0.07288325" z3="9.14945392">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.14050648" y3="-1.63760775" z3="8.51714086">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.97995193" y3="-1.9635524" z3="9.56755726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.26229496" y3="-1.01779827" z3="8.24907121">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.19542345" y3="-2.87007324" z3="7.61498316">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31167633" y3="-2.5355574" z3="6.56828292">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.11758861" y3="-3.43404164" z3="7.84001857">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.01780167" y3="-3.79778038" z3="7.71622407">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.17113181" y3="-4.69918236" z3="7.10296248">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.12715602" y3="-4.15429177" z3="8.75966705">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.32992287" y3="-3.15808946" z3="7.26137012">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61912568" y3="-2.31583424" z3="7.91343653">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.16091165" y3="-3.88679425" z3="7.26838333">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23376961" y3="-2.76012699" z3="6.23449585">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.29608029" y3="-1.89677355" z3="6.5715676">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.69174395" y3="-0.21442942" z3="7.04746663">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84484034" y3="0.27682152" z3="6.55383731">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.39485682" y3="1.12171274" z3="7.70906944">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.42288195" y3="0.4006069" z3="8.54705067">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21125398" y3="0.85496976" z3="7.01276342">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.62175869" y3="2.1224075" z3="8.12484818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.0353978" y3="1.10561751" z3="7.01439023">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.84678411" y3="0.10136155" z3="6.60106595">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.03137906" y3="1.80990765" z3="6.16441023">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.88555018" y3="1.47902007" z3="7.94350338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.72845194" y3="0.70062423" z3="8.71147499">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.15280999" y3="2.41446518" z3="8.48719583">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.56376651" y3="1.75570591" z3="7.21453137">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.56300498" y3="2.34692171" z3="6.11858192">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.73306213" y3="1.95860777" z3="7.94433459">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0997,1.1122,3.9099;-1.4635,1.4501,2.9207;-.0639,1.4797,4.03;-1.7298,1.6016,4.6754;-1.1545,-.4123,4.0129;-.7696,-.7288,4.9984;-.4727,-.8567,3.2609;-2.5547,-1.0007,3.7998;-2.4959,-2.1039,3.873;-2.862,-.7777,2.7578;-3.6653,-.5006,4.7385;-4.6269,-.8922,4.3643;-3.7138,.6047,4.7284;-3.562,-.9669,6.1924;-2.4019,-.7603,8.4226;-3.275,-1.3575,8.7436;-2.2894,.0729,9.1495;-1.1405,-1.6376,8.5171;-.98,-1.9636,9.5676;-.2623,-1.0178,8.2491;-1.1954,-2.8701,7.615;-1.3117,-2.5356,6.5683;-2.1176,-3.434,7.84;.0178,-3.7978,7.7162;-.1711,-4.6992,7.103;.1272,-4.1543,8.7597;1.3299,-3.1581,7.2614;1.6191,-2.3158,7.9134;2.1609,-3.8868,7.2684;1.2338,-2.7601,6.2345;-4.2961,-1.8968,6.5716;-2.6917,-.2144,7.0475;-1.8448,.2768,6.5538;-7.3949,1.1217,7.7091;-7.4229,.4006,8.5471;-8.2113,.855,7.0128;-7.6218,2.1224,8.1248;-6.0354,1.1056,7.0144;-5.8468,.1014,6.6011;-6.0314,1.8099,6.1644;-4.8856,1.479,7.9435;-4.7285,.7006,8.7115;-5.1528,2.4145,8.4872;-3.5638,1.7557,7.2145;-3.563,2.3469,6.1186;-2.7331,1.9586,7.9443;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.725377875136</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.012633498490 0.001241984208 0.051481281113 0.008512582218</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.014520528 0.000022702 0.000187359 0.000290144 0.000340706 0.000454467 0.000487439 0.000846464 0.001078796 0.001479708 0.002181699 0.002945023 0.003051048 0.003282794 0.004271645 0.005143649 0.005391848 0.005713236 0.006961427 0.007543674 0.009751519 0.010419115 0.010799692 0.012878023 0.017928766 0.019127715 0.021089329 0.023693953 0.027679669 0.030520730 0.032963386 0.033942004 0.034361252 0.037161584 0.038916110 0.043228421 0.045303374 0.048118368 0.049681540 0.049814600 0.050302803 0.051608922 0.052087300 0.052833040 0.053767084 0.054038243 0.056898160 0.058373225 0.061102749 0.061509505 0.065983764 0.068894484 0.072288295 0.075855703 0.076974059 0.078065576 0.078277445 0.081616070 0.083988990 0.087736008 0.096016533 0.098650055 0.102683398 0.104960258 0.107851359 0.111212759 0.113511619 0.113774843 0.116756593 0.118684554 0.130870643 0.134782500 0.137347718 0.143958715 0.145067936 0.153511684 0.154503632 0.165773044 0.170452135 0.173392658 0.180012921 0.188571265 0.193084470 0.201756080 0.207606589 0.213271541 0.216460507 0.237344878 0.254447872 0.263346057 0.312153602 0.322878551 0.351076001 0.358285046 0.413803368 0.448951764 0.501727353 0.534449913 0.562053707 0.597118256 0.615456995 0.631679156 0.684074276 0.728692859 0.745241706 0.746190602 0.751040384 0.759269099 0.766607477 0.771174402 0.784904661 0.785480336 0.790917599 0.797326422 0.807013501 0.809041180 0.814034615 0.824455440 0.832647509 0.851057178 0.861227828 0.867856435 0.876428553 0.891788809 0.897567253 0.902475230 0.910919368 0.920685884 0.922167639 0.954512598 1.260922483 1.489714773</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">3</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.09782169" y3="1.11040038" z3="3.90663798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.46302681" y3="1.44954028" z3="2.91840817">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.06164589" y3="1.4773736" z3="4.02575857">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.72539515" y3="1.60032851" z3="4.67328523">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15398251" y3="-0.41397881" z3="4.01020224">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77017602" y3="-0.73001889" z3="4.99613477">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47228078" y3="-0.8582784" z3="3.25802948">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55473555" y3="-1.00155054" z3="3.79819653">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.49614598" y3="-2.1046119" z3="3.87381085">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86183448" y3="-0.78070015" z3="2.75550531">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66388256" y3="-0.49897279" z3="4.73742583">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62619533" y3="-0.88979902" z3="4.36373174">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.7122693" y3="0.60591226" z3="4.72067504">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.56173457" y3="-0.96593781" z3="6.19358959">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.39490794" y3="-0.76857224" z3="8.42046612">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26986401" y3="-1.36407234" z3="8.73995439">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.28447315" y3="0.06645645" z3="9.1468539">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.13478602" y3="-1.64726557" z3="8.52321844">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98003035" y3="-1.97234023" z3="9.57467555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.25417782" y3="-1.02929303" z3="8.25831188">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.1896505" y3="-2.8793842" z3="7.62072216">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.3075997" y3="-2.54288015" z3="6.57495441">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.11218271" y3="-3.44301778" z3="7.84572385">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.02434587" y3="-3.80644029" z3="7.71826948">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.1647734" y3="-4.70653525" z3="7.10307453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.1369662" y3="-4.16567013" z3="8.76046721">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.33439488" y3="-3.16367452" z3="7.26150101">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62292141" y3="-2.32162226" z3="7.91412353">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.16729658" y3="-3.89026365" z3="7.26543365">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23474415" y3="-2.76423689" z3="6.23552282">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.3100577" y3="-1.88914654" z3="6.5713893">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.67882503" y3="-0.23644722" z3="7.04172531">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85035943" y3="0.28925109" z3="6.55331726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.39964507" y3="1.11928928" z3="7.70865871">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.42296642" y3="0.39907462" z3="8.54743404">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21368784" y3="0.84595745" z3="7.01236698">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.63357799" y3="2.11913624" z3="8.12278116">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.04019504" y3="1.11102904" z3="7.01402907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.84185169" y3="0.10676682" z3="6.60537686">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.04241392" y3="1.81269157" z3="6.1619107">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.89468031" y3="1.49509398" z3="7.94402083">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.71964127" y3="0.71143158" z3="8.70198051">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.17369049" y3="2.42018915" z3="8.49944249">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.5836481" y3="1.80718719" z3="7.21927773">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.57866985" y3="2.38342701" z3="6.12338917">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.73715551" y3="1.97463031" z3="7.93612387">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0978,1.1104,3.9066;-1.463,1.4495,2.9184;-.0616,1.4774,4.0258;-1.7254,1.6003,4.6733;-1.154,-.414,4.0102;-.7702,-.73,4.9961;-.4723,-.8583,3.258;-2.5547,-1.0016,3.7982;-2.4961,-2.1046,3.8738;-2.8618,-.7807,2.7555;-3.6639,-.499,4.7374;-4.6262,-.8898,4.3637;-3.7123,.6059,4.7207;-3.5617,-.9659,6.1936;-2.3949,-.7686,8.4205;-3.2699,-1.3641,8.74;-2.2845,.0665,9.1469;-1.1348,-1.6473,8.5232;-.98,-1.9723,9.5747;-.2542,-1.0293,8.2583;-1.1897,-2.8794,7.6207;-1.3076,-2.5429,6.575;-2.1122,-3.443,7.8457;.0243,-3.8064,7.7183;-.1648,-4.7065,7.1031;.137,-4.1657,8.7605;1.3344,-3.1637,7.2615;1.6229,-2.3216,7.9141;2.1673,-3.8903,7.2654;1.2347,-2.7642,6.2355;-4.3101,-1.8891,6.5714;-2.6788,-.2364,7.0417;-1.8504,.2893,6.5533;-7.3996,1.1193,7.7087;-7.423,.3991,8.5474;-8.2137,.846,7.0124;-7.6336,2.1191,8.1228;-6.0402,1.111,7.014;-5.8419,.1068,6.6054;-6.0424,1.8127,6.1619;-4.8947,1.4951,7.944;-4.7196,.7114,8.702;-5.1737,2.4202,8.4994;-3.5836,1.8072,7.2193;-3.5787,2.3834,6.1234;-2.7372,1.9746,7.9361;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724544130470</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.008378023664 0.000885491375 0.047869408135 0.008512638731</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.012067671 0.000024066 0.000186836 0.000290220 0.000334602 0.000449889 0.000484924 0.000843606 0.001077262 0.001446969 0.002158156 0.002941590 0.003039764 0.003282102 0.004278364 0.005129271 0.005328918 0.005709227 0.006891434 0.007466006 0.009756076 0.010326687 0.010766358 0.012858008 0.017887552 0.019095072 0.021088920 0.023690653 0.027627107 0.030487594 0.032963264 0.033940690 0.034358564 0.037129461 0.038914148 0.043228416 0.045306428 0.048101316 0.049681826 0.049814578 0.050303601 0.051606736 0.052089257 0.052832202 0.053773328 0.054025485 0.056893851 0.058373449 0.061095415 0.061508253 0.065983156 0.068881779 0.072286370 0.075852968 0.076959315 0.078059645 0.078276157 0.081603043 0.083983279 0.087697677 0.096015711 0.098650067 0.102670427 0.104959743 0.107851453 0.111212187 0.113511292 0.113774303 0.116756288 0.118683843 0.130870656 0.134781621 0.137347409 0.143957768 0.145066345 0.153512404 0.154503144 0.165773289 0.170452066 0.173394412 0.180013633 0.188570686 0.193085906 0.201757577 0.207610052 0.213271344 0.216465686 0.237351917 0.254448608 0.263344531 0.312156455 0.322880693 0.351075769 0.358284809 0.413803375 0.448951454 0.501727735 0.534459415 0.562054517 0.597118335 0.615456036 0.631682595 0.684077794 0.728772894 0.745242930 0.746192436 0.751048704 0.759269159 0.766606306 0.771174918 0.784909057 0.785482414 0.790918556 0.797333509 0.807013513 0.809041932 0.814082996 0.824462381 0.832648093 0.851058504 0.861309885 0.867857888 0.876433104 0.891797368 0.897615631 0.902494166 0.910930437 0.920687156 0.922170385 0.954788023 1.261374303 1.489744201</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">4</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.09444685" y3="1.10801558" z3="3.90152306">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.4616951" y3="1.4476084" z3="2.9142399">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.05755109" y3="1.47358125" z3="4.01847242">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.71843789" y3="1.59975316" z3="4.66930275">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15356784" y3="-0.41603424" z3="4.00747594">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77127645" y3="-0.73079026" z3="4.99429767">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47242818" y3="-0.86190195" z3="3.25572082">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55526683" y3="-1.0018374" z3="3.79677633">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.49789395" y3="-2.10464164" z3="3.8766008">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86165081" y3="-0.78436117" z3="2.75300852">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66317362" y3="-0.49538432" z3="4.73534146">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62610039" y3="-0.88579617" z3="4.36268249">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.71153361" y3="0.60914811" z3="4.71135288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.56176126" y3="-0.96207773" z3="6.19363521">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.38846714" y3="-0.77592165" z3="8.41727051">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26618791" y3="-1.36877398" z3="8.73439926">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.27938902" y3="0.06020631" z3="9.14366808">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.13031185" y3="-1.65693066" z3="8.52805216">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98181848" y3="-1.98048166" z3="9.58077286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.24730444" y3="-1.04094318" z3="8.26611576">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.18410475" y3="-2.88966356" z3="7.62637114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.30538124" y3="-2.55306213" z3="6.58100517">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.10488495" y3="-3.45532744" z3="7.8536631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.03174797" y3="-3.81481063" z3="7.72083269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.1572706" y3="-4.71427882" z3="7.10463861">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14759367" y3="-4.1757512" z3="8.76211597">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.33990719" y3="-3.16970552" z3="7.26173967">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62900828" y3="-2.32826244" z3="7.91489373">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.17390269" y3="-3.89511995" z3="7.26228618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23693008" y3="-2.76878427" z3="6.23667512">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.32344988" y3="-1.87832214" z3="6.57095205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.6657025" y3="-0.25380436" z3="7.03552779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85455623" y3="0.30214791" z3="6.55372097">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.40476237" y3="1.11561184" z3="7.70816942">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.4227622" y3="0.39678917" z3="8.54819143">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21549463" y3="0.83376954" z3="7.01155799">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.64774035" y3="2.11440387" z3="8.11987706">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.04494628" y3="1.11668652" z3="7.0143204">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83710889" y3="0.11302853" z3="6.60873785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.05247489" y3="1.81708496" z3="6.16124664">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.90391749" y3="1.51019063" z3="7.94582669">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.71302872" y3="0.72204101" z3="8.69477308">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.19332874" y3="2.42550881" z3="8.51200589">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.60269911" y3="1.85505659" z3="7.2259595">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.59502351" y3="2.42042523" z3="6.13061782">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.74415863" y3="1.99216727" z3="7.93147338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0944,1.108,3.9015;-1.4617,1.4476,2.9142;-.0576,1.4736,4.0185;-1.7184,1.5998,4.6693;-1.1536,-.416,4.0075;-.7713,-.7308,4.9943;-.4724,-.8619,3.2557;-2.5553,-1.0018,3.7968;-2.4979,-2.1046,3.8766;-2.8617,-.7844,2.753;-3.6632,-.4954,4.7353;-4.6261,-.8858,4.3627;-3.7115,.6091,4.7114;-3.5618,-.9621,6.1936;-2.3885,-.7759,8.4173;-3.2662,-1.3688,8.7344;-2.2794,.0602,9.1437;-1.1303,-1.6569,8.5281;-.9818,-1.9805,9.5808;-.2473,-1.0409,8.2661;-1.1841,-2.8897,7.6264;-1.3054,-2.5531,6.581;-2.1049,-3.4553,7.8537;.0317,-3.8148,7.7208;-.1573,-4.7143,7.1046;.1476,-4.1758,8.7621;1.3399,-3.1697,7.2617;1.629,-2.3283,7.9149;2.1739,-3.8951,7.2623;1.2369,-2.7688,6.2367;-4.3234,-1.8783,6.571;-2.6657,-.2538,7.0355;-1.8546,.3021,6.5537;-7.4048,1.1156,7.7082;-7.4228,.3968,8.5482;-8.2155,.8338,7.0116;-7.6477,2.1144,8.1199;-6.0449,1.1167,7.0143;-5.8371,.113,6.6087;-6.0525,1.8171,6.1612;-4.9039,1.5102,7.9458;-4.713,.722,8.6948;-5.1933,2.4255,8.512;-3.6027,1.8551,7.226;-3.595,2.4204,6.1306;-2.7442,1.9922,7.9315;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724068159598</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.005501715947 0.000603339587 0.044260619985 0.008512606738</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.008637395 0.000023178 0.000168409 0.000289522 0.000319025 0.000432678 0.000479096 0.000833064 0.001073312 0.001398936 0.002110862 0.002927229 0.003019502 0.003273191 0.004229926 0.005040598 0.005209983 0.005702339 0.006750990 0.007407911 0.009753017 0.010237443 0.010737929 0.012833341 0.017846774 0.019070498 0.021088491 0.023687203 0.027587177 0.030468467 0.032963125 0.033939807 0.034349471 0.037110832 0.038913996 0.043228402 0.045306915 0.048100497 0.049681842 0.049814536 0.050303550 0.051606842 0.052089184 0.052831804 0.053772701 0.054023150 0.056892024 0.058373421 0.061092207 0.061507577 0.065982916 0.068877964 0.072285681 0.075852687 0.076956738 0.078059021 0.078275500 0.081599548 0.083982500 0.087698180 0.096015592 0.098651261 0.102672657 0.104961656 0.107851418 0.111211893 0.113511463 0.113773952 0.116756048 0.118683584 0.130871723 0.134782662 0.137347960 0.143963681 0.145067591 0.153512582 0.154503076 0.165778836 0.170453217 0.173397194 0.180016015 0.188570734 0.193088854 0.201767981 0.207626362 0.213270982 0.216494045 0.237372930 0.254451770 0.263345086 0.312160734 0.322885268 0.351079350 0.358285960 0.413803408 0.448951881 0.501728250 0.534458565 0.562062936 0.597122202 0.615470902 0.631691268 0.684077574 0.728798292 0.745244194 0.746194066 0.751059882 0.759270760 0.766623509 0.771176534 0.784911776 0.785484847 0.790920467 0.797337646 0.807013779 0.809049273 0.814141982 0.824467373 0.832651449 0.851059429 0.861398718 0.867862007 0.876441717 0.891819819 0.897657989 0.902511421 0.910940884 0.920687017 0.922180023 0.955046533 1.262101492 1.489859633</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">5</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.09104624" y3="1.10572299" z3="3.89588767">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.4603828" y3="1.44536775" z3="2.90940278">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.05312916" y3="1.46935148" z3="4.00986606">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.71135172" y3="1.5997644" z3="4.66498793">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15346059" y3="-0.41801263" z3="4.00443583">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77260113" y3="-0.73145944" z3="4.99212024">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47318803" y3="-0.86607685" z3="3.25318037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55636085" y3="-1.0014715" z3="3.79536245">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.50098736" y3="-2.10397531" z3="3.88016477">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86204261" y3="-0.7877911" z3="2.75047412">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66252789" y3="-0.49001158" z3="4.73319723">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6264957" y3="-0.87931127" z3="4.36201111">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.70972999" y3="0.61427119" z3="4.70282299">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.56109092" y3="-0.95694019" z3="6.19289679">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.3819981" y3="-0.78280798" z3="8.41349106">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26284092" y3="-1.3726247" z3="8.7279311">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.2737017" y3="0.05420682" z3="9.13972906">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12620641" y3="-1.66681191" z3="8.53220941">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98372588" y3="-1.9885237" z3="9.58628643">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.24076756" y3="-1.05311026" z3="8.27292246">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17878263" y3="-2.90079896" z3="7.63219082">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.30376788" y3="-2.56520819" z3="6.58693093">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09751513" y3="-3.4687391" z3="7.86245445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.0393491" y3="-3.8234483" z3="7.72428091">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.14932939" y3="-4.72305194" z3="7.10813368">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.15847886" y3="-4.18479184" z3="8.76507652">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.34571628" y3="-3.17655535" z3="7.2622554">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.63641585" y3="-2.33593261" z3="7.91577215">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.18022411" y3="-3.90146348" z3="7.25915104">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23943647" y3="-2.77416293" z3="6.23810794">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.33383335" y3="-1.86711692" z3="6.56980792">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.6528549" y3="-0.26798585" z3="7.02928596">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8576706" y3="0.31560061" z3="6.55454041">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.41014112" y3="1.11061959" z3="7.70754234">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.4219668" y3="0.39357186" z3="8.5491313">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21685489" y3="0.81870653" z3="7.01052448">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.66384497" y3="2.10805031" z3="8.11632094">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.04982224" y3="1.12288175" z3="7.01483185">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.831795" y3="0.12036922" z3="6.61131252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.06306641" y3="1.82279527" z3="6.16139957">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.9133938" y3="1.52567002" z3="7.94807277">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.70759464" y3="0.73349769" z3="8.68858567">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.21303856" y3="2.43142444" z3="8.5244242">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.62099276" y3="1.89931721" z3="7.23272884">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.61138798" y3="2.45579672" z3="6.13761364">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.75230084" y3="2.01165425" z3="7.92803213">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.091,1.1057,3.8959;-1.4604,1.4454,2.9094;-.0531,1.4694,4.0099;-1.7114,1.5998,4.665;-1.1535,-.418,4.0044;-.7726,-.7315,4.9921;-.4732,-.8661,3.2532;-2.5564,-1.0015,3.7954;-2.501,-2.104,3.8802;-2.862,-.7878,2.7505;-3.6625,-.49,4.7332;-4.6265,-.8793,4.362;-3.7097,.6143,4.7028;-3.5611,-.9569,6.1929;-2.382,-.7828,8.4135;-3.2628,-1.3726,8.7279;-2.2737,.0542,9.1397;-1.1262,-1.6668,8.5322;-.9837,-1.9885,9.5863;-.2408,-1.0531,8.2729;-1.1788,-2.9008,7.6322;-1.3038,-2.5652,6.5869;-2.0975,-3.4687,7.8625;.0393,-3.8234,7.7243;-.1493,-4.7231,7.1081;.1585,-4.1848,8.7651;1.3457,-3.1766,7.2623;1.6364,-2.3359,7.9158;2.1802,-3.9015,7.2592;1.2394,-2.7742,6.2381;-4.3338,-1.8671,6.5698;-2.6529,-.268,7.0293;-1.8577,.3156,6.5545;-7.4101,1.1106,7.7075;-7.422,.3936,8.5491;-8.2169,.8187,7.0105;-7.6638,2.1081,8.1163;-6.0498,1.1229,7.0148;-5.8318,.1204,6.6113;-6.0631,1.8228,6.1614;-4.9134,1.5257,7.9481;-4.7076,.7335,8.6886;-5.213,2.4314,8.5244;-3.621,1.8993,7.2327;-3.6114,2.4558,6.1376;-2.7523,2.0117,7.928;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723809069988</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003631147344 0.000423117652 0.039650083113 0.008512773581</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.006023655 0.000017176 0.000085964 0.000266017 0.000291451 0.000399790 0.000476013 0.000810069 0.001062036 0.001288068 0.002075669 0.002897113 0.002999932 0.003263678 0.004120595 0.004912934 0.005178490 0.005697703 0.006657618 0.007378674 0.009746273 0.010231885 0.010721918 0.012826097 0.017822140 0.019059960 0.021089434 0.023685181 0.027575696 0.030464816 0.032963039 0.033941867 0.034344990 0.037102563 0.038913031 0.043230414 0.045307982 0.048103572 0.049681964 0.049815085 0.050304332 0.051606963 0.052089183 0.052831657 0.053772721 0.054022645 0.056891496 0.058373755 0.061091302 0.061507492 0.065982406 0.068878216 0.072285697 0.075852217 0.076958799 0.078059555 0.078275703 0.081599405 0.083981744 0.087702593 0.096015431 0.098651845 0.102675832 0.104963948 0.107851269 0.111212872 0.113511467 0.113773784 0.116756297 0.118684027 0.130872171 0.134783875 0.137348065 0.143969058 0.145067790 0.153512891 0.154503563 0.165779335 0.170454142 0.173398753 0.180021219 0.188570611 0.193090090 0.201770966 0.207659910 0.213270338 0.216533359 0.237400676 0.254460123 0.263347474 0.312162034 0.322885666 0.351078517 0.358304931 0.413804447 0.448951951 0.501728617 0.534460667 0.562064509 0.597123352 0.615516828 0.631708362 0.684078267 0.728806428 0.745244413 0.746196318 0.751070087 0.759271571 0.766652983 0.771178715 0.784917061 0.785486363 0.790921946 0.797346009 0.807013821 0.809067726 0.814192507 0.824471276 0.832653344 0.851059679 0.861464337 0.867867701 0.876458812 0.891834688 0.897699517 0.902527865 0.910953267 0.920686652 0.922198363 0.955257862 1.262357577 1.489920871</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">6</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.08596334" y3="1.10276367" z3="3.88813586">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.45766956" y3="1.44248079" z3="2.90257751">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.04677896" y3="1.46376136" z3="3.9987407">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.70194735" y3="1.59946449" z3="4.65860542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15322942" y3="-0.4204602" z3="3.99995407">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77367095" y3="-0.73254376" z3="4.98848072">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47476566" y3="-0.87198765" z3="3.24913698">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5583148" y3="-0.99953164" z3="3.79355562">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.50658696" y3="-2.10181658" z3="3.88305934">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86387893" y3="-0.78900152" z3="2.74790726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66105785" y3="-0.4816579" z3="4.73190022">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62725449" y3="-0.86684506" z3="4.36210577">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.70425383" y3="0.62278953" z3="4.69932804">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.55929922" y3="-0.95152327" z3="6.19168241">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37536804" y3="-0.78919954" z3="8.41007728">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25927566" y3="-1.37601077" z3="8.72183963">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26752985" y3="0.04856617" z3="9.13600212">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12209525" y3="-1.67643716" z3="8.53628356">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98492511" y3="-1.99599115" z3="9.59171659">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23425259" y3="-1.06532999" z3="8.27900388">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17385009" y3="-2.91214407" z3="7.63862302">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.30312814" y3="-2.57808415" z3="6.59336851">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09031439" y3="-3.48239742" z3="7.87261771">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.04676867" y3="-3.83202123" z3="7.7286505">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.14150656" y3="-4.73240091" z3="7.11346552">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16935886" y3="-4.19270477" z3="8.76930786">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35128518" y3="-3.18367442" z3="7.26305146">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.64407939" y3="-2.34379528" z3="7.91660851">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.1860662" y3="-3.90833116" z3="7.25626702">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.24156252" y3="-2.78006753" z3="6.23975064">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.34107564" y3="-1.85696102" z3="6.5673599">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.64024097" y3="-0.27964321" z3="7.02381391">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85936406" y3="0.32772665" z3="6.55616198">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.41617501" y3="1.10423778" z3="7.70714674">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.4211842" y3="0.38893633" z3="8.5502309">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21850937" y3="0.80163895" z3="7.0097484">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.68146896" y3="2.09987493" z3="8.11308891">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.05550432" y3="1.12903354" z3="7.01552751">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82747428" y3="0.1284238" z3="6.61259127">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.0746483" y3="1.82932025" z3="6.16251512">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.92353318" y3="1.54031585" z3="7.95057107">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.70399901" y3="0.74477238" z3="8.6832779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.23267676" y3="2.43699096" z3="8.53602385">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.63898774" y3="1.9389673" z3="7.23891764">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.6291302" y3="2.48838428" z3="6.14389102">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.76220063" y3="2.0325686" z3="7.92521838">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.086,1.1028,3.8881;-1.4577,1.4425,2.9026;-.0468,1.4638,3.9987;-1.7019,1.5995,4.6586;-1.1532,-.4205,4;-.7737,-.7325,4.9885;-.4748,-.872,3.2491;-2.5583,-.9995,3.7936;-2.5066,-2.1018,3.8831;-2.8639,-.789,2.7479;-3.6611,-.4817,4.7319;-4.6273,-.8668,4.3621;-3.7043,.6228,4.6993;-3.5593,-.9515,6.1917;-2.3754,-.7892,8.4101;-3.2593,-1.376,8.7218;-2.2675,.0486,9.136;-1.1221,-1.6764,8.5363;-.9849,-1.996,9.5917;-.2343,-1.0653,8.279;-1.1739,-2.9121,7.6386;-1.3031,-2.5781,6.5934;-2.0903,-3.4824,7.8726;.0468,-3.832,7.7287;-.1415,-4.7324,7.1135;.1694,-4.1927,8.7693;1.3513,-3.1837,7.2631;1.6441,-2.3438,7.9166;2.1861,-3.9083,7.2563;1.2416,-2.7801,6.2398;-4.3411,-1.857,6.5674;-2.6402,-.2796,7.0238;-1.8594,.3277,6.5562;-7.4162,1.1042,7.7071;-7.4212,.3889,8.5502;-8.2185,.8016,7.0097;-7.6815,2.0999,8.1131;-6.0555,1.129,7.0155;-5.8275,.1284,6.6126;-6.0746,1.8293,6.1625;-4.9235,1.5403,7.9506;-4.704,.7448,8.6833;-5.2327,2.437,8.536;-3.639,1.939,7.2389;-3.6291,2.4884,6.1439;-2.7622,2.0326,7.9252;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723671321239</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003087714649 0.000340802462 0.044646084634 0.008512660919</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002797491 -0.000279654 0.000026762 0.000234352 0.000290772 0.000382597 0.000481458 0.000776014 0.001047276 0.001184984 0.002028983 0.002847712 0.002986909 0.003254746 0.003982564 0.004826253 0.005171340 0.005694710 0.006593852 0.007363687 0.009737071 0.010224997 0.010713899 0.012822436 0.017811760 0.019057175 0.021088418 0.023684240 0.027577241 0.030467459 0.032963063 0.033940829 0.034348184 0.037107245 0.038915348 0.043230092 0.045309882 0.048104766 0.049681843 0.049814963 0.050304071 0.051606899 0.052089569 0.052831490 0.053772646 0.054022734 0.056894038 0.058373836 0.061098489 0.061507537 0.065982158 0.068888389 0.072286842 0.075856544 0.076974474 0.078065348 0.078277013 0.081609033 0.083984840 0.087739754 0.096015939 0.098652951 0.102691234 0.104969145 0.107851275 0.111213332 0.113512080 0.113773477 0.116756740 0.118684332 0.130874779 0.134788148 0.137348522 0.143983019 0.145070992 0.153522092 0.154503687 0.165797187 0.170457855 0.173415709 0.180031696 0.188571425 0.193096528 0.201776827 0.207741894 0.213271031 0.216593098 0.237417649 0.254459307 0.263355855 0.312161983 0.322894691 0.351079713 0.358370830 0.413804522 0.448951641 0.501731846 0.534481970 0.562068713 0.597126734 0.615633443 0.631721969 0.684078836 0.728818838 0.745247138 0.746206514 0.751078897 0.759272821 0.766740822 0.771188155 0.784920780 0.785488824 0.790922000 0.797348447 0.807014106 0.809099825 0.814226219 0.824473714 0.832653565 0.851059752 0.861497357 0.867868415 0.876480437 0.891853244 0.897718165 0.902534807 0.910963626 0.920686163 0.922217428 0.955359177 1.262435721 1.489979003</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">7</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.08419877" y3="1.10148292" z3="3.88477801">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.45700673" y3="1.44260118" z3="2.90012975">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.04482284" y3="1.46193887" z3="3.99478885">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.69839521" y3="1.59818454" z3="4.6563191">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15272667" y3="-0.42161685" z3="3.99645011">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.7738531" y3="-0.73368269" z3="4.98510966">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47488572" y3="-0.87309283" z3="3.24506401">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55843051" y3="-0.99959453" z3="3.79142654">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.50723317" y3="-2.10163221" z3="3.88285016">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.8644861" y3="-0.79045137" z3="2.74553253">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.65930133" y3="-0.48023113" z3="4.73095465">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62660893" y3="-0.86284181" z3="4.36157978">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.70102553" y3="0.62410582" z3="4.69558082">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.55872999" y3="-0.95280433" z3="6.19145018">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.36902083" y3="-0.80020961" z3="8.40768896">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25531811" y3="-1.38477358" z3="8.71734506">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26389904" y3="0.04057525" z3="9.13121971">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11710676" y3="-1.68840345" z3="8.54379263">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98533183" y3="-2.00705349" z3="9.60025045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22761917" y3="-1.07829633" z3="8.28973625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16760352" y3="-2.92346133" z3="7.64559622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.30144708" y3="-2.58711287" z3="6.60161049">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.08158782" y3="-3.49682018" z3="7.88179597">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.0554847" y3="-3.84031243" z3="7.73055752">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.13199189" y3="-4.73970115" z3="7.11359054">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.18168081" y3="-4.20314023" z3="8.77008968">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35703928" y3="-3.18737749" z3="7.26302542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6490712" y3="-2.3480443" z3="7.91762918">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.19382467" y3="-3.9097353" z3="7.25257585">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.24347601" y3="-2.78166392" z3="6.24096114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.35482132" y3="-1.85010601" z3="6.56619714">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62630823" y3="-0.3012226" z3="7.01721454">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.86117344" y3="0.33242439" z3="6.55703409">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.42145844" y3="1.10526746" z3="7.70690779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.4230576" y3="0.39192038" z3="8.55138786">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22125661" y3="0.79711952" z3="7.00971007">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.69190331" y3="2.10017311" z3="8.11037594">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.0612882" y3="1.13562103" z3="7.01558631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82528986" y3="0.13477163" z3="6.61754021">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.08513528" y3="1.83278946" z3="6.16010818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.93316289" y3="1.55652846" z3="7.95111167">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.69574533" y3="0.75656939" z3="8.67389882">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.25281226" y3="2.44246721" z3="8.5480824">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.65937191" y3="1.98361338" z3="7.24158169">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.64957577" y3="2.52236851" z3="6.1462899">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.76955438" y3="2.05331572" z3="7.91538245">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0842,1.1015,3.8848;-1.457,1.4426,2.9001;-.0448,1.4619,3.9948;-1.6984,1.5982,4.6563;-1.1527,-.4216,3.9965;-.7739,-.7337,4.9851;-.4749,-.8731,3.2451;-2.5584,-.9996,3.7914;-2.5072,-2.1016,3.8829;-2.8645,-.7905,2.7455;-3.6593,-.4802,4.731;-4.6266,-.8628,4.3616;-3.701,.6241,4.6956;-3.5587,-.9528,6.1915;-2.369,-.8002,8.4077;-3.2553,-1.3848,8.7173;-2.2639,.0406,9.1312;-1.1171,-1.6884,8.5438;-.9853,-2.0071,9.6003;-.2276,-1.0783,8.2897;-1.1676,-2.9235,7.6456;-1.3014,-2.5871,6.6016;-2.0816,-3.4968,7.8818;.0555,-3.8403,7.7306;-.132,-4.7397,7.1136;.1817,-4.2031,8.7701;1.357,-3.1874,7.263;1.6491,-2.348,7.9176;2.1938,-3.9097,7.2526;1.2435,-2.7817,6.241;-4.3548,-1.8501,6.5662;-2.6263,-.3012,7.0172;-1.8612,.3324,6.557;-7.4215,1.1053,7.7069;-7.4231,.3919,8.5514;-8.2213,.7971,7.0097;-7.6919,2.1002,8.1104;-6.0613,1.1356,7.0156;-5.8253,.1348,6.6175;-6.0851,1.8328,6.1601;-4.9332,1.5565,7.9511;-4.6957,.7566,8.6739;-5.2528,2.4425,8.5481;-3.6594,1.9836,7.2416;-3.6496,2.5224,6.1463;-2.7696,2.0533,7.9154;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723457750066</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.004168791584 0.000672450049 0.051360736508 0.008512611827</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002110830 0.000025633 0.000217046 0.000290576 0.000322427 0.000474442 0.000510941 0.000896157 0.001075084 0.001181678 0.002101243 0.002870668 0.002997734 0.003263085 0.004020740 0.004867905 0.005182329 0.005692854 0.006588276 0.007354879 0.009759257 0.010256960 0.010708458 0.012827612 0.017820315 0.019062574 0.021093547 0.023683571 0.027588722 0.030484578 0.032963735 0.033943000 0.034459952 0.037208586 0.038922709 0.043230160 0.045309151 0.048106306 0.049682746 0.049815265 0.050305861 0.051606749 0.052089417 0.052831335 0.053772921 0.054049587 0.056895270 0.058373817 0.061095918 0.061511877 0.065981316 0.068901087 0.072287069 0.075860417 0.076988762 0.078073485 0.078276908 0.081622923 0.083992859 0.087811630 0.096018426 0.098654124 0.102745461 0.104967546 0.107851201 0.111219255 0.113512306 0.113775220 0.116759757 0.118690028 0.130875389 0.134795221 0.137351584 0.143989975 0.145089150 0.153528953 0.154502614 0.165805214 0.170460077 0.173418402 0.180041242 0.188577713 0.193106233 0.201786730 0.207770765 0.213271483 0.216658298 0.237439536 0.254458427 0.263440556 0.312182753 0.322911071 0.351079453 0.358368116 0.413804522 0.448950790 0.501733655 0.534480069 0.562067936 0.597132735 0.615650651 0.631720990 0.684078022 0.729052597 0.745247055 0.746206242 0.751080691 0.759272813 0.766739052 0.771188038 0.784921175 0.785488580 0.790921933 0.797351283 0.807016339 0.809104701 0.814231172 0.824482692 0.832656336 0.851061467 0.861542078 0.867871022 0.876503046 0.891852858 0.897733303 0.902539883 0.910965904 0.920685787 0.922219613 0.955454353 1.263336546 1.490228929</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">8</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.08247271" y3="1.10114055" z3="3.88227712">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.45563048" y3="1.43944715" z3="2.89676388">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.04209774" y3="1.45980427" z3="3.98951608">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.69613782" y3="1.60044846" z3="4.65330323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15305794" y3="-0.42170819" z3="3.99730273">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77325995" y3="-0.73275527" z3="4.98616709">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47662011" y3="-0.87686551" z3="3.24676445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55988176" y3="-0.9973363" z3="3.7935449">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.51168888" y3="-2.099539" z3="3.88725293">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86533084" y3="-0.79007514" z3="2.747228">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66070597" y3="-0.47218203" z3="4.73040631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62836936" y3="-0.8543346" z3="4.3613441">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.69880738" y3="0.63278711" z3="4.69881476">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.55926957" y3="-0.94066156" z3="6.18972339">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37454515" y3="-0.78787807" z3="8.40778916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25969309" y3="-1.37430877" z3="8.71647818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26379676" y3="0.04470712" z3="9.13836715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12341897" y3="-1.68048806" z3="8.53457014">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.99132384" y3="-1.99855947" z3="9.59134429">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23186186" y3="-1.07331202" z3="8.28058132">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17158886" y3="-2.92044668" z3="7.64183815">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.30581199" y3="-2.59213204" z3="6.5952939">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.08314046" y3="-3.49608513" z3="7.88238086">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.05335912" y3="-3.83635385" z3="7.73164861">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.13348277" y3="-4.7381898" z3="7.11800207">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.17874595" y3="-4.19636393" z3="8.77231314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35685149" y3="-3.18754078" z3="7.2634366">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.65259155" y3="-2.34928555" z3="7.91772405">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.19109183" y3="-3.91297714" z3="7.25301782">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.24495387" y3="-2.7823925" z3="6.24100388">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.33594355" y3="-1.8477048" z3="6.56565133">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.6428703" y3="-0.26291503" z3="7.02599575">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85811183" y3="0.33430335" z3="6.55824594">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.42156652" y3="1.10141761" z3="7.70779899">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.42254993" y3="0.38861011" z3="8.55311684">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22087961" y3="0.79028233" z3="7.01020083">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.69557375" y3="2.09638669" z3="8.11016818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.06022209" y3="1.13345252" z3="7.01720591">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8303414" y3="0.13505171" z3="6.61035123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.08125838" y3="1.83640987" z3="6.16646288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.92771794" y3="1.54345774" z3="7.95230931">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.71120348" y3="0.74981462" z3="8.68665601">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.23519712" y3="2.44098692" z3="8.53555445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.64005965" y3="1.93225265" z3="7.23955727">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.63457421" y3="2.4876715" z3="6.14341959">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.7714986" y3="2.04441515" z3="7.92899546">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0825,1.1011,3.8823;-1.4556,1.4394,2.8968;-.0421,1.4598,3.9895;-1.6961,1.6004,4.6533;-1.1531,-.4217,3.9973;-.7733,-.7328,4.9862;-.4766,-.8769,3.2468;-2.5599,-.9973,3.7935;-2.5117,-2.0995,3.8873;-2.8653,-.7901,2.7472;-3.6607,-.4722,4.7304;-4.6284,-.8543,4.3613;-3.6988,.6328,4.6988;-3.5593,-.9407,6.1897;-2.3745,-.7879,8.4078;-3.2597,-1.3743,8.7165;-2.2638,.0447,9.1384;-1.1234,-1.6805,8.5346;-.9913,-1.9986,9.5913;-.2319,-1.0733,8.2806;-1.1716,-2.9204,7.6418;-1.3058,-2.5921,6.5953;-2.0831,-3.4961,7.8824;.0534,-3.8364,7.7316;-.1335,-4.7382,7.118;.1787,-4.1964,8.7723;1.3569,-3.1875,7.2634;1.6526,-2.3493,7.9177;2.1911,-3.913,7.253;1.245,-2.7824,6.241;-4.3359,-1.8477,6.5657;-2.6429,-.2629,7.026;-1.8581,.3343,6.5582;-7.4216,1.1014,7.7078;-7.4225,.3886,8.5531;-8.2209,.7903,7.0102;-7.6956,2.0964,8.1102;-6.0602,1.1335,7.0172;-5.8303,.1351,6.6104;-6.0813,1.8364,6.1665;-4.9277,1.5435,7.9523;-4.7112,.7498,8.6867;-5.2352,2.441,8.5356;-3.6401,1.9323,7.2396;-3.6346,2.4877,6.1434;-2.7715,2.0444,7.929;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723707732893</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.008509000210 0.001077920903 0.025984784705 0.008512620943</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.003153633 -0.000570593 0.000030112 0.000210639 0.000290896 0.000369697 0.000484599 0.000699199 0.000927007 0.001091413 0.002119883 0.002848767 0.003002459 0.003269808 0.004084419 0.005148239 0.005351002 0.005693422 0.007070466 0.007630757 0.009834225 0.010560674 0.011079026 0.012938595 0.018176796 0.019391308 0.021097219 0.023703977 0.027976848 0.030762913 0.032968414 0.033958958 0.035187942 0.038557852 0.039934902 0.043252586 0.045329545 0.048131486 0.049683035 0.049816431 0.050306676 0.051612156 0.052090845 0.052832459 0.053811433 0.054197481 0.056965303 0.058374535 0.061187774 0.061528719 0.065992617 0.069169443 0.072323994 0.075909907 0.077281206 0.078217707 0.078389426 0.081885223 0.084113662 0.089045244 0.096038486 0.098667749 0.103387438 0.104993850 0.107852581 0.111272575 0.113524827 0.113793232 0.116792552 0.118724980 0.130882409 0.134886568 0.137380181 0.144113334 0.145261718 0.153579521 0.154512943 0.165872175 0.170482273 0.173464677 0.180181996 0.188617171 0.193220744 0.201927045 0.208032025 0.213273726 0.217265259 0.237594206 0.254494033 0.263695817 0.312284616 0.322978284 0.351092248 0.358534150 0.413806653 0.448952353 0.501734639 0.534602845 0.562075465 0.597138099 0.615652453 0.631723827 0.684097936 0.731402173 0.745250609 0.746210693 0.751109863 0.759273894 0.766762672 0.771188530 0.784939139 0.785490320 0.790932849 0.797407750 0.807025292 0.809104966 0.814450367 0.824598278 0.832696197 0.851087076 0.862272270 0.867875351 0.876573466 0.891859684 0.898090077 0.902701496 0.911019382 0.920689894 0.922221201 0.957548938 1.271176216 1.490773539</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">9</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.09308836" y3="1.10689294" z3="3.89569468">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.46356575" y3="1.4467258" z3="2.90972104">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.05561197" y3="1.47165211" z3="4.00940587">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.71380518" y3="1.59959518" z3="4.66527513">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15371355" y3="-0.41679841" z3="4.00378115">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77146072" y3="-0.7301461" z3="4.99095588">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47405525" y3="-0.86424135" z3="3.25158829">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55628962" y3="-1.00143831" z3="3.79646294">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.5004313" y3="-2.10352585" z3="3.88686587">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86146675" y3="-0.79348076" z3="2.75025262">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66344277" y3="-0.48631936" z3="4.73131256">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62631764" y3="-0.87991284" z3="4.36171683">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.71269308" y3="0.61815065" z3="4.69732567">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.56043194" y3="-0.94761996" z3="6.19243532">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37898643" y3="-0.78116108" z3="8.40984956">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26331414" y3="-1.36707562" z3="8.72160446">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26621521" y3="0.05217674" z3="9.13940654">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12776306" y3="-1.67382552" z3="8.53223123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.99616449" y3="-1.99683333" z3="9.58754571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23612231" y3="-1.06526245" z3="8.28134343">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17588189" y3="-2.90954369" z3="7.63344632">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.3025797" y3="-2.57668873" z3="6.58744155">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09119514" y3="-3.48216231" z3="7.86594579">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.04520748" y3="-3.83026196" z3="7.7250528">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.14278362" y3="-4.72967427" z3="7.10817122">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16575312" y3="-4.19362129" z3="8.7651159">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35214853" y3="-3.18441159" z3="7.26265848">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.64605802" y3="-2.34596222" z3="7.91752172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.18519795" y3="-3.91120764" z3="7.25681964">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.24575684" y3="-2.78010377" z3="6.23933207">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.33264429" y3="-1.85651318" z3="6.57277031">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.65031834" y3="-0.25830602" z3="7.02792308">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85711816" y3="0.32584626" z3="6.55446123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.41349225" y3="1.10575959" z3="7.70730363">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.42000547" y3="0.39266475" z3="8.55230157">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2149378" y3="0.80118714" z3="7.00935586">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.67974204" y3="2.10245031" z3="8.11012599">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.05215174" y3="1.12783006" z3="7.01699498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8278145" y3="0.12658641" z3="6.61403569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.06907862" y3="1.82723251" z3="6.1631498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.91709276" y3="1.53704922" z3="7.94926663">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.70865548" y3="0.74937153" z3="8.69311061">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.21793218" y3="2.44396161" z3="8.52156298">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.62627435" y3="1.90907672" z3="7.23154036">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.62093752" y3="2.46168672" z3="6.13344587">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.75851537" y3="2.03065756" z3="7.92425939">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0931,1.1069,3.8957;-1.4636,1.4467,2.9097;-.0556,1.4717,4.0094;-1.7138,1.5996,4.6653;-1.1537,-.4168,4.0038;-.7715,-.7301,4.991;-.4741,-.8642,3.2516;-2.5563,-1.0014,3.7965;-2.5004,-2.1035,3.8869;-2.8615,-.7935,2.7503;-3.6634,-.4863,4.7313;-4.6263,-.8799,4.3617;-3.7127,.6182,4.6973;-3.5604,-.9476,6.1924;-2.379,-.7812,8.4098;-3.2633,-1.3671,8.7216;-2.2662,.0522,9.1394;-1.1278,-1.6738,8.5322;-.9962,-1.9968,9.5875;-.2361,-1.0653,8.2813;-1.1759,-2.9095,7.6334;-1.3026,-2.5767,6.5874;-2.0912,-3.4822,7.8659;.0452,-3.8303,7.7251;-.1428,-4.7297,7.1082;.1658,-4.1936,8.7651;1.3521,-3.1844,7.2627;1.6461,-2.346,7.9175;2.1852,-3.9112,7.2568;1.2458,-2.7801,6.2393;-4.3326,-1.8565,6.5728;-2.6503,-.2583,7.0279;-1.8571,.3258,6.5545;-7.4135,1.1058,7.7073;-7.42,.3927,8.5523;-8.2149,.8012,7.0094;-7.6797,2.1025,8.1101;-6.0522,1.1278,7.017;-5.8278,.1266,6.614;-6.0691,1.8272,6.1631;-4.9171,1.537,7.9493;-4.7087,.7494,8.6931;-5.2179,2.444,8.5216;-3.6263,1.9091,7.2315;-3.6209,2.4617,6.1334;-2.7585,2.0307,7.9243;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723794253459</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003196856249 0.000452325850 0.039955408661 0.008512651210</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.003634032 -0.000878257 0.000049269 0.000213644 0.000290990 0.000366942 0.000504121 0.000718757 0.000921756 0.001110028 0.002068021 0.002788070 0.003005287 0.003260340 0.003901431 0.005065504 0.005214567 0.005690849 0.006861032 0.007488306 0.009779346 0.010486422 0.010800205 0.012893823 0.018127874 0.019303729 0.021097853 0.023721059 0.027930610 0.030746177 0.032968289 0.033955001 0.035128888 0.038492184 0.039560838 0.043245342 0.045314627 0.048135714 0.049681784 0.049817396 0.050306919 0.051612515 0.052091072 0.052836109 0.053799531 0.054238766 0.056967440 0.058373974 0.061192678 0.061525630 0.065998111 0.069171985 0.072333044 0.075909628 0.077277954 0.078217297 0.078396665 0.081887884 0.084128367 0.089030598 0.096038605 0.098666341 0.103350460 0.105002075 0.107852150 0.111267431 0.113526485 0.113790185 0.116793262 0.118724495 0.130880741 0.134884902 0.137380293 0.144126850 0.145257140 0.153573433 0.154512298 0.165861508 0.170481123 0.173459903 0.180181599 0.188609687 0.193220523 0.201930529 0.208016896 0.213272358 0.217244854 0.237592700 0.254493718 0.263641518 0.312279042 0.322974138 0.351090580 0.358409659 0.413805872 0.448952018 0.501729422 0.534549485 0.562075801 0.597130667 0.615566885 0.631722795 0.684094334 0.731171879 0.745248163 0.746208310 0.751108536 0.759273663 0.766716918 0.771186976 0.784937880 0.785490240 0.790924592 0.797401745 0.807025023 0.809090435 0.814434240 0.824590149 0.832685050 0.851082473 0.862203699 0.867873491 0.876561004 0.891856103 0.898055939 0.902683369 0.911013730 0.920685029 0.922220587 0.957401022 1.270427072 1.490683959</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">10</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.09645708" y3="1.10625688" z3="3.9051122">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.46361631" y3="1.45201329" z3="2.91995478">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.06000968" y3="1.47201861" z3="4.0254098">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.72056717" y3="1.59386569" z3="4.67519453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15478283" y3="-0.41819081" z3="4.0041571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77323413" y3="-0.73648487" z3="4.98990829">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47347726" y3="-0.8594334" z3="3.24966073">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55584783" y3="-1.00539426" z3="3.79333988">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.49588505" y3="-2.1077806" z3="3.87687247">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86142028" y3="-0.79212866" z3="2.74821757">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66584545" y3="-0.4990975" z3="4.73023699">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62598008" y3="-0.89939959" z3="4.36071838">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.72278554" y3="0.60506917" z3="4.69248697">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.56368891" y3="-0.95756285" z3="6.1937877">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37549537" y3="-0.79052405" z3="8.40959228">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25870909" y3="-1.37822813" z3="8.7215744">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26870651" y3="0.04790666" z3="9.1342094">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12247777" y3="-1.6795556" z3="8.54134939">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.99391209" y3="-2.00423092" z3="9.59681959">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23061704" y3="-1.0694055" z3="8.29461798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17066982" y3="-2.91092119" z3="7.6372138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.29460438" y3="-2.56855512" z3="6.59406026">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.08916918" y3="-3.48097235" z3="7.8635317">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.04791782" y3="-3.83419404" z3="7.72266886">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.14184605" y3="-4.72959833" z3="7.10037555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.17023749" y3="-4.20363258" z3="8.76045114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35208309" y3="-3.1831067" z3="7.26049304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6393952" y3="-2.34138362" z3="7.91403916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.18979729" y3="-3.90440161" z3="7.25639463">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.24299309" y3="-2.78069343" z3="6.23667495">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.34608729" y3="-1.85817521" z3="6.57696284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.64166619" y3="-0.27999362" z3="7.02195358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85982807" y3="0.31441811" z3="6.55124573">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.41112043" y3="1.11071095" z3="7.70440373">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.4220932" y3="0.39227428" z3="8.54452444">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21347382" y3="0.81574687" z3="7.00398822">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.67132615" y3="2.10627655" z3="8.11358442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.04920302" y3="1.13039566" z3="7.01576294">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.81941226" y3="0.12595396" z3="6.62294262">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.06672434" y3="1.82242802" z3="6.15590884">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.91822442" y3="1.5501046" z3="7.9486108">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.68969095" y3="0.75640526" z3="8.68000031">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.23241458" y3="2.44381711" z3="8.53576989">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.63759914" y3="1.94903213" z3="7.23134642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.63681492" y3="2.49643404" z3="6.1324644">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.76090914" y3="2.05237289" z3="7.90929552">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0965,1.1063,3.9051;-1.4636,1.452,2.92;-.06,1.472,4.0254;-1.7206,1.5939,4.6752;-1.1548,-.4182,4.0042;-.7732,-.7365,4.9899;-.4735,-.8594,3.2497;-2.5558,-1.0054,3.7933;-2.4959,-2.1078,3.8769;-2.8614,-.7921,2.7482;-3.6658,-.4991,4.7302;-4.626,-.8994,4.3607;-3.7228,.6051,4.6925;-3.5637,-.9576,6.1938;-2.3755,-.7905,8.4096;-3.2587,-1.3782,8.7216;-2.2687,.0479,9.1342;-1.1225,-1.6796,8.5413;-.9939,-2.0042,9.5968;-.2306,-1.0694,8.2946;-1.1707,-2.9109,7.6372;-1.2946,-2.5686,6.5941;-2.0892,-3.481,7.8635;.0479,-3.8342,7.7227;-.1418,-4.7296,7.1004;.1702,-4.2036,8.7605;1.3521,-3.1831,7.2605;1.6394,-2.3414,7.914;2.1898,-3.9044,7.2564;1.243,-2.7807,6.2367;-4.3461,-1.8582,6.577;-2.6417,-.28,7.022;-1.8598,.3144,6.5512;-7.4111,1.1107,7.7044;-7.4221,.3923,8.5445;-8.2135,.8157,7.004;-7.6713,2.1063,8.1136;-6.0492,1.1304,7.0158;-5.8194,.126,6.6229;-6.0667,1.8224,6.1559;-4.9182,1.5501,7.9486;-4.6897,.7564,8.68;-5.2324,2.4438,8.5358;-3.6376,1.949,7.2313;-3.6368,2.4964,6.1325;-2.7609,2.0524,7.9093;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723448937290</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.010659634479 0.001459868517 0.044286504187 0.008512361574</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002896079 -0.001649014 0.000052678 0.000203100 0.000290848 0.000386929 0.000508581 0.000696395 0.000891283 0.001100597 0.002271642 0.002894093 0.003047922 0.003293729 0.004097245 0.005133327 0.005575843 0.005726838 0.006994836 0.007462537 0.009755639 0.010444729 0.010751943 0.012896524 0.018108939 0.019317272 0.021097526 0.023719125 0.027956519 0.030751682 0.032968295 0.033955057 0.035271739 0.038585464 0.040643887 0.043249995 0.045327089 0.048142481 0.049683563 0.049817688 0.050315698 0.051612602 0.052090917 0.052837213 0.053868453 0.054225941 0.056976372 0.058374800 0.061279116 0.061538073 0.065999021 0.069240111 0.072335471 0.075925096 0.077331642 0.078229159 0.078470625 0.081971043 0.084147886 0.089566098 0.096053456 0.098671016 0.103529507 0.105011886 0.107853147 0.111279345 0.113535091 0.113796735 0.116803668 0.118726285 0.130880454 0.134909004 0.137390099 0.144147881 0.145357655 0.153578670 0.154515246 0.165881802 0.170492317 0.173486363 0.180250849 0.188612279 0.193277918 0.202012593 0.208072398 0.213273720 0.217376329 0.237610338 0.254502932 0.263690146 0.312323382 0.323028611 0.351098914 0.358423272 0.413807125 0.448951502 0.501742181 0.534737600 0.562085049 0.597138064 0.615654876 0.631735793 0.684130718 0.732167198 0.745254644 0.746218337 0.751157888 0.759276656 0.766773829 0.771186947 0.784956248 0.785494891 0.790957969 0.797454920 0.807025028 0.809098089 0.814713863 0.824653181 0.832709662 0.851094086 0.862793166 0.867883624 0.876560177 0.891894038 0.898367411 0.902863220 0.911080621 0.920696208 0.922226724 0.959575468 1.274252171 1.490801952</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">11</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.10059502" y3="1.10853234" z3="3.91014207">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.46618268" y3="1.45348102" z3="2.92416886">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.06515527" y3="1.47627038" z3="4.03296391">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.72783635" y3="1.59434913" z3="4.67874967">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15604047" y3="-0.41612544" z3="4.00780461">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77246165" y3="-0.73502582" z3="4.99268049">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47488314" y3="-0.85615886" z3="3.25257005">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55649591" y3="-1.0045307" z3="3.79670392">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.49696956" y3="-2.10670329" z3="3.88353176">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86133076" y3="-0.79423764" z3="2.75096393">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66675088" y3="-0.49615064" z3="4.73142162">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62669091" y3="-0.89931776" z3="4.36395477">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.72583209" y3="0.60738472" z3="4.69312571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.55922119" y3="-0.95196162" z3="6.1940442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.38023196" y3="-0.7800306" z3="8.41014265">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26578346" y3="-1.36386937" z3="8.721918">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26614118" y3="0.05352412" z3="9.13948794">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.13058615" y3="-1.67455747" z3="8.53299472">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-1.00396206" y3="-2.00073586" z3="9.58749883">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23779463" y3="-1.06585115" z3="8.28784183">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17588563" y3="-2.90765769" z3="7.63025901">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.30126084" y3="-2.57235675" z3="6.58485969">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09095809" y3="-3.48188509" z3="7.85953439">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.04577501" y3="-3.82792552" z3="7.72080793">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.14198927" y3="-4.72626655" z3="7.10241012">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16616365" y3="-4.1931675" z3="8.76014291">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35313104" y3="-3.18191373" z3="7.25957701">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6457325" y3="-2.34224883" z3="7.91343449">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.18653346" y3="-3.90832569" z3="7.25639427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.24840934" y3="-2.77958286" z3="6.23531093">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.32932824" y3="-1.86118648" z3="6.57787594">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.65154765" y3="-0.25929861" z3="7.02800913">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85531975" y3="0.32509541" z3="6.55224283">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.41011747" y3="1.11021002" z3="7.70506787">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.4214154" y3="0.39505942" z3="8.5481427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21091077" y3="0.8106931" z3="7.00464527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.67334302" y3="2.10668675" z3="8.10970907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.04786699" y3="1.12851427" z3="7.01675511">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82476986" y3="0.12642438" z3="6.61605951">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.06242989" y3="1.825768" z3="6.16138413">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.91253436" y3="1.53925007" z3="7.9472739">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.70612766" y3="0.7558053" z3="8.69629142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.20987877" y3="2.45132554" z3="8.51359775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.62260487" y3="1.90529728" z3="7.22368679">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.61852762" y3="2.45214754" z3="6.12432037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.75195232" y3="2.03170895" z3="7.91738618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.1006,1.1085,3.9101;-1.4662,1.4535,2.9242;-.0652,1.4763,4.033;-1.7278,1.5943,4.6787;-1.156,-.4161,4.0078;-.7725,-.735,4.9927;-.4749,-.8562,3.2526;-2.5565,-1.0045,3.7967;-2.497,-2.1067,3.8835;-2.8613,-.7942,2.751;-3.6668,-.4962,4.7314;-4.6267,-.8993,4.364;-3.7258,.6074,4.6931;-3.5592,-.952,6.194;-2.3802,-.78,8.4101;-3.2658,-1.3639,8.7219;-2.2661,.0535,9.1395;-1.1306,-1.6746,8.533;-1.004,-2.0007,9.5875;-.2378,-1.0659,8.2878;-1.1759,-2.9077,7.6303;-1.3013,-2.5724,6.5849;-2.091,-3.4819,7.8595;.0458,-3.8279,7.7208;-.142,-4.7263,7.1024;.1662,-4.1932,8.7601;1.3531,-3.1819,7.2596;1.6457,-2.3422,7.9134;2.1865,-3.9083,7.2564;1.2484,-2.7796,6.2353;-4.3293,-1.8612,6.5779;-2.6515,-.2593,7.028;-1.8553,.3251,6.5522;-7.4101,1.1102,7.7051;-7.4214,.3951,8.5481;-8.2109,.8107,7.0046;-7.6733,2.1067,8.1097;-6.0479,1.1285,7.0168;-5.8248,.1264,6.6161;-6.0624,1.8258,6.1614;-4.9125,1.5393,7.9473;-4.7061,.7558,8.6963;-5.2099,2.4513,8.5136;-3.6226,1.9053,7.2237;-3.6185,2.4521,6.1243;-2.752,2.0317,7.9174;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723750629241</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.005089399346 0.000763049084 0.031653461038 0.008512323268</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.003188054 -0.000225252 0.000055911 0.000247464 0.000300406 0.000381057 0.000482377 0.000595532 0.000916782 0.001109800 0.002346422 0.002924894 0.003058418 0.003293133 0.003968936 0.005095607 0.005467809 0.005787044 0.007376724 0.007409275 0.009728533 0.010638633 0.010739831 0.012902625 0.018188771 0.019310657 0.021101047 0.023748264 0.027953673 0.030749741 0.032968613 0.033954116 0.035301207 0.038585587 0.041028768 0.043250506 0.045328689 0.048142824 0.049684325 0.049817804 0.050329734 0.051612535 0.052092115 0.052837271 0.053929815 0.054245516 0.056976520 0.058377379 0.061317769 0.061540975 0.066000065 0.069256431 0.072339242 0.075928313 0.077344314 0.078238820 0.078484932 0.082010651 0.084160111 0.089810868 0.096061867 0.098671107 0.103582743 0.105012706 0.107856176 0.111281117 0.113543903 0.113801057 0.116807815 0.118728340 0.130880380 0.134916733 0.137395694 0.144153463 0.145436577 0.153586855 0.154516436 0.165891996 0.170502667 0.173500246 0.180313359 0.188636055 0.193305603 0.202044397 0.208089850 0.213275084 0.217400284 0.237613082 0.254507716 0.263762843 0.312350753 0.323058448 0.351099911 0.358441874 0.413807291 0.448952369 0.501748941 0.534894613 0.562089198 0.597147520 0.615823266 0.631742039 0.684193959 0.732907517 0.745270476 0.746232958 0.751218639 0.759277617 0.766859974 0.771187091 0.784981623 0.785499562 0.790979092 0.797507660 0.807026950 0.809126912 0.814998302 0.824726605 0.832725422 0.851101271 0.863354592 0.867892036 0.876564875 0.891917264 0.898632609 0.903070141 0.911165102 0.920705444 0.922232203 0.962110100 1.277574433 1.490829652</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">12</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.08787032" y3="1.10279642" z3="3.88942917">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.45828164" y3="1.44194905" z3="2.90320052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.04900168" y3="1.464208" z3="4.00131045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.70591002" y3="1.59900721" z3="4.65880999">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15414706" y3="-0.42052836" z3="4.00037501">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.7736901" y3="-0.73353144" z3="4.98839164">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47591851" y3="-0.87190428" z3="3.24923333">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55911843" y3="-0.99940987" z3="3.79346002">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.50829011" y3="-2.10161702" z3="3.88451056">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86394241" y3="-0.79037833" z3="2.7474631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66248093" y3="-0.47936895" z3="4.72981724">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6279325" y3="-0.86809318" z3="4.361501">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.70708269" y3="0.62502165" z3="4.69661326">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.55731471" y3="-0.94483425" z3="6.18940948">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37949945" y3="-0.78122228" z3="8.40816992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26415012" y3="-1.36777297" z3="8.71771872">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26843384" y3="0.05120612" z3="9.1392382">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12791121" y3="-1.67256697" z3="8.53074168">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.99458857" y3="-1.99203965" z3="9.58665447">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23784822" y3="-1.06350885" z3="8.27652857">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17580949" y3="-2.9112143" z3="7.6360218">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.30655697" y3="-2.58280018" z3="6.58903989">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.08886971" y3="-3.48552204" z3="7.87336099">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.04750977" y3="-3.82895742" z3="7.72841003">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.13914573" y3="-4.72996232" z3="7.11353985">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16919354" y3="-4.18994101" z3="8.76913514">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35349419" y3="-3.18217593" z3="7.2644029">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.64776514" y3="-2.34331173" z3="7.91855794">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.1868522" y3="-3.90860566" z3="7.25830457">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.24615677" y3="-2.77853372" z3="6.24093776">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.32629217" y3="-1.85760701" z3="6.56625363">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.64966649" y3="-0.25716282" z3="7.02711796">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85732989" y3="0.33454726" z3="6.5554388">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.41657659" y3="1.10679256" z3="7.70766402">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.4267376" y3="0.39052372" z3="8.54959521">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2171644" y3="0.80749391" z3="7.00730802">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.68084713" y3="2.10202175" z3="8.11425236">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.05439589" y3="1.12834506" z3="7.01924792">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83191008" y3="0.12883939" z3="6.61146646">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.06794751" y3="1.83171806" z3="6.16895704">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.91954697" y3="1.53106759" z3="7.95388197">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.71334741" y3="0.73990416" z3="8.69519469">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.21826329" y3="2.43706582" z3="8.52950733">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.62860223" y3="1.90528299" z3="7.23579771">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.62267422" y3="2.46068968" z3="6.14049907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.75984415" y3="2.02454637" z3="7.93141885">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0879,1.1028,3.8894;-1.4583,1.4419,2.9032;-.049,1.4642,4.0013;-1.7059,1.599,4.6588;-1.1541,-.4205,4.0004;-.7737,-.7335,4.9884;-.4759,-.8719,3.2492;-2.5591,-.9994,3.7935;-2.5083,-2.1016,3.8845;-2.8639,-.7904,2.7475;-3.6625,-.4794,4.7298;-4.6279,-.8681,4.3615;-3.7071,.625,4.6966;-3.5573,-.9448,6.1894;-2.3795,-.7812,8.4082;-3.2642,-1.3678,8.7177;-2.2684,.0512,9.1392;-1.1279,-1.6726,8.5307;-.9946,-1.992,9.5867;-.2378,-1.0635,8.2765;-1.1758,-2.9112,7.636;-1.3066,-2.5828,6.589;-2.0889,-3.4855,7.8734;.0475,-3.829,7.7284;-.1391,-4.73,7.1135;.1692,-4.1899,8.7691;1.3535,-3.1822,7.2644;1.6478,-2.3433,7.9186;2.1869,-3.9086,7.2583;1.2462,-2.7785,6.2409;-4.3263,-1.8576,6.5663;-2.6497,-.2572,7.0271;-1.8573,.3345,6.5554;-7.4166,1.1068,7.7077;-7.4267,.3905,8.5496;-8.2172,.8075,7.0073;-7.6808,2.102,8.1143;-6.0544,1.1283,7.0192;-5.8319,.1288,6.6115;-6.0679,1.8317,6.169;-4.9195,1.5311,7.9539;-4.7133,.7399,8.6952;-5.2183,2.4371,8.5295;-3.6286,1.9053,7.2358;-3.6227,2.4607,6.1405;-2.7598,2.0245,7.9314;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723839827982</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003071261501 0.000517980267 0.031204209512 0.008512770306</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.003494745 -0.000090161 0.000140828 0.000245629 0.000294749 0.000376203 0.000492003 0.000905416 0.001095392 0.001156926 0.002349573 0.002945618 0.003073113 0.003310203 0.004114203 0.005136694 0.005464651 0.005781292 0.007307642 0.007455262 0.009766391 0.010499090 0.010793988 0.012896807 0.018252793 0.019342753 0.021101381 0.023720191 0.027975162 0.030749822 0.032968241 0.033956258 0.035341301 0.038599619 0.041618514 0.043268094 0.045346524 0.048140918 0.049684280 0.049817638 0.050339963 0.051611677 0.052090571 0.052836971 0.053937874 0.054193324 0.056976905 0.058380302 0.061338508 0.061544114 0.066013564 0.069280805 0.072344605 0.075930369 0.077365603 0.078246193 0.078510134 0.082054475 0.084193113 0.090049357 0.096065427 0.098672925 0.103643325 0.105012309 0.107865539 0.111285434 0.113553087 0.113803107 0.116813422 0.118728439 0.130880399 0.134924919 0.137398598 0.144154878 0.145479376 0.153592878 0.154519345 0.165904078 0.170512848 0.173513329 0.180369448 0.188620672 0.193319881 0.202099887 0.208121537 0.213276129 0.217443483 0.237608199 0.254517974 0.263796595 0.312376062 0.323074132 0.351101061 0.358632904 0.413810286 0.448952152 0.501749350 0.534955431 0.562091675 0.597149792 0.615886401 0.631749964 0.684267239 0.733390201 0.745287605 0.746245745 0.751277745 0.759278228 0.766891485 0.771187731 0.785008139 0.785510186 0.790999220 0.797549088 0.807030231 0.809156681 0.815284520 0.824795735 0.832731773 0.851104756 0.863829055 0.867898016 0.876565404 0.891934668 0.898834457 0.903272609 0.911246294 0.920709116 0.922238796 0.964670095 1.280225052 1.490914160</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">13</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.08240153" y3="1.10478444" z3="3.87273514">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.46073044" y3="1.43682213" z3="2.88698353">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.04220057" y3="1.4660485" z3="3.97308046">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.69318414" y3="1.60714953" z3="4.64382816">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15025126" y3="-0.41751803" z3="3.99662929">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.76990435" y3="-0.72215148" z3="4.98729221">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47314112" y3="-0.87568416" z3="3.24856871">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55620938" y3="-0.99613688" z3="3.79570663">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.50661775" y3="-2.09780125" z3="3.8943387">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86202748" y3="-0.79365255" z3="2.74854421">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.65676816" y3="-0.4691509" z3="4.73141025">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6248771" y3="-0.85001806" z3="4.36196677">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.69409255" y3="0.63551549" z3="4.69831227">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.55493842" y3="-0.93933785" z3="6.19048242">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37306382" y3="-0.78536258" z3="8.4084017">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25917653" y3="-1.37028543" z3="8.71730686">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26196397" y3="0.0478777" z3="9.13889647">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12295228" y3="-1.67854259" z3="8.53379756">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98916609" y3="-1.99598797" z3="9.59023996">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23215883" y3="-1.07155073" z3="8.27706049">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17469799" y3="-2.91834082" z3="7.64105393">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.30703255" y3="-2.59037024" z3="6.59416148">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.08839001" y3="-3.49059983" z3="7.88074766">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.04698972" y3="-3.83805463" z3="7.73228792">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.14178459" y3="-4.7388876" z3="7.11776735">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16940999" y3="-4.19892257" z3="8.77295138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35326446" y3="-3.19318363" z3="7.26668741">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.65140382" y3="-2.35712516" z3="7.92275424">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.18477136" y3="-3.92166987" z3="7.2557963">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.24387826" y3="-2.78588657" z3="6.24488827">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.33312964" y3="-1.84766054" z3="6.5644661">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63924896" y3="-0.26595109" z3="7.02563221">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85722428" y3="0.34315512" z3="6.5594582">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.42106641" y3="1.09562861" z3="7.71056573">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.4187073" y3="0.38566998" z3="8.55823575">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21998809" y3="0.77979518" z3="7.01502647">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.6972948" y3="2.09086211" z3="8.11001524">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.06083464" y3="1.12937685" z3="7.01850453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82945893" y3="0.13129562" z3="6.61158397">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.08335801" y3="1.83250841" z3="6.16789933">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.92896615" y3="1.54155776" z3="7.95318152">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.71113217" y3="0.7480338" z3="8.68844268">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.23695493" y3="2.44012591" z3="8.53547379">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.64356372" y3="1.9364872" z3="7.23993742">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.63558087" y3="2.48638994" z3="6.14483756">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.76944661" y3="2.04120495" z3="7.92995004">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0824,1.1048,3.8727;-1.4607,1.4368,2.887;-.0422,1.466,3.9731;-1.6932,1.6071,4.6438;-1.1503,-.4175,3.9966;-.7699,-.7222,4.9873;-.4731,-.8757,3.2486;-2.5562,-.9961,3.7957;-2.5066,-2.0978,3.8943;-2.862,-.7937,2.7485;-3.6568,-.4692,4.7314;-4.6249,-.85,4.362;-3.6941,.6355,4.6983;-3.5549,-.9393,6.1905;-2.3731,-.7854,8.4084;-3.2592,-1.3703,8.7173;-2.262,.0479,9.1389;-1.123,-1.6785,8.5338;-.9892,-1.996,9.5902;-.2322,-1.0716,8.2771;-1.1747,-2.9183,7.6411;-1.307,-2.5904,6.5942;-2.0884,-3.4906,7.8807;.047,-3.8381,7.7323;-.1418,-4.7389,7.1178;.1694,-4.1989,8.773;1.3533,-3.1932,7.2667;1.6514,-2.3571,7.9228;2.1848,-3.9217,7.2558;1.2439,-2.7859,6.2449;-4.3331,-1.8477,6.5645;-2.6392,-.266,7.0256;-1.8572,.3432,6.5595;-7.4211,1.0956,7.7106;-7.4187,.3857,8.5582;-8.22,.7798,7.015;-7.6973,2.0909,8.11;-6.0608,1.1294,7.0185;-5.8295,.1313,6.6116;-6.0834,1.8325,6.1679;-4.929,1.5416,7.9532;-4.7111,.748,8.6884;-5.237,2.4401,8.5355;-3.6436,1.9365,7.2399;-3.6356,2.4864,6.1448;-2.7694,2.0412,7.93;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723755796830</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002775980070 0.000438055794 0.024942749197 0.008512873278</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.005099783 -0.000669208 0.000131045 0.000280598 0.000305430 0.000450882 0.000481835 0.000790550 0.001000271 0.001152475 0.002334659 0.002964854 0.003024898 0.003299331 0.004055499 0.005135627 0.005592381 0.005810661 0.007444073 0.007588434 0.009697405 0.010565732 0.010809727 0.012904700 0.018272439 0.019336225 0.021099985 0.023736231 0.027971615 0.030742757 0.032968199 0.033955002 0.035369787 0.038603245 0.042227227 0.043290147 0.045381833 0.048134462 0.049684008 0.049817898 0.050348869 0.051609998 0.052090908 0.052836570 0.053968195 0.054153465 0.056972237 0.058382300 0.061358246 0.061549537 0.066011823 0.069297587 0.072344372 0.075932181 0.077377091 0.078248570 0.078548240 0.082093459 0.084196050 0.090313094 0.096071734 0.098672109 0.103735802 0.105013551 0.107872526 0.111290631 0.113558573 0.113816361 0.116824395 0.118730149 0.130880836 0.134938036 0.137402569 0.144158187 0.145536215 0.153596869 0.154519575 0.165923050 0.170525779 0.173537232 0.180432537 0.188610254 0.193344882 0.202120612 0.208164249 0.213273436 0.217508979 0.237613490 0.254516145 0.263832501 0.312391180 0.323090479 0.351090878 0.358613200 0.413811408 0.448952424 0.501746490 0.535030450 0.562090705 0.597149841 0.615928591 0.631756377 0.684316589 0.733738461 0.745309262 0.746256014 0.751330920 0.759279368 0.766942507 0.771187386 0.785036705 0.785516561 0.791003656 0.797593622 0.807029417 0.809137084 0.815488684 0.824863651 0.832729419 0.851109529 0.864241347 0.867895742 0.876563916 0.891937418 0.899011548 0.903472132 0.911303759 0.920710797 0.922235629 0.967119989 1.282855710 1.490895898</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">14</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.07401879" y3="1.09319424" z3="3.88404335">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.44507484" y3="1.43511862" z3="2.89900065">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.03126645" y3="1.44477183" z3="3.99165879">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.68388867" y3="1.59617886" z3="4.6552847">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15530097" y3="-0.42926854" z3="3.99801119">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77798164" y3="-0.74359502" z3="4.98673312">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48195106" y3="-0.88812259" z3="3.24698716">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5661213" y3="-0.9949186" z3="3.79361894">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.5251884" y3="-2.09748499" z3="3.8851926">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87083896" y3="-0.7832032" z3="2.74801428">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66179395" y3="-0.46528942" z3="4.73342946">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6327928" y3="-0.83918005" z3="4.36417116">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.69312562" y3="0.63957314" z3="4.70292357">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.56046295" y3="-0.94076327" z3="6.19155172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37502138" y3="-0.79576236" z3="8.40895213">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26039446" y3="-1.38333245" z3="8.71502045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26822718" y3="0.03717823" z3="9.1407598">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12199046" y3="-1.68448012" z3="8.53720068">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98794168" y3="-1.99991907" z3="9.59419771">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.2333082" y3="-1.07450879" z3="8.28031866">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16800317" y3="-2.92569077" z3="7.64621034">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.30859422" y3="-2.59995231" z3="6.59957567">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.0755537" y3="-3.50566594" z3="7.89171471">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.06210857" y3="-3.83503784" z3="7.73293824">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.12297518" y3="-4.73985276" z3="7.12316514">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.19435274" y3="-4.19094075" z3="8.77426369">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.36034377" y3="-3.18134888" z3="7.25633713">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6563347" y3="-2.34060912" z3="7.90732306">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.19761233" y3="-3.90332461" z3="7.2427136">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.24113809" y3="-2.77858426" z3="6.23374166">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.34583243" y3="-1.84496621" z3="6.56376887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.638405" y3="-0.27782225" z3="7.02571797">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85951878" y3="0.33773272" z3="6.56218761">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.42467924" y3="1.10219182" z3="7.70415797">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.42118336" y3="0.39078698" z3="8.55058478">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22282177" y3="0.78592192" z3="7.0078772">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.70290389" y3="2.0963471" z3="8.10512851">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.06413382" y3="1.13921415" z3="7.01272987">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8318254" y3="0.14277867" z3="6.60242743">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.08678894" y3="1.84550461" z3="6.1648056">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.93358569" y3="1.54768871" z3="7.95059774">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7153923" y3="0.75074627" z3="8.68132444">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.24171387" y3="2.4427472" z3="8.53732167">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.64861254" y3="1.94821187" z3="7.24282256">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.63497955" y3="2.49709129" z3="6.14912254">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.7716664" y3="2.04110217" z3="7.93226013">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.074,1.0932,3.884;-1.4451,1.4351,2.899;-.0313,1.4448,3.9917;-1.6839,1.5962,4.6553;-1.1553,-.4293,3.998;-.778,-.7436,4.9867;-.482,-.8881,3.247;-2.5661,-.9949,3.7936;-2.5252,-2.0975,3.8852;-2.8708,-.7832,2.748;-3.6618,-.4653,4.7334;-4.6328,-.8392,4.3642;-3.6931,.6396,4.7029;-3.5605,-.9408,6.1916;-2.375,-.7958,8.409;-3.2604,-1.3833,8.715;-2.2682,.0372,9.1408;-1.122,-1.6845,8.5372;-.9879,-1.9999,9.5942;-.2333,-1.0745,8.2803;-1.168,-2.9257,7.6462;-1.3086,-2.6,6.5996;-2.0756,-3.5057,7.8917;.0621,-3.835,7.7329;-.123,-4.7399,7.1232;.1944,-4.1909,8.7743;1.3603,-3.1813,7.2563;1.6563,-2.3406,7.9073;2.1976,-3.9033,7.2427;1.2411,-2.7786,6.2337;-4.3458,-1.845,6.5638;-2.6384,-.2778,7.0257;-1.8595,.3377,6.5622;-7.4247,1.1022,7.7042;-7.4212,.3908,8.5506;-8.2228,.7859,7.0079;-7.7029,2.0963,8.1051;-6.0641,1.1392,7.0127;-5.8318,.1428,6.6024;-6.0868,1.8455,6.1648;-4.9336,1.5477,7.9506;-4.7154,.7507,8.6813;-5.2417,2.4427,8.5373;-3.6486,1.9482,7.2428;-3.635,2.4971,6.1491;-2.7717,2.0411,7.9323;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723691086086</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.004601502312 0.000624692723 0.030409084100 0.008512653047</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002926901 -0.001048199 0.000028111 0.000185380 0.000310379 0.000391613 0.000495251 0.000711330 0.000978684 0.001143450 0.002234940 0.002850758 0.003002569 0.003270102 0.003956556 0.005129919 0.005592919 0.005820103 0.007444107 0.007675043 0.009715478 0.010620715 0.010810051 0.012909832 0.018269631 0.019344691 0.021099856 0.023737242 0.027971188 0.030741759 0.032967983 0.033954844 0.035390988 0.038607112 0.042671397 0.043334847 0.045416237 0.048131298 0.049683950 0.049818046 0.050354836 0.051608799 0.052090609 0.052836518 0.054014468 0.054125612 0.056975263 0.058386258 0.061380925 0.061557223 0.066010350 0.069313816 0.072344327 0.075934828 0.077395549 0.078252474 0.078561203 0.082116006 0.084195220 0.090581582 0.096079260 0.098674637 0.103879544 0.105010295 0.107874680 0.111305893 0.113562656 0.113828602 0.116825632 0.118732695 0.130880694 0.134957912 0.137407611 0.144157919 0.145627563 0.153617436 0.154521926 0.165944113 0.170540024 0.173557726 0.180482438 0.188635877 0.193375895 0.202126836 0.208220456 0.213277339 0.217523881 0.237608230 0.254511771 0.263968637 0.312397400 0.323128264 0.351089908 0.358592447 0.413811770 0.448952479 0.501746678 0.535161207 0.562093221 0.597150772 0.616094635 0.631756301 0.684332754 0.734314623 0.745321455 0.746266079 0.751376764 0.759279991 0.767116817 0.771188000 0.785048743 0.785522932 0.791039991 0.797623055 0.807029256 0.809141293 0.815631729 0.824912735 0.832732191 0.851113595 0.864538164 0.867896592 0.876563431 0.891938665 0.899099493 0.903593231 0.911366004 0.920712893 0.922235550 0.968819964 1.286322029 1.490984945</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">15</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.08991606" y3="1.1034727" z3="3.89515124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.46036926" y3="1.44757061" z3="2.91060404">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.05117687" y3="1.46465143" z3="4.00913276">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.70776099" y3="1.59600469" z3="4.66679076">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15591706" y3="-0.42024384" z3="3.99982526">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77388517" y3="-0.73680459" z3="4.9860097">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47886097" y3="-0.86783562" z3="3.24538141">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56080989" y3="-0.99965128" z3="3.79337311">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.50844989" y3="-2.10191465" z3="3.88337711">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86621956" y3="-0.79006883" z3="2.74746681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66456999" y3="-0.48197253" z3="4.73058293">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62975219" y3="-0.86958913" z3="4.36072172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.70979665" y3="0.6222456" z3="4.69664971">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.56234758" y3="-0.94915104" z3="6.19114303">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37605752" y3="-0.79557332" z3="8.40696551">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26128756" y3="-1.38172469" z3="8.71584907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26693367" y3="0.03857041" z3="9.136878">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12372371" y3="-1.68571286" z3="8.5352707">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.99408799" y3="-2.00541422" z3="9.59148618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23339633" y3="-1.0756263" z3="8.28459751">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16673966" y3="-2.92350735" z3="7.63922772">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.29946603" y3="-2.59331414" z3="6.59311674">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.07727545" y3="-3.50204995" z3="7.8762011">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.06055559" y3="-3.83619613" z3="7.72954563">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.12256781" y3="-4.73739584" z3="7.11382323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.18511312" y3="-4.19787856" z3="8.76963706">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.36318644" y3="-3.18315348" z3="7.26486585">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.65549946" y3="-2.34499715" z3="7.9208679">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.19936162" y3="-3.90636292" z3="7.25495188">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.25225162" y3="-2.77690188" z3="6.24283045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.34622435" y3="-1.85171299" z3="6.56878913">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.64225362" y3="-0.27900706" z3="7.02331117">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85942457" y3="0.32798734" z3="6.55549081">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.42096145" y3="1.11458167" z3="7.70721051">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.42403087" y3="0.40470323" z3="8.55490924">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22222981" y3="0.80511074" z3="7.0116218">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.68947778" y3="2.11179648" z3="8.10657384">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.06088328" y3="1.13807859" z3="7.01494099">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83477025" y3="0.1375385" z3="6.61179385">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.07995193" y3="1.83803803" z3="6.16176652">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.92681643" y3="1.54767561" z3="7.94778897">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7090314" y3="0.75459796" z3="8.68311753">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.23099869" y3="2.44727039" z3="8.52976252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.64252476" y3="1.93921251" z3="7.23253523">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.63381547" y3="2.48470824" z3="6.13610228">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.76517417" y3="2.04040186" z3="7.91984972">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0899,1.1035,3.8952;-1.4604,1.4476,2.9106;-.0512,1.4647,4.0091;-1.7078,1.596,4.6668;-1.1559,-.4202,3.9998;-.7739,-.7368,4.986;-.4789,-.8678,3.2454;-2.5608,-.9997,3.7934;-2.5084,-2.1019,3.8834;-2.8662,-.7901,2.7475;-3.6646,-.482,4.7306;-4.6298,-.8696,4.3607;-3.7098,.6222,4.6966;-3.5623,-.9492,6.1911;-2.3761,-.7956,8.407;-3.2613,-1.3817,8.7158;-2.2669,.0386,9.1369;-1.1237,-1.6857,8.5353;-.9941,-2.0054,9.5915;-.2334,-1.0756,8.2846;-1.1667,-2.9235,7.6392;-1.2995,-2.5933,6.5931;-2.0773,-3.502,7.8762;.0606,-3.8362,7.7295;-.1226,-4.7374,7.1138;.1851,-4.1979,8.7696;1.3632,-3.1832,7.2649;1.6555,-2.345,7.9209;2.1994,-3.9064,7.255;1.2523,-2.7769,6.2428;-4.3462,-1.8517,6.5688;-2.6423,-.279,7.0233;-1.8594,.328,6.5555;-7.421,1.1146,7.7072;-7.424,.4047,8.5549;-8.2222,.8051,7.0116;-7.6895,2.1118,8.1066;-6.0609,1.1381,7.0149;-5.8348,.1375,6.6118;-6.08,1.838,6.1618;-4.9268,1.5477,7.9478;-4.709,.7546,8.6831;-5.231,2.4473,8.5298;-3.6425,1.9392,7.2325;-3.6338,2.4847,6.1361;-2.7652,2.0404,7.9198;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723638086316</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003946115132 0.000569172731 0.029941267833 0.008512148221</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.001527224 -0.000103424 0.000138529 0.000268810 0.000313482 0.000423162 0.000509508 0.000888033 0.001027772 0.001204152 0.002210228 0.002709588 0.002997019 0.003247942 0.003798228 0.005087822 0.005556329 0.005920757 0.007386477 0.007925468 0.009673172 0.010649383 0.010953876 0.012915775 0.018351454 0.019355939 0.021094788 0.023803346 0.027963655 0.030729715 0.032969092 0.033955110 0.035393438 0.038618166 0.042794451 0.043353380 0.045434101 0.048129698 0.049685645 0.049816816 0.050372410 0.051604369 0.052090674 0.052837021 0.054033483 0.054181056 0.056972356 0.058387915 0.061382570 0.061563454 0.066014498 0.069321692 0.072341797 0.075935901 0.077403165 0.078254139 0.078573378 0.082131218 0.084209715 0.090697070 0.096082207 0.098674111 0.103931878 0.105025884 0.107878116 0.111309732 0.113564780 0.113836281 0.116832982 0.118732208 0.130884588 0.134964258 0.137409594 0.144172278 0.145660928 0.153629372 0.154532913 0.165961873 0.170546373 0.173571262 0.180519244 0.188684224 0.193389332 0.202161755 0.208279366 0.213278850 0.217643026 0.237675897 0.254518636 0.264061764 0.312437043 0.323152639 0.351095567 0.358633765 0.413812215 0.448954571 0.501747984 0.535251001 0.562095011 0.597157401 0.616203944 0.631770067 0.684364666 0.734661781 0.745336548 0.746274577 0.751429157 0.759281769 0.767228619 0.771188754 0.785066162 0.785530937 0.791047599 0.797652061 0.807029597 0.809146035 0.815813722 0.824971847 0.832732496 0.851116012 0.864883810 0.867900161 0.876588831 0.891949692 0.899236113 0.903768197 0.911415098 0.920722410 0.922246168 0.971143628 1.289265939 1.491005943</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">16</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.08434694" y3="1.10332821" z3="3.88105071">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.45807395" y3="1.44544529" z3="2.89711746">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.04389179" y3="1.46110909" z3="3.98921354">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.69654324" y3="1.60096234" z3="4.65371328">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15621904" y3="-0.41962293" z3="3.99204116">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77545095" y3="-0.73339546" z3="4.97950965">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48156378" y3="-0.87273044" z3="3.23879305">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56391315" y3="-0.99359795" z3="3.7898894">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.51635203" y3="-2.09563882" z3="3.88343418">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87096696" y3="-0.78566023" z3="2.74414311">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66157496" y3="-0.4689106" z3="4.73017095">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.63054016" y3="-0.84938018" z3="4.36287052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.69991245" y3="0.63551913" z3="4.69596765">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.55765987" y3="-0.9417367" z3="6.18944439">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.36832544" y3="-0.79895112" z3="8.40483443">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25606996" y3="-1.3826671" z3="8.71152793">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.25903449" y3="0.03541002" z3="9.13467334">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11844533" y3="-1.69215996" z3="8.53795158">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98982402" y3="-2.00834872" z3="9.59543932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.2266916" y3="-1.08510434" z3="8.28497125">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16418364" y3="-2.93287081" z3="7.64633237">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.29998793" y3="-2.60589524" z3="6.59958314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.07406497" y3="-3.51066073" z3="7.88774157">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.06313752" y3="-3.84532446" z3="7.73771866">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.12062151" y3="-4.74830453" z3="7.12485029">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.18853705" y3="-4.20380669" z3="8.77878937">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.36596006" y3="-3.19436773" z3="7.27051153">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66144826" y3="-2.35699863" z3="7.92606702">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.20054243" y3="-3.91928697" z3="7.25895447">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.25400877" y3="-2.78769509" z3="6.24882123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.34578438" y3="-1.84337621" z3="6.56373822">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62978914" y3="-0.28392894" z3="7.0200502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8570431" y3="0.33851616" z3="6.55850078">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.42618051" y3="1.10252842" z3="7.70887999">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.42115028" y3="0.39275053" z3="8.55645938">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22393772" y3="0.7838616" z3="7.01378641">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.70598652" y3="2.09671949" z3="8.10815445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.06671204" y3="1.14096006" z3="7.01549832">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83060222" y3="0.14340805" z3="6.60979936">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.09365999" y3="1.84347072" z3="6.16451627">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.93576249" y3="1.5575979" z3="7.94932827">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.70670748" y3="0.76099026" z3="8.67784711">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.24877526" y3="2.44955479" z3="8.53973064">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.65688936" y3="1.96915378" z3="7.23712041">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.64869365" y3="2.50997509" z3="6.14001809">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.77567056" y3="2.05961589" z3="7.91833381">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0843,1.1033,3.8811;-1.4581,1.4454,2.8971;-.0439,1.4611,3.9892;-1.6965,1.601,4.6537;-1.1562,-.4196,3.992;-.7755,-.7334,4.9795;-.4816,-.8727,3.2388;-2.5639,-.9936,3.7899;-2.5164,-2.0956,3.8834;-2.871,-.7857,2.7441;-3.6616,-.4689,4.7302;-4.6305,-.8494,4.3629;-3.6999,.6355,4.696;-3.5577,-.9417,6.1894;-2.3683,-.799,8.4048;-3.2561,-1.3827,8.7115;-2.259,.0354,9.1347;-1.1184,-1.6922,8.538;-.9898,-2.0083,9.5954;-.2267,-1.0851,8.285;-1.1642,-2.9329,7.6463;-1.3,-2.6059,6.5996;-2.0741,-3.5107,7.8877;.0631,-3.8453,7.7377;-.1206,-4.7483,7.1249;.1885,-4.2038,8.7788;1.366,-3.1944,7.2705;1.6614,-2.357,7.9261;2.2005,-3.9193,7.259;1.254,-2.7877,6.2488;-4.3458,-1.8434,6.5637;-2.6298,-.2839,7.0201;-1.857,.3385,6.5585;-7.4262,1.1025,7.7089;-7.4212,.3928,8.5565;-8.2239,.7839,7.0138;-7.706,2.0967,8.1082;-6.0667,1.141,7.0155;-5.8306,.1434,6.6098;-6.0937,1.8435,6.1645;-4.9358,1.5576,7.9493;-4.7067,.761,8.6778;-5.2488,2.4496,8.5397;-3.6569,1.9692,7.2371;-3.6487,2.51,6.14;-2.7757,2.0596,7.9183;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723590183297</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001131326418 0.000235011347 0.025385358042 0.008513091902</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000605029 -0.000461683 0.000167710 0.000281260 0.000308930 0.000432624 0.000607091 0.000911945 0.001018453 0.001200437 0.002371602 0.002856049 0.003011209 0.003244056 0.003773745 0.005105790 0.005571095 0.005962735 0.007373301 0.008126791 0.009678916 0.010672378 0.011141060 0.012912264 0.018323808 0.019334559 0.021104327 0.023792116 0.027928841 0.030718995 0.032968974 0.033954350 0.035407522 0.038617015 0.042952830 0.043394831 0.045451424 0.048127411 0.049686110 0.049816561 0.050374729 0.051602328 0.052090672 0.052836808 0.054038991 0.054143355 0.056975269 0.058388320 0.061387465 0.061568620 0.066014730 0.069329225 0.072340586 0.075937138 0.077408152 0.078254709 0.078586184 0.082143287 0.084215239 0.090818046 0.096086757 0.098674299 0.103995373 0.105030214 0.107878693 0.111315622 0.113566342 0.113841720 0.116838742 0.118733411 0.130884712 0.134973256 0.137411782 0.144176065 0.145697818 0.153637197 0.154533347 0.165975831 0.170552706 0.173583611 0.180545398 0.188684229 0.193403631 0.202182504 0.208320275 0.213281456 0.217706825 0.237690752 0.254518916 0.264128834 0.312456992 0.323176955 0.351095298 0.358641389 0.413813571 0.448954278 0.501747304 0.535274433 0.562096417 0.597156324 0.616212671 0.631774063 0.684374599 0.734894163 0.745345277 0.746281132 0.751456671 0.759283230 0.767253112 0.771189862 0.785073867 0.785534946 0.791054612 0.797667881 0.807030132 0.809144994 0.815896844 0.824999457 0.832733370 0.851117681 0.865050638 0.867901106 0.876593185 0.891954502 0.899289832 0.903850421 0.911444829 0.920724137 0.922246822 0.972238824 1.291134781 1.491063038</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">17</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.07274647" y3="1.09211012" z3="3.88386567">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.44409244" y3="1.43621241" z3="2.8996601">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.0288801" y3="1.44053883" z3="3.99066599">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.68006386" y3="1.59601224" z3="4.65655504">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15857603" y3="-0.43011867" z3="3.99653722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78189831" y3="-0.74619539" z3="4.98497064">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48729764" y3="-0.89056489" z3="3.24466909">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57144191" y3="-0.99084837" z3="3.79366001">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.53469247" y3="-2.09351798" z3="3.88559247">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87728113" y3="-0.77810331" z3="2.74851496">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.66263248" y3="-0.45720423" z3="4.73622128">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.63600835" y3="-0.82729618" z3="4.36979184">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.69003844" y3="0.64777904" z3="4.70608996">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.55908758" y3="-0.93573746" z3="6.19304584">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37170357" y3="-0.79982679" z3="8.41008838">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25858812" y3="-1.38664351" z3="8.71321744">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26438617" y3="0.03110412" z3="9.1440004">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11994909" y3="-1.69067456" z3="8.53934332">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98644988" y3="-2.00521879" z3="9.59668113">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23058553" y3="-1.08193027" z3="8.28219536">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16523834" y3="-2.9335417" z3="7.65070452">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31069909" y3="-2.61098026" z3="6.60370952">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.06957775" y3="-3.51655142" z3="7.90088048">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.06852" y3="-3.83828819" z3="7.73671139">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.1155757" y3="-4.74688348" z3="7.1322723">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.20546936" y3="-4.18827776" z3="8.77942458">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.36381956" y3="-3.18384123" z3="7.25285992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66247968" y3="-2.34156891" z3="7.90068167">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.20140948" y3="-3.90537113" z3="7.23727659">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.2402239" y3="-2.78347899" z3="6.22986801">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.34444683" y3="-1.84029749" z3="6.56393925">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63332378" y3="-0.27666291" z3="7.02779212">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85490523" y3="0.33785244" z3="6.56681601">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.42777149" y3="1.0985989" z3="7.69994773">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.42013546" y3="0.38896275" z3="8.54762144">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22246858" y3="0.77489845" z3="7.00341103">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.71421314" y3="2.09128039" z3="8.09861649">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.06708719" y3="1.14410086" z3="7.0091404">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.830017" y3="0.14968098" z3="6.59629949">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.09342038" y3="1.85274312" z3="6.1632002">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.93786435" y3="1.55453741" z3="7.94792779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.71936046" y3="0.75724831" z3="8.67899149">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.24875005" y3="2.44968389" z3="8.53521784">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.65104107" y3="1.95533752" z3="7.24224143">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.6357155" y3="2.4998208" z3="6.14508106">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.77787985" y3="2.05157753" z3="7.93188936">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0727,1.0921,3.8839;-1.4441,1.4362,2.8997;-.0289,1.4405,3.9907;-1.6801,1.596,4.6566;-1.1586,-.4301,3.9965;-.7819,-.7462,4.985;-.4873,-.8906,3.2447;-2.5714,-.9908,3.7937;-2.5347,-2.0935,3.8856;-2.8773,-.7781,2.7485;-3.6626,-.4572,4.7362;-4.636,-.8273,4.3698;-3.69,.6478,4.7061;-3.5591,-.9357,6.193;-2.3717,-.7998,8.4101;-3.2586,-1.3866,8.7132;-2.2644,.0311,9.144;-1.1199,-1.6907,8.5393;-.9864,-2.0052,9.5967;-.2306,-1.0819,8.2822;-1.1652,-2.9335,7.6507;-1.3107,-2.611,6.6037;-2.0696,-3.5166,7.9009;.0685,-3.8383,7.7367;-.1156,-4.7469,7.1323;.2055,-4.1883,8.7794;1.3638,-3.1838,7.2529;1.6625,-2.3416,7.9007;2.2014,-3.9054,7.2373;1.2402,-2.7835,6.2299;-4.3444,-1.8403,6.5639;-2.6333,-.2767,7.0278;-1.8549,.3379,6.5668;-7.4278,1.0986,7.6999;-7.4201,.389,8.5476;-8.2225,.7749,7.0034;-7.7142,2.0913,8.0986;-6.0671,1.1441,7.0091;-5.83,.1497,6.5963;-6.0934,1.8527,6.1632;-4.9379,1.5545,7.9479;-4.7194,.7572,8.679;-5.2488,2.4497,8.5352;-3.651,1.9553,7.2422;-3.6357,2.4998,6.1451;-2.7779,2.0516,7.9319;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723680788633</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001809857534 0.000276346368 0.022779542078 0.008512438257</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.001079978 0.000051010 0.000117465 0.000259479 0.000308102 0.000433614 0.000581057 0.000878781 0.001046580 0.001203673 0.002280448 0.002870124 0.002990302 0.003201110 0.003669594 0.005168475 0.005562581 0.005906877 0.007371799 0.008014021 0.009729799 0.010673156 0.011132174 0.012909368 0.018337485 0.019332893 0.021112985 0.023802483 0.027936068 0.030718925 0.032969133 0.033954365 0.035420340 0.038617120 0.043002335 0.043432314 0.045459482 0.048126550 0.049686041 0.049816553 0.050380502 0.051601400 0.052090699 0.052836527 0.054048576 0.054195833 0.056974632 0.058388556 0.061385298 0.061566949 0.066015406 0.069328895 0.072340589 0.075936650 0.077408642 0.078257577 0.078587756 0.082147222 0.084215567 0.090830120 0.096085722 0.098673900 0.104009793 0.105030441 0.107884521 0.111316624 0.113568688 0.113842145 0.116839330 0.118733777 0.130884840 0.134975076 0.137411705 0.144178740 0.145708858 0.153634116 0.154532646 0.165978327 0.170551632 0.173587748 0.180553637 0.188697135 0.193406500 0.202193195 0.208319043 0.213282451 0.217716265 0.237703641 0.254518258 0.264168864 0.312463712 0.323178200 0.351096402 0.358638831 0.413814207 0.448955556 0.501747222 0.535323048 0.562099393 0.597157335 0.616303369 0.631774767 0.684379850 0.734991003 0.745346996 0.746280812 0.751463122 0.759283333 0.767335959 0.771190418 0.785074353 0.785535600 0.791054747 0.797671786 0.807030544 0.809157657 0.815912318 0.825010441 0.832733745 0.851117747 0.865104658 0.867901649 0.876599622 0.891955502 0.899305542 0.903875702 0.911447288 0.920731329 0.922252545 0.972512018 1.291954859 1.491073757</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">18</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.06507169" y3="1.09200603" z3="3.87119316">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.43806174" y3="1.43391412" z3="2.88683131">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.01874467" y3="1.43481325" z3="3.97228576">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.66698494" y3="1.60223345" z3="4.64408219">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15927627" y3="-0.4293545" z3="3.98998692">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78288983" y3="-0.74397113" z3="4.97903803">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.4918017" y3="-0.89675033" z3="3.23894174">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5758517" y3="-0.9819438" z3="3.79086398">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.5457134" y3="-2.08484638" z3="3.88137998">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88401267" y3="-0.76609628" z3="2.74717999">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.6600358" y3="-0.44255933" z3="4.73798205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.63740424" y3="-0.80451663" z3="4.37358531">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.67939403" y3="0.66262639" z3="4.71287414">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.55258313" y3="-0.92594182" z3="6.19225012">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.36873962" y3="-0.78805029" z3="8.41051214">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25515022" y3="-1.37451069" z3="8.7152736">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.2580656" y3="0.04089172" z3="9.14593856">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11827733" y3="-1.68117462" z3="8.53475357">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.98003184" y3="-1.99092219" z3="9.59293351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22871125" y3="-1.075828" z3="8.27022751">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16981141" y3="-2.92953801" z3="7.65371373">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.3150496" y3="-2.61436145" z3="6.60451142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.07567776" y3="-3.50762879" z3="7.90908706">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.06035829" y3="-3.83868398" z3="7.74515622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.12778982" y3="-4.75103223" z3="7.14755059">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.1964319" y3="-4.18170325" z3="8.79019197">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35806014" y3="-3.19335934" z3="7.25611431">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66126673" y3="-2.34847183" z3="7.89848137">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.19216683" y3="-3.91880018" z3="7.24409129">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23541121" y3="-2.79896586" z3="6.23086941">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.32878021" y3="-1.83820433" z3="6.56084888">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63498947" y3="-0.2588345" z3="7.03114769">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85232217" y3="0.35185952" z3="6.56841791">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.42772277" y3="1.08130124" z3="7.70003213">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.416007" y3="0.36683198" z3="8.54378674">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22062707" y3="0.75666406" z3="7.00199914">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.72004654" y3="2.0698723" z3="8.10419401">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.06717603" y3="1.1375905" z3="7.009368">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82830248" y3="0.14712801" z3="6.58900193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.09583317" y3="1.85202255" z3="6.16824073">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.93885339" y3="1.54509364" z3="7.95028046">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.72971142" y3="0.75104377" z3="8.68718338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.24622032" y3="2.44503881" z3="8.52983456">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.64679967" y3="1.93572194" z3="7.24691648">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.62923204" y3="2.48694416" z3="6.15238721">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.77990992" y3="2.04290852" z3="7.94636808">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0651,1.092,3.8712;-1.4381,1.4339,2.8868;-.0187,1.4348,3.9723;-1.667,1.6022,4.6441;-1.1593,-.4294,3.99;-.7829,-.744,4.979;-.4918,-.8968,3.2389;-2.5759,-.9819,3.7909;-2.5457,-2.0848,3.8814;-2.884,-.7661,2.7472;-3.66,-.4426,4.738;-4.6374,-.8045,4.3736;-3.6794,.6626,4.7129;-3.5526,-.9259,6.1923;-2.3687,-.7881,8.4105;-3.2552,-1.3745,8.7153;-2.2581,.0409,9.1459;-1.1183,-1.6812,8.5348;-.98,-1.9909,9.5929;-.2287,-1.0758,8.2702;-1.1698,-2.9295,7.6537;-1.315,-2.6144,6.6045;-2.0757,-3.5076,7.9091;.0604,-3.8387,7.7452;-.1278,-4.751,7.1476;.1964,-4.1817,8.7902;1.3581,-3.1934,7.2561;1.6613,-2.3485,7.8985;2.1922,-3.9188,7.2441;1.2354,-2.799,6.2309;-4.3288,-1.8382,6.5608;-2.635,-.2588,7.0311;-1.8523,.3519,6.5684;-7.4277,1.0813,7.7;-7.416,.3668,8.5438;-8.2206,.7567,7.002;-7.72,2.0699,8.1042;-6.0672,1.1376,7.0094;-5.8283,.1471,6.589;-6.0958,1.852,6.1682;-4.9389,1.5451,7.9503;-4.7297,.751,8.6872;-5.2462,2.445,8.5298;-3.6468,1.9357,7.2469;-3.6292,2.4869,6.1524;-2.7799,2.0429,7.9464;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723820662883</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003033994697 0.000422901029 0.031203357335 0.008512915136</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.001021047 0.000054183 0.000155059 0.000246227 0.000311112 0.000419092 0.000629517 0.000892149 0.001050154 0.001205391 0.002323331 0.002911236 0.003005852 0.003243015 0.003748997 0.005168055 0.005569387 0.005923206 0.007376703 0.008045932 0.009730153 0.010674277 0.011133901 0.012919613 0.018346923 0.019335399 0.021115519 0.023810518 0.027942814 0.030719993 0.032969143 0.033954618 0.035423156 0.038617650 0.043016672 0.043436203 0.045462889 0.048126821 0.049685901 0.049817377 0.050382238 0.051601029 0.052091241 0.052835960 0.054049337 0.054226155 0.056975850 0.058388952 0.061386514 0.061566524 0.066015570 0.069329112 0.072340573 0.075936489 0.077408632 0.078258305 0.078587547 0.082148219 0.084215344 0.090831375 0.096085752 0.098674285 0.104012667 0.105031881 0.107885313 0.111316938 0.113569580 0.113842648 0.116839282 0.118733748 0.130885032 0.134975307 0.137411931 0.144187705 0.145709800 0.153634398 0.154532715 0.165979196 0.170552159 0.173588528 0.180557949 0.188710089 0.193408175 0.202194053 0.208320271 0.213286786 0.217715846 0.237708686 0.254518919 0.264182373 0.312468104 0.323184445 0.351097661 0.358643558 0.413814155 0.448955946 0.501747092 0.535332359 0.562099766 0.597158213 0.616380240 0.631775015 0.684388871 0.735030215 0.745351407 0.746282112 0.751465482 0.759283739 0.767374044 0.771191186 0.785076905 0.785536829 0.791056866 0.797676569 0.807030561 0.809169259 0.815930978 0.825020755 0.832734716 0.851119198 0.865139322 0.867904475 0.876600099 0.891957522 0.899317577 0.903912897 0.911452770 0.920732739 0.922254675 0.972775099 1.292469453 1.491089820</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">19</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.06020807" y3="1.09296231" z3="3.85889935">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.43607749" y3="1.43479223" z3="2.87560675">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.01217242" y3="1.43194531" z3="3.95505658">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.65641212" y3="1.60691378" z3="4.63355626">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16047146" y3="-0.42772689" z3="3.98130411">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78456679" y3="-0.74150325" z3="4.97080526">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49606159" y3="-0.89909191" z3="3.23006199">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57968129" y3="-0.97462541" z3="3.78621837">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.55380625" y3="-2.07758883" z3="3.87679905">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.89041198" y3="-0.75712447" z3="2.74349896">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.65731652" y3="-0.43123451" z3="4.73833447">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.63805463" y3="-0.78656259" z3="4.37671198">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.67110857" y3="0.67385172" z3="4.71348101">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.54734699" y3="-0.92116007" z3="6.19110159">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.36098918" y3="-0.79238995" z3="8.40922275">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.24939669" y3="-1.37689846" z3="8.71243087">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.25086633" y3="0.03751069" z3="9.14370878">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11244892" y3="-1.68765057" z3="8.53903278">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.97523692" y3="-1.99373485" z3="9.59851532">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22156466" y3="-1.08515056" z3="8.27240554">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16701743" y3="-2.93854528" z3="7.66211433">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31464507" y3="-2.62533048" z3="6.61268384">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.07300366" y3="-3.51488768" z3="7.92116867">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.06250164" y3="-3.84856226" z3="7.75375541">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.12731992" y3="-4.76241811" z3="7.1591369">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.20035123" y3="-4.18868198" z3="8.79952811">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35963967" y3="-3.20534163" z3="7.26042985">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66464416" y3="-2.35930259" z3="7.90032177">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.1933696" y3="-3.93139141" z3="7.24806045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23477246" y3="-2.81280787" z3="6.23467243">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.32694887" y3="-1.83331108" z3="6.55622866">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62269748" y3="-0.26627901" z3="7.02831898">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85113161" y3="0.36203095" z3="6.57168436">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43130305" y3="1.06825033" z3="7.70007269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.41118894" y3="0.35497749" z3="8.54476066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2202312" y3="0.73298295" z3="7.00213199">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.73547726" y3="2.0541791" z3="8.10262493">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.0712602" y3="1.13878753" z3="7.00972666">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82073163" y3="0.15006784" z3="6.59155244">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.10774071" y3="1.85173389" z3="6.16778055">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.94791031" y3="1.55874684" z3="7.95142469">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.72784185" y3="0.76540978" z3="8.68558636">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.26500925" y3="2.45349234" z3="8.53406096">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.66123646" y3="1.9669253" z3="7.25156109">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.64278909" y3="2.51308767" z3="6.15660762">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.7895647" y3="2.06110991" z3="7.94514206">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0602,1.093,3.8589;-1.4361,1.4348,2.8756;-.0122,1.4319,3.9551;-1.6564,1.6069,4.6336;-1.1605,-.4277,3.9813;-.7846,-.7415,4.9708;-.4961,-.8991,3.2301;-2.5797,-.9746,3.7862;-2.5538,-2.0776,3.8768;-2.8904,-.7571,2.7435;-3.6573,-.4312,4.7383;-4.6381,-.7866,4.3767;-3.6711,.6739,4.7135;-3.5473,-.9212,6.1911;-2.361,-.7924,8.4092;-3.2494,-1.3769,8.7124;-2.2509,.0375,9.1437;-1.1124,-1.6877,8.539;-.9752,-1.9937,9.5985;-.2216,-1.0852,8.2724;-1.167,-2.9385,7.6621;-1.3146,-2.6253,6.6127;-2.073,-3.5149,7.9212;.0625,-3.8486,7.7538;-.1273,-4.7624,7.1591;.2004,-4.1887,8.7995;1.3596,-3.2053,7.2604;1.6646,-2.3593,7.9003;2.1934,-3.9314,7.2481;1.2348,-2.8128,6.2347;-4.3269,-1.8333,6.5562;-2.6227,-.2663,7.0283;-1.8511,.362,6.5717;-7.4313,1.0683,7.7001;-7.4112,.355,8.5448;-8.2202,.733,7.0021;-7.7355,2.0542,8.1026;-6.0713,1.1388,7.0097;-5.8207,.1501,6.5916;-6.1077,1.8517,6.1678;-4.9479,1.5587,7.9514;-4.7278,.7654,8.6856;-5.265,2.4535,8.5341;-3.6612,1.9669,7.2516;-3.6428,2.5131,6.1566;-2.7896,2.0611,7.9451;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723747375167</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001296517737 0.000243540106 0.027533621143 0.008512960836</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000649423 -0.000008776 0.000066618 0.000242055 0.000308075 0.000418349 0.000625268 0.000880189 0.001034088 0.001207011 0.002338601 0.002903632 0.003008302 0.003247763 0.003747596 0.005176957 0.005569690 0.005927153 0.007380391 0.008053570 0.009736703 0.010674265 0.011133671 0.012926886 0.018346161 0.019335069 0.021115080 0.023810548 0.027941674 0.030720073 0.032969162 0.033955821 0.035422738 0.038617223 0.043016386 0.043435501 0.045463955 0.048127177 0.049686405 0.049818166 0.050383925 0.051602073 0.052091117 0.052835384 0.054049506 0.054217523 0.056975195 0.058388356 0.061385460 0.061566683 0.066014595 0.069328959 0.072341426 0.075937215 0.077408453 0.078257959 0.078587601 0.082147902 0.084214627 0.090831687 0.096086126 0.098674334 0.104011793 0.105031329 0.107885996 0.111316866 0.113569384 0.113842029 0.116839265 0.118733615 0.130885085 0.134975083 0.137412292 0.144184775 0.145709690 0.153633678 0.154531559 0.165979269 0.170551849 0.173588185 0.180557056 0.188710831 0.193407988 0.202193668 0.208318735 0.213285723 0.217715287 0.237706792 0.254517716 0.264176038 0.312469610 0.323188346 0.351097362 0.358649260 0.413814374 0.448955417 0.501746856 0.535332326 0.562099463 0.597158769 0.616384665 0.631774875 0.684389072 0.735026092 0.745351202 0.746282092 0.751465458 0.759283702 0.767386199 0.771191057 0.785076741 0.785536745 0.791058867 0.797676537 0.807030952 0.809168150 0.815930164 0.825020043 0.832734692 0.851119133 0.865137802 0.867904150 0.876603352 0.891956814 0.899317305 0.903912534 0.911453369 0.920731943 0.922256211 0.972770246 1.292458263 1.491096926</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">20</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.04853456" y3="1.08794504" z3="3.84673152">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.42564025" y3="1.43014971" z3="2.86404304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.00242444" y3="1.41922904" z3="3.9381624">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.6373132" y3="1.60876442" z3="4.62223176">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16072453" y3="-0.43156122" z3="3.9744802">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78690492" y3="-0.74472277" z3="4.96497748">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.5006093" y3="-0.91028119" z3="3.2240481">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58447303" y3="-0.96794135" z3="3.78301957">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.56644534" y3="-2.07113449" z3="3.87392323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.89659823" y3="-0.74810945" z3="2.74109097">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.65433311" y3="-0.41753018" z3="4.73976705">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.63924736" y3="-0.76392496" z3="4.38079293">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.65998737" y3="0.687815" z3="4.71681707">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.54258598" y3="-0.91372521" z3="6.1908347">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.35366799" y3="-0.79133426" z3="8.40815918">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.24392439" y3="-1.37370047" z3="8.71061629">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.24325811" y3="0.03938007" z3="9.14196089">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10736115" y3="-1.689261" z3="8.54160527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.97069346" y3="-1.99252747" z3="9.60200019">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21514023" y3="-1.08972772" z3="8.27259104">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16593969" y3="-2.94227842" z3="7.66822581">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31580113" y3="-2.63132945" z3="6.61839209">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.07230555" y3="-3.51644677" z3="7.93095677">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.06231062" y3="-3.85395184" z3="7.76000387">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.13025827" y3="-4.76951345" z3="7.16887353">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.20190096" y3="-4.19069686" z3="8.80664515">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.359599" y3="-3.21468465" z3="7.2619142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66759413" y3="-2.36714275" z3="7.89845239">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.19181913" y3="-3.94242275" z3="7.25029365">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23346981" y3="-2.82526672" z3="6.23516147">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.32672066" y3="-1.82509096" z3="6.55312254">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61187692" y3="-0.26855845" z3="7.02578641">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85029121" y3="0.37492511" z3="6.57445254">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4348215" y3="1.0527223" z3="7.70027652">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40808238" y3="0.3367965" z3="8.54224528">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22017464" y3="0.7127948" z3="7.00135715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.74802687" y3="2.03411696" z3="8.10633638">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.07575203" y3="1.13838391" z3="7.00977542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.81562936" y3="0.15355033" z3="6.58846164">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.11882019" y3="1.85430868" z3="6.17059391">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.95720606" y3="1.56454521" z3="7.95407714">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.72597106" y3="0.7662473" z3="8.6810156">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.2853162" y3="2.45086428" z3="8.54632681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.67530564" y3="1.99445892" z3="7.25773664">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.65777314" y3="2.53839783" z3="6.16367921">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.79957188" y3="2.07792562" z3="7.94587321">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0485,1.0879,3.8467;-1.4256,1.4301,2.864;.0024,1.4192,3.9382;-1.6373,1.6088,4.6222;-1.1607,-.4316,3.9745;-.7869,-.7447,4.965;-.5006,-.9103,3.224;-2.5845,-.9679,3.783;-2.5664,-2.0711,3.8739;-2.8966,-.7481,2.7411;-3.6543,-.4175,4.7398;-4.6392,-.7639,4.3808;-3.66,.6878,4.7168;-3.5426,-.9137,6.1908;-2.3537,-.7913,8.4082;-3.2439,-1.3737,8.7106;-2.2433,.0394,9.142;-1.1074,-1.6893,8.5416;-.9707,-1.9925,9.602;-.2151,-1.0897,8.2726;-1.1659,-2.9423,7.6682;-1.3158,-2.6313,6.6184;-2.0723,-3.5164,7.931;.0623,-3.854,7.76;-.1303,-4.7695,7.1689;.2019,-4.1907,8.8066;1.3596,-3.2147,7.2619;1.6676,-2.3671,7.8985;2.1918,-3.9424,7.2503;1.2335,-2.8253,6.2352;-4.3267,-1.8251,6.5531;-2.6119,-.2686,7.0258;-1.8503,.3749,6.5745;-7.4348,1.0527,7.7003;-7.4081,.3368,8.5422;-8.2202,.7128,7.0014;-7.748,2.0341,8.1063;-6.0758,1.1384,7.0098;-5.8156,.1536,6.5885;-6.1188,1.8543,6.1706;-4.9572,1.5645,7.9541;-4.726,.7662,8.681;-5.2853,2.4509,8.5463;-3.6753,1.9945,7.2577;-3.6578,2.5384,6.1637;-2.7996,2.0779,7.9459;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723724403248</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001185306059 0.000234716154 0.026672068020 0.008512394967</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000673598 0.000055474 0.000087318 0.000240021 0.000326060 0.000421168 0.000632744 0.000861722 0.001035287 0.001236500 0.002331294 0.002901148 0.003008171 0.003250912 0.003744934 0.005187346 0.005569877 0.005931667 0.007381641 0.008062174 0.009736968 0.010674888 0.011133747 0.012934951 0.018346509 0.019334930 0.021114729 0.023810359 0.027942017 0.030720661 0.032969169 0.033956139 0.035422386 0.038617366 0.043016811 0.043435873 0.045464080 0.048127068 0.049685874 0.049819011 0.050383480 0.051603940 0.052091507 0.052834292 0.054050719 0.054263555 0.056974780 0.058387983 0.061385397 0.061566051 0.066016296 0.069328940 0.072342018 0.075937142 0.077408549 0.078258651 0.078587097 0.082147588 0.084217162 0.090835927 0.096087874 0.098675321 0.104011013 0.105032240 0.107886912 0.111316867 0.113569515 0.113842597 0.116839204 0.118735597 0.130885032 0.134974976 0.137412519 0.144191321 0.145710002 0.153632722 0.154531646 0.165979369 0.170551687 0.173588193 0.180556899 0.188752496 0.193407961 0.202193720 0.208317457 0.213286666 0.217715285 0.237734585 0.254516391 0.264185758 0.312469324 0.323196608 0.351096311 0.358671406 0.413817165 0.448954868 0.501751607 0.535335340 0.562099223 0.597165886 0.616473398 0.631774933 0.684389032 0.735033214 0.745351845 0.746282279 0.751465528 0.759284167 0.767507769 0.771193929 0.785076691 0.785536683 0.791080592 0.797676789 0.807031058 0.809171030 0.815929512 0.825019692 0.832735994 0.851119060 0.865136488 0.867906141 0.876635978 0.891955978 0.899317819 0.903912653 0.911453167 0.920731722 0.922256017 0.972765312 1.292467178 1.491112829</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">21</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.03675112" y3="1.08239469" z3="3.83485204">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.41471124" y3="1.42515276" z3="2.85268197">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.01716641" y3="1.4054004" z3="3.92156319">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.61792314" y3="1.61003389" z3="4.61133158">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16123717" y3="-0.43564255" z3="3.96771266">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79012836" y3="-0.74826252" z3="4.95941307">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.50535838" y3="-0.92184593" z3="3.21843086">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58943992" y3="-0.96080044" z3="3.7792473">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.57980351" y3="-2.06403205" z3="3.86958475">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.90285176" y3="-0.73765919" z3="2.73837409">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.65111767" y3="-0.40326646" z3="4.74088072">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.64028274" y3="-0.73999495" z3="4.38432916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.64766037" y3="0.70199616" z3="4.71992359">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.5373653" y3="-0.90691375" z3="6.18985682">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.34824412" y3="-0.79228963" z3="8.40792293">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.24007995" y3="-1.37319217" z3="8.70886581">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.23807817" y3="0.03872148" z3="9.14156772">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10375628" y3="-1.69238809" z3="8.545321">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.96873292" y3="-1.99406613" z3="9.60639998">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21009151" y3="-1.09521258" z3="8.27613471">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16487248" y3="-2.94633313" z3="7.67372572">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31568857" y3="-2.63580901" z3="6.62394614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.07186658" y3="-3.51867466" z3="7.93806233">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.0622072" y3="-3.85955599" z3="7.76502207">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.13262953" y3="-4.77602136" z3="7.17608463">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.20352445" y3="-4.19438675" z3="8.81207788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35916725" y3="-3.22265211" z3="7.26295555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6689547" y3="-2.37385516" z3="7.89686477">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.19091339" y3="-3.95103412" z3="7.25140084">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23116414" y3="-2.8353725" z3="6.23555535">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.32192959" y3="-1.82051337" z3="6.54750698">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.60315731" y3="-0.27089337" z3="7.02464257">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85027151" y3="0.38706982" z3="6.57856555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4377182" y3="1.03619776" z3="7.70122227">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40248589" y3="0.32055479" z3="8.54327174">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21879325" y3="0.68612273" z3="7.00166069">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.76300762" y3="2.01431921" z3="8.10671637">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.07936463" y3="1.13699602" z3="7.01157908">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80762058" y3="0.15404755" z3="6.59221688">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.13081691" y3="1.85156802" z3="6.17163227">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.96554626" y3="1.57554632" z3="7.95668353">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.72465824" y3="0.78000218" z3="8.68187646">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.3014116" y3="2.45699094" z3="8.54900604">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.68989959" y3="2.02049398" z3="7.26373968">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.67291574" y3="2.5626519" z3="6.17052724">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.80879865" y3="2.0948636" z3="7.94695168">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0368,1.0824,3.8349;-1.4147,1.4252,2.8527;.0172,1.4054,3.9216;-1.6179,1.61,4.6113;-1.1612,-.4356,3.9677;-.7901,-.7483,4.9594;-.5054,-.9218,3.2184;-2.5894,-.9608,3.7792;-2.5798,-2.064,3.8696;-2.9029,-.7377,2.7384;-3.6511,-.4033,4.7409;-4.6403,-.74,4.3843;-3.6477,.702,4.7199;-3.5374,-.9069,6.1899;-2.3482,-.7923,8.4079;-3.2401,-1.3732,8.7089;-2.2381,.0387,9.1416;-1.1038,-1.6924,8.5453;-.9687,-1.9941,9.6064;-.2101,-1.0952,8.2761;-1.1649,-2.9463,7.6737;-1.3157,-2.6358,6.6239;-2.0719,-3.5187,7.9381;.0622,-3.8596,7.765;-.1326,-4.776,7.1761;.2035,-4.1944,8.8121;1.3592,-3.2227,7.263;1.669,-2.3739,7.8969;2.1909,-3.951,7.2514;1.2312,-2.8354,6.2356;-4.3219,-1.8205,6.5475;-2.6032,-.2709,7.0246;-1.8503,.3871,6.5786;-7.4377,1.0362,7.7012;-7.4025,.3206,8.5433;-8.2188,.6861,7.0017;-7.763,2.0143,8.1067;-6.0794,1.137,7.0116;-5.8076,.154,6.5922;-6.1308,1.8516,6.1716;-4.9655,1.5755,7.9567;-4.7247,.78,8.6819;-5.3014,2.457,8.549;-3.6899,2.0205,7.2637;-3.6729,2.5627,6.1705;-2.8088,2.0949,7.947;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723695662652</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001183563389 0.000243368531 0.034063516866 0.008512368996</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000396219 -0.000040714 0.000067031 0.000235792 0.000324934 0.000437193 0.000627308 0.000856463 0.001028862 0.001277897 0.002365162 0.002897061 0.003015123 0.003280280 0.003746761 0.005220655 0.005577497 0.005935805 0.007382461 0.008062228 0.009745563 0.010701786 0.011140903 0.012949459 0.018346366 0.019341498 0.021113992 0.023812329 0.027942546 0.030723453 0.032969166 0.033956280 0.035426272 0.038619396 0.043023402 0.043444166 0.045464577 0.048127578 0.049685777 0.049819501 0.050384165 0.051603860 0.052091708 0.052833813 0.054051526 0.054291295 0.056975043 0.058386925 0.061385511 0.061565296 0.066018369 0.069329772 0.072343228 0.075937079 0.077408178 0.078258312 0.078587398 0.082151297 0.084218965 0.090836796 0.096088638 0.098676454 0.104028000 0.105032113 0.107890238 0.111316824 0.113569498 0.113848187 0.116840069 0.118735528 0.130885792 0.134974954 0.137412602 0.144190933 0.145712374 0.153643117 0.154537148 0.165985266 0.170552904 0.173593383 0.180559889 0.188803377 0.193412234 0.202193479 0.208342204 0.213292589 0.217726210 0.237733884 0.254515223 0.264212224 0.312469134 0.323205961 0.351102438 0.358758543 0.413820618 0.448954857 0.501751213 0.535335163 0.562100065 0.597167759 0.616544118 0.631775732 0.684395479 0.735037388 0.745354233 0.746284167 0.751468798 0.759284180 0.767646102 0.771195712 0.785078123 0.785537241 0.791114180 0.797679547 0.807031197 0.809170962 0.815930028 0.825020496 0.832736120 0.851119254 0.865149165 0.867905674 0.876643875 0.891955129 0.899317778 0.903921760 0.911456311 0.920731463 0.922258124 0.972832123 1.292469787 1.491127366</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">22</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.04771724" y3="1.08786435" z3="3.84190623">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.42778885" y3="1.42913456" z3="2.85996048">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.00426434" y3="1.4172843" z3="3.9287436">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.63272644" y3="1.61071347" z3="4.61907581">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.1622854" y3="-0.43113556" z3="3.9721105">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78821316" y3="-0.74329629" z3="4.96285833">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.50361199" y3="-0.91221276" z3="3.22198542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58699715" y3="-0.9652144" z3="3.78228285">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.57084266" y3="-2.06838842" z3="3.87233555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.90016503" y3="-0.74403134" z3="2.74099684">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.65450371" y3="-0.41355039" z3="4.74081687">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.64071203" y3="-0.75632266" z3="4.38184646">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.65660505" y3="0.69178687" z3="4.72069651">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.54249329" y3="-0.91333042" z3="6.19040981">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.35678711" y3="-0.79244137" z3="8.4099357">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.24658946" y3="-1.37638775" z3="8.71067892">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.24783991" y3="0.03703429" z3="9.14529486">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10950179" y3="-1.68895993" z3="8.54254496">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.97214127" y3="-1.99274803" z3="9.60267006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21808347" y3="-1.08824507" z3="8.27387444">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16682094" y3="-2.94149244" z3="7.66849089">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31586631" y3="-2.63028068" z3="6.61861791">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.07313282" y3="-3.51611053" z3="7.93023901">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.06180613" y3="-3.85263828" z3="7.76110308">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.13004259" y3="-4.76854485" z3="7.17032848">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.2010499" y3="-4.18885632" z3="8.80798033">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35896026" y3="-3.21282316" z3="7.26333583">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66607376" y3="-2.36478499" z3="7.89954158">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.19170082" y3="-3.9400425" z3="7.25251142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23303895" y3="-2.82394479" z3="6.23630927">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.32293445" y3="-1.82813666" z3="6.54990354">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61464769" y3="-0.26626135" z3="7.02846081">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84984248" y3="0.3725259" z3="6.57695806">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43283563" y3="1.05037057" z3="7.69937599">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40537422" y3="0.33653796" z3="8.54314352">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21728965" y3="0.70714212" z3="7.00037891">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.74799666" y3="2.0323962" z3="8.10275654">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.07341124" y3="1.13602843" z3="7.0101346">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8127181" y3="0.15050362" z3="6.59066009">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.11667807" y3="1.85036742" z3="6.16968225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.9553208" y3="1.56424736" z3="7.95449655">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.72839616" y3="0.77051228" z3="8.68631048">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.28142377" y3="2.45432026" z3="8.53982557">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.67135736" y3="1.98643047" z3="7.25961888">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.65179428" y3="2.53306329" z3="6.16597888">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.79737473" y3="2.07237346" z3="7.95072156">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0477,1.0879,3.8419;-1.4278,1.4291,2.86;.0043,1.4173,3.9287;-1.6327,1.6107,4.6191;-1.1623,-.4311,3.9721;-.7882,-.7433,4.9629;-.5036,-.9122,3.222;-2.587,-.9652,3.7823;-2.5708,-2.0684,3.8723;-2.9002,-.744,2.741;-3.6545,-.4136,4.7408;-4.6407,-.7563,4.3818;-3.6566,.6918,4.7207;-3.5425,-.9133,6.1904;-2.3568,-.7924,8.4099;-3.2466,-1.3764,8.7107;-2.2478,.037,9.1453;-1.1095,-1.689,8.5425;-.9721,-1.9927,9.6027;-.2181,-1.0882,8.2739;-1.1668,-2.9415,7.6685;-1.3159,-2.6303,6.6186;-2.0731,-3.5161,7.9302;.0618,-3.8526,7.7611;-.13,-4.7685,7.1703;.201,-4.1889,8.808;1.359,-3.2128,7.2633;1.6661,-2.3648,7.8995;2.1917,-3.94,7.2525;1.233,-2.8239,6.2363;-4.3229,-1.8281,6.5499;-2.6146,-.2663,7.0285;-1.8498,.3725,6.577;-7.4328,1.0504,7.6994;-7.4054,.3365,8.5431;-8.2173,.7071,7.0004;-7.748,2.0324,8.1028;-6.0734,1.136,7.0101;-5.8127,.1505,6.5907;-6.1167,1.8504,6.1697;-4.9553,1.5642,7.9545;-4.7284,.7705,8.6863;-5.2814,2.4543,8.5398;-3.6714,1.9864,7.2596;-3.6518,2.5331,6.166;-2.7974,2.0724,7.9507;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723745487412</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001171351402 0.000203217017 0.032097041975 0.008512812250</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000462533 0.000005524 0.000065845 0.000142663 0.000297492 0.000374673 0.000519937 0.000720156 0.001019933 0.001286621 0.002410235 0.002915249 0.003033141 0.003379564 0.003851362 0.005265228 0.005574525 0.005945544 0.007388357 0.008077378 0.009751481 0.010733709 0.011148393 0.012983996 0.018346299 0.019351756 0.021113804 0.023827084 0.027946176 0.030746850 0.032969172 0.033956336 0.035432429 0.038620476 0.043045585 0.043448104 0.045465553 0.048134948 0.049689337 0.049828038 0.050388004 0.051602163 0.052091391 0.052835126 0.054050438 0.054372759 0.056977109 0.058385742 0.061399029 0.061604604 0.066048717 0.069331927 0.072342966 0.075937363 0.077417094 0.078257907 0.078588889 0.082153647 0.084237979 0.090893937 0.096096175 0.098681642 0.104028650 0.105038314 0.107892048 0.111317492 0.113577221 0.113857453 0.116840027 0.118734166 0.130886853 0.134980810 0.137414105 0.144208439 0.145712391 0.153652518 0.154551670 0.165985914 0.170553143 0.173592081 0.180559977 0.188969071 0.193412379 0.202195730 0.208345712 0.213293863 0.217745553 0.237804337 0.254525654 0.264261482 0.312472957 0.323208845 0.351108781 0.358846087 0.413830961 0.448959749 0.501749187 0.535354779 0.562112188 0.597171603 0.616783429 0.631796422 0.684400261 0.735079814 0.745354123 0.746287239 0.751470631 0.759285021 0.768064872 0.771209413 0.785078247 0.785548791 0.791219865 0.797684359 0.807032180 0.809171540 0.815966672 0.825042461 0.832736483 0.851120384 0.865191902 0.867907253 0.876736231 0.891962048 0.899332777 0.903936438 0.911460703 0.920735012 0.922262908 0.973189683 1.292741309 1.491170148</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">23</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.0576215" y3="1.09330544" z3="3.85219012">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.4368843" y3="1.43325711" z3="2.86955821">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="-0.00833994" y3="1.4298298" z3="3.94258307">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.64899597" y3="1.61091325" z3="4.62800055">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16128234" y3="-0.42679359" z3="3.97917722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78505876" y3="-0.73872969" z3="4.96920755">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49850683" y3="-0.9018242" z3="3.22887603">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5817752" y3="-0.97101938" z3="3.78614624">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.55796947" y3="-2.07410259" z3="3.87616026">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.89347384" y3="-0.75228554" z3="2.74399053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.6570196" y3="-0.42640636" z3="4.7400388">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.63905109" y3="-0.77765272" z3="4.37822019">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.66715952" y3="0.67881874" z3="4.71924165">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.54704989" y3="-0.92017848" z3="6.19106274">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.36354481" y3="-0.78941828" z3="8.41106621">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25099454" y3="-1.37543683" z3="8.71420878">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.25429587" y3="0.03997536" z3="9.14632787">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.1137827" y3="-1.68279275" z3="8.53803027">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.97240693" y3="-1.98743295" z3="9.59727876">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22478302" y3="-1.07937062" z3="8.2673869">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17005608" y3="-2.9348381" z3="7.66293018">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31763284" y3="-2.62367618" z3="6.61278864">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.0766621" y3="-3.50970363" z3="7.92322118">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.05856654" y3="-3.8457598" z3="7.75660929">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.13241767" y3="-4.76126468" z3="7.16490205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.19618967" y3="-4.18261492" z3="8.80351527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35638251" y3="-3.20533267" z3="7.26120452">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66238702" y3="-2.35761477" z3="7.89846789">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.18926705" y3="-3.93237156" z3="7.25121738">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23202484" y3="-2.81594446" z3="6.23412663">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.32328968" y3="-1.83577406" z3="6.55369289">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62610265" y3="-0.26171807" z3="7.03088999">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85125607" y3="0.36226186" z3="6.57340663">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.42856288" y3="1.06247013" z3="7.6991805">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.4076925" y3="0.34718296" z3="8.54210542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21738006" y3="0.72836652" z3="7.00082994">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.73335297" y3="2.04709539" z3="8.10434955">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.0685412" y3="1.13571841" z3="7.00870696">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.81823487" y3="0.14850095" z3="6.58687457">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.10505759" y3="1.85172764" z3="6.1691915">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.94558448" y3="1.55252786" z3="7.95203971">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73182963" y3="0.75930757" z3="8.68912009">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.26140868" y3="2.45034524" z3="8.53175498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.6543249" y3="1.95433343" z3="7.25478611">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.63280921" y3="2.5039449" z3="6.16055799">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.78659424" y3="2.05063049" z3="7.95266643">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0576,1.0933,3.8522;-1.4369,1.4333,2.8696;-.0083,1.4298,3.9426;-1.649,1.6109,4.628;-1.1613,-.4268,3.9792;-.7851,-.7387,4.9692;-.4985,-.9018,3.2289;-2.5818,-.971,3.7861;-2.558,-2.0741,3.8762;-2.8935,-.7523,2.744;-3.657,-.4264,4.74;-4.6391,-.7777,4.3782;-3.6672,.6788,4.7192;-3.547,-.9202,6.1911;-2.3635,-.7894,8.4111;-3.251,-1.3754,8.7142;-2.2543,.04,9.1463;-1.1138,-1.6828,8.538;-.9724,-1.9874,9.5973;-.2248,-1.0794,8.2674;-1.1701,-2.9348,7.6629;-1.3176,-2.6237,6.6128;-2.0767,-3.5097,7.9232;.0586,-3.8458,7.7566;-.1324,-4.7613,7.1649;.1962,-4.1826,8.8035;1.3564,-3.2053,7.2612;1.6624,-2.3576,7.8985;2.1893,-3.9324,7.2512;1.232,-2.8159,6.2341;-4.3233,-1.8358,6.5537;-2.6261,-.2617,7.0309;-1.8513,.3623,6.5734;-7.4286,1.0625,7.6992;-7.4077,.3472,8.5421;-8.2174,.7284,7.0008;-7.7334,2.0471,8.1043;-6.0685,1.1357,7.0087;-5.8182,.1485,6.5869;-6.1051,1.8517,6.1692;-4.9456,1.5525,7.952;-4.7318,.7593,8.6891;-5.2614,2.4503,8.5318;-3.6543,1.9543,7.2548;-3.6328,2.5039,6.1606;-2.7866,2.0506,7.9527;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723810786247</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001212930446 0.000212682111 0.027706820852 0.008513050666</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000491392 -0.000078171 0.000067289 0.000259660 0.000363915 0.000395767 0.000667446 0.000781797 0.001024697 0.001302191 0.002317694 0.002963429 0.003043142 0.003296675 0.003830697 0.005228919 0.005567312 0.005946829 0.007384431 0.008101012 0.009786228 0.010677720 0.011139544 0.013010518 0.018347001 0.019339003 0.021114624 0.023824495 0.027950863 0.030743852 0.032969202 0.033958691 0.035433539 0.038615354 0.043046950 0.043445412 0.045462921 0.048144630 0.049687800 0.049830625 0.050388143 0.051604059 0.052091710 0.052835690 0.054050874 0.054413144 0.056978120 0.058386384 0.061399579 0.061615704 0.066057827 0.069335010 0.072343494 0.075939460 0.077419135 0.078257230 0.078590132 0.082154721 0.084240785 0.090920703 0.096100770 0.098682684 0.104018552 0.105041129 0.107894186 0.111317792 0.113578991 0.113856929 0.116839127 0.118734287 0.130886754 0.134982379 0.137415780 0.144214089 0.145713165 0.153649404 0.154553727 0.165982446 0.170552938 0.173589980 0.180559802 0.189012878 0.193411099 0.202198482 0.208338180 0.213300255 0.217739045 0.237843706 0.254527279 0.264270330 0.312473120 0.323210079 0.351114740 0.358869676 0.413831300 0.448961555 0.501749515 0.535358456 0.562116860 0.597173303 0.616861114 0.631801605 0.684401015 0.735082038 0.745353642 0.746286848 0.751470079 0.759285278 0.768236527 0.771215455 0.785078209 0.785552455 0.791258909 0.797683530 0.807032165 0.809171923 0.815972286 0.825042381 0.832736653 0.851120364 0.865189395 0.867909450 0.876787592 0.891969338 0.899333955 0.903932961 0.911459614 0.920736232 0.922262664 0.973165361 1.292743353 1.491253928</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">24</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.04466631" y3="1.08379489" z3="3.84041933">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.42340592" y3="1.42597311" z3="2.85836495">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.00833308" y3="1.40957461" z3="3.927138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.627895" y3="1.60907657" z3="4.61712127">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16414168" y3="-0.43487613" z3="3.97100093">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79062457" y3="-0.74826524" z3="4.96161417">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.50726459" y3="-0.91833318" z3="3.22086935">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59073234" y3="-0.96413401" z3="3.78153284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.5783559" y3="-2.06757377" z3="3.86982108">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.90439991" y3="-0.74010472" z3="2.74102712">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.65503783" y3="-0.410132" z3="4.74217339">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6428545" y3="-0.7499459" z3="4.38482367">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.65399542" y3="0.69518696" z3="4.72350916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.5412713" y3="-0.9108671" z3="6.19083582">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.35750694" y3="-0.78725272" z3="8.410936">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.24670301" y3="-1.37174299" z3="8.71221116">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.24810666" y3="0.04161551" z3="9.14679395">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11013691" y3="-1.68362436" z3="8.54096058">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.97150377" y3="-1.98798802" z3="9.60074571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.2190292" y3="-1.08272705" z3="8.27148111">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16846059" y3="-2.93594675" z3="7.66663442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31618025" y3="-2.62481558" z3="6.61660415">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.07569914" y3="-3.50934078" z3="7.92756804">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.05894667" y3="-3.84843049" z3="7.76037773">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.13339204" y3="-4.76421215" z3="7.16965047">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.19675612" y3="-4.18445723" z3="8.8074166">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35711656" y3="-3.21008886" z3="7.26372213">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66406585" y3="-2.36180956" z3="7.8996717">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.18927143" y3="-3.93795358" z3="7.25443342">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23274162" y3="-2.82194282" z3="6.23627798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.31766084" y3="-1.82845845" z3="6.54998868">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61723893" y3="-0.25884842" z3="7.03055636">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84922816" y3="0.37605831" z3="6.5776395">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43159205" y3="1.0491901" z3="7.6967306">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40702386" y3="0.33521154" z3="8.54038705">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21592879" y3="0.70826583" z3="6.99664411">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.74467347" y3="2.03168954" z3="8.10010472">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.07108376" y3="1.13179084" z3="7.00959406">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.81361876" y3="0.14669788" z3="6.58784506">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.11000237" y3="1.84814985" z3="6.17084568">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.95341573" y3="1.55430986" z3="7.95663703">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7311695" y3="0.75772313" z3="8.68771775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.27894298" y3="2.44452482" z3="8.54343897">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.66582183" y3="1.97420165" z3="7.26334285">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.64578921" y3="2.52623032" z3="6.17155377">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.79664611" y3="2.06506276" z3="7.9591258">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0447,1.0838,3.8404;-1.4234,1.426,2.8584;.0083,1.4096,3.9271;-1.6279,1.6091,4.6171;-1.1641,-.4349,3.971;-.7906,-.7483,4.9616;-.5073,-.9183,3.2209;-2.5907,-.9641,3.7815;-2.5784,-2.0676,3.8698;-2.9044,-.7401,2.741;-3.655,-.4101,4.7422;-4.6429,-.7499,4.3848;-3.654,.6952,4.7235;-3.5413,-.9109,6.1908;-2.3575,-.7873,8.4109;-3.2467,-1.3717,8.7122;-2.2481,.0416,9.1468;-1.1101,-1.6836,8.541;-.9715,-1.988,9.6007;-.219,-1.0827,8.2715;-1.1685,-2.9359,7.6666;-1.3162,-2.6248,6.6166;-2.0757,-3.5093,7.9276;.0589,-3.8484,7.7604;-.1334,-4.7642,7.1697;.1968,-4.1845,8.8074;1.3571,-3.2101,7.2637;1.6641,-2.3618,7.8997;2.1893,-3.938,7.2544;1.2327,-2.8219,6.2363;-4.3177,-1.8285,6.55;-2.6172,-.2588,7.0306;-1.8492,.3761,6.5776;-7.4316,1.0492,7.6967;-7.407,.3352,8.5404;-8.2159,.7083,6.9966;-7.7447,2.0317,8.1001;-6.0711,1.1318,7.0096;-5.8136,.1467,6.5878;-6.11,1.8481,6.1708;-4.9534,1.5543,7.9566;-4.7312,.7577,8.6877;-5.2789,2.4445,8.5434;-3.6658,1.9742,7.2633;-3.6458,2.5262,6.1716;-2.7966,2.0651,7.9591;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723802164993</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001200927898 0.000176434422 0.029373293469 0.008513305718</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000551609 -0.000118636 0.000064484 0.000136807 0.000331029 0.000538869 0.000571285 0.000773703 0.001023547 0.001293450 0.002359696 0.002950351 0.003040456 0.003328003 0.003834823 0.005242434 0.005571211 0.005949676 0.007397423 0.008102098 0.009790917 0.010688505 0.011142359 0.013014381 0.018347889 0.019346278 0.021117623 0.023825216 0.027951389 0.030746167 0.032969200 0.033959518 0.035432765 0.038616712 0.043044640 0.043445489 0.045462528 0.048145885 0.049689481 0.049831696 0.050393476 0.051604452 0.052091754 0.052834479 0.054051397 0.054434373 0.056977523 0.058386063 0.061397818 0.061616373 0.066061664 0.069335779 0.072343424 0.075939910 0.077418810 0.078258172 0.078590872 0.082154860 0.084245557 0.090924872 0.096102198 0.098683153 0.104032951 0.105042342 0.107894558 0.111319488 0.113579978 0.113858665 0.116839056 0.118733561 0.130886688 0.134983167 0.137416322 0.144226487 0.145718003 0.153648067 0.154557384 0.165981840 0.170553532 0.173588698 0.180559542 0.189053212 0.193413665 0.202199159 0.208344232 0.213295822 0.217740947 0.237852621 0.254525704 0.264296872 0.312472710 0.323209734 0.351115729 0.358903018 0.413834362 0.448961599 0.501749053 0.535358773 0.562117779 0.597174677 0.616920989 0.631806159 0.684403715 0.735143348 0.745353772 0.746286910 0.751470294 0.759285334 0.768312768 0.771218320 0.785078187 0.785553047 0.791272766 0.797683923 0.807032527 0.809181872 0.815973476 0.825042255 0.832738462 0.851120573 0.865190391 0.867908853 0.876798104 0.891969871 0.899333171 0.903935149 0.911459922 0.920736083 0.922263295 0.973168840 1.292744445 1.491275378</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">25</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.03394807" y3="1.07689431" z3="3.82907445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.41301976" y3="1.4213215" z3="2.84789709">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.02205159" y3="1.39390957" z3="3.91227532">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.60990542" y3="1.60792763" z3="4.60713831">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16666076" y3="-0.44042427" z3="3.96257284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.7952243" y3="-0.75488261" z3="4.95361732">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.5151183" y3="-0.93069934" z3="3.21218539">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59831697" y3="-0.95704367" z3="3.77697798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.59529966" y3="-2.06059563" z3="3.86397858">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.91412235" y3="-0.72868204" z3="2.7379711">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.65260375" y3="-0.3957287" z3="4.74417993">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.64532572" y3="-0.72542861" z3="4.3907967">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.64235562" y3="0.70950152" z3="4.72731181">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.53529378" y3="-0.90394599" z3="6.19073963">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.35083145" y3="-0.78909813" z3="8.41060886">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.24239372" y3="-1.37146901" z3="8.70939309">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.24187619" y3="0.03987994" z3="9.14664991">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10612199" y3="-1.68859237" z3="8.54570327">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.9717661" y3="-1.99311044" z3="9.60603084">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21269342" y3="-1.08999912" z3="8.27882414">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.16550001" y3="-2.94051733" z3="7.67102639">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31349514" y3="-2.62827444" z3="6.62131884">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.07323988" y3="-3.51331991" z3="7.93179919">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.06133626" y3="-3.8537737" z3="7.76424354">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.13179582" y3="-4.7695096" z3="7.17364385">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.19966876" y3="-4.18979947" z3="8.81129833">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35958897" y3="-3.21603586" z3="7.2667495">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66708703" y3="-2.36760175" z3="7.90226409">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.19156719" y3="-3.94411559" z3="7.25732506">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23473207" y3="-2.82812033" z3="6.23923968">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.31480073" y3="-1.82221718" z3="6.54615217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.60575637" y3="-0.26312874" z3="7.02899106">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84768004" y3="0.38920996" z3="6.58205666">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43587031" y3="1.03856316" z3="7.69512892">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40730132" y3="0.33003524" z3="8.54331015">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21549908" y3="0.68666597" z3="6.99502708">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.75819332" y3="2.02117514" z3="8.0913631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.07437404" y3="1.12807638" z3="7.01095651">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80806175" y3="0.14287718" z3="6.59442753">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.11683205" y3="1.84096536" z3="6.16933961">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.96220581" y3="1.56156883" z3="7.95986372">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.72713721" y3="0.76387515" z3="8.68554273">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.29850056" y3="2.44383586" z3="8.55245827">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.68166375" y3="2.00357495" z3="7.27035322">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.66249139" y3="2.55295833" z3="6.17970165">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.8067248" y3="2.0837541" z3="7.96038083">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0339,1.0769,3.8291;-1.413,1.4213,2.8479;.0221,1.3939,3.9123;-1.6099,1.6079,4.6071;-1.1667,-.4404,3.9626;-.7952,-.7549,4.9536;-.5151,-.9307,3.2122;-2.5983,-.957,3.777;-2.5953,-2.0606,3.864;-2.9141,-.7287,2.738;-3.6526,-.3957,4.7442;-4.6453,-.7254,4.3908;-3.6424,.7095,4.7273;-3.5353,-.9039,6.1907;-2.3508,-.7891,8.4106;-3.2424,-1.3715,8.7094;-2.2419,.0399,9.1466;-1.1061,-1.6886,8.5457;-.9718,-1.9931,9.606;-.2127,-1.09,8.2788;-1.1655,-2.9405,7.671;-1.3135,-2.6283,6.6213;-2.0732,-3.5133,7.9318;.0613,-3.8538,7.7642;-.1318,-4.7695,7.1736;.1997,-4.1898,8.8113;1.3596,-3.216,7.2667;1.6671,-2.3676,7.9023;2.1916,-3.9441,7.2573;1.2347,-2.8281,6.2392;-4.3148,-1.8222,6.5462;-2.6058,-.2631,7.029;-1.8477,.3892,6.5821;-7.4359,1.0386,7.6951;-7.4073,.33,8.5433;-8.2155,.6867,6.995;-7.7582,2.0212,8.0914;-6.0744,1.1281,7.011;-5.8081,.1429,6.5944;-6.1168,1.841,6.1693;-4.9622,1.5616,7.9599;-4.7271,.7639,8.6855;-5.2985,2.4438,8.5525;-3.6817,2.0036,7.2704;-3.6625,2.553,6.1797;-2.8067,2.0838,7.9604;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723757748612</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001284462694 0.000220638553 0.037995210676 0.008512633225</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000311524 -0.000141523 0.000055420 0.000181402 0.000329736 0.000492773 0.000633162 0.000864639 0.001028580 0.001293941 0.002343582 0.002987325 0.003050619 0.003320882 0.003840628 0.005245079 0.005572152 0.005948422 0.007394536 0.008100311 0.009779467 0.010700283 0.011148676 0.013013775 0.018347920 0.019350910 0.021117158 0.023825079 0.027953083 0.030748841 0.032969200 0.033959425 0.035435475 0.038617401 0.043051321 0.043449148 0.045462421 0.048146419 0.049690813 0.049831240 0.050400458 0.051604091 0.052091763 0.052832886 0.054051599 0.054433903 0.056977509 0.058385751 0.061398722 0.061614787 0.066060556 0.069337214 0.072344711 0.075940573 0.077418942 0.078259867 0.078591229 0.082156430 0.084243629 0.090933300 0.096102889 0.098683867 0.104041430 0.105042153 0.107895406 0.111319504 0.113581180 0.113858781 0.116839132 0.118737784 0.130887137 0.134983863 0.137416375 0.144241623 0.145721438 0.153648082 0.154561170 0.165983409 0.170554408 0.173589631 0.180561297 0.189058636 0.193415626 0.202202013 0.208351683 0.213295949 0.217757576 0.237852797 0.254526807 0.264301595 0.312472946 0.323228938 0.351118175 0.358925289 0.413836113 0.448962514 0.501752155 0.535369814 0.562117620 0.597177854 0.616954750 0.631809843 0.684405391 0.735145744 0.745356578 0.746288128 0.751473571 0.759285355 0.768309790 0.771218414 0.785079204 0.785553397 0.791282455 0.797685739 0.807033780 0.809232086 0.815983872 0.825043454 0.832740477 0.851121106 0.865206560 0.867909760 0.876816902 0.891970909 0.899335871 0.903948117 0.911468098 0.920736841 0.922270373 0.973255911 1.292810307 1.491278538</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">26</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.03222566" y3="1.07468161" z3="3.83100018">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.40859524" y3="1.4182314" z3="2.84852211">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.02378705" y3="1.39050584" z3="3.91581238">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.60947736" y3="1.60687332" z3="4.60727207">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16613935" y3="-0.44228518" z3="3.96523635">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.7951975" y3="-0.75671768" z3="4.95658664">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.51436002" y3="-0.93366886" z3="3.21598335">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59766815" y3="-0.95783354" z3="3.77793149">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.59586766" y3="-2.06134372" z3="3.86417176">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.9118885" y3="-0.72843469" z3="2.73882671">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.65305809" y3="-0.39587295" z3="4.7431043">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6450002" y3="-0.72589216" z3="4.38898801">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.64198416" y3="0.70925179" z3="4.72718829">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.53654068" y3="-0.90146707" z3="6.18938887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.35524255" y3="-0.77492373" z3="8.41090427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.24455136" y3="-1.35826129" z3="8.71397585">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.2431874" y3="0.0538586" z3="9.14631262">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.1093796" y3="-1.67325766" z3="8.53823596">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.96846893" y3="-1.97643396" z3="9.5979699">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21795049" y3="-1.07440573" z3="8.2656323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17270875" y3="-2.92683526" z3="7.66588576">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.31836097" y3="-2.61733928" z3="6.61494055">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.08281696" y3="-3.49573437" z3="7.92713938">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.05059328" y3="-3.84445387" z3="7.76285612">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.14531295" y3="-4.7609206" z3="7.17422497">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.18572797" y3="-4.17836047" z3="8.81107013">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.35222569" y3="-3.21290062" z3="7.26602253">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66130018" y3="-2.3633451" z3="7.89940419">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.18161689" y3="-3.94400015" z3="7.26103583">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.23120108" y3="-2.82820472" z3="6.23675033">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.30570278" y3="-1.82586481" z3="6.54552899">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61727615" y3="-0.24409478" z3="7.03167908">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84830319" y3="0.38729698" z3="6.5779275">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43178065" y3="1.0341287" z3="7.69554348">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40889116" y3="0.31782653" z3="8.53748178">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21332626" y3="0.69337971" z3="6.99277001">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.74824319" y3="2.01508412" z3="8.10045422">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.06870102" y3="1.12127267" z3="7.01215133">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80872644" y3="0.13736624" z3="6.58829871">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.1066513" y3="1.84019965" z3="6.17499689">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.95340044" y3="1.54285735" z3="7.9626563">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73301669" y3="0.74578881" z3="8.69303383">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.28086757" y3="2.43101138" z3="8.54931215">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.66524815" y3="1.96557973" z3="7.27367127">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.64557426" y3="2.52727111" z3="6.18567015">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.79872916" y3="2.06084294" z3="7.97433936">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0322,1.0747,3.831;-1.4086,1.4182,2.8485;.0238,1.3905,3.9158;-1.6095,1.6069,4.6073;-1.1661,-.4423,3.9652;-.7952,-.7567,4.9566;-.5144,-.9337,3.216;-2.5977,-.9578,3.7779;-2.5959,-2.0613,3.8642;-2.9119,-.7284,2.7388;-3.6531,-.3959,4.7431;-4.645,-.7259,4.389;-3.642,.7093,4.7272;-3.5365,-.9015,6.1894;-2.3552,-.7749,8.4109;-3.2446,-1.3583,8.714;-2.2432,.0539,9.1463;-1.1094,-1.6733,8.5382;-.9685,-1.9764,9.598;-.218,-1.0744,8.2656;-1.1727,-2.9268,7.6659;-1.3184,-2.6173,6.6149;-2.0828,-3.4957,7.9271;.0506,-3.8445,7.7629;-.1453,-4.7609,7.1742;.1857,-4.1784,8.8111;1.3522,-3.2129,7.266;1.6613,-2.3633,7.8994;2.1816,-3.944,7.261;1.2312,-2.8282,6.2368;-4.3057,-1.8259,6.5455;-2.6173,-.2441,7.0317;-1.8483,.3873,6.5779;-7.4318,1.0341,7.6955;-7.4089,.3178,8.5375;-8.2133,.6934,6.9928;-7.7482,2.0151,8.1005;-6.0687,1.1213,7.0122;-5.8087,.1374,6.5883;-6.1067,1.8402,6.175;-4.9534,1.5429,7.9627;-4.733,.7458,8.693;-5.2809,2.431,8.5493;-3.6652,1.9656,7.2737;-3.6456,2.5273,6.1857;-2.7987,2.0608,7.9743;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723884687316</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001466031629 0.000294356127 0.022785799958 0.008513277314</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000315185 0.000050109 0.000067393 0.000108689 0.000325169 0.000474802 0.000690590 0.000783150 0.001021057 0.001294804 0.002372149 0.002981953 0.003048698 0.003332429 0.003839171 0.005250719 0.005571557 0.005948658 0.007417371 0.008100465 0.009789226 0.010707197 0.011157512 0.013013585 0.018348880 0.019358061 0.021121408 0.023825558 0.027961124 0.030750749 0.032969234 0.033959386 0.035442879 0.038619852 0.043058978 0.043448858 0.045463943 0.048165366 0.049694809 0.049831500 0.050415669 0.051604447 0.052091881 0.052834208 0.054057614 0.054460248 0.056978207 0.058387311 0.061399586 0.061617205 0.066064400 0.069337311 0.072344841 0.075941207 0.077419110 0.078264283 0.078592003 0.082164749 0.084251956 0.090963291 0.096107012 0.098683931 0.104046240 0.105042763 0.107895839 0.111320141 0.113581202 0.113860053 0.116839166 0.118744806 0.130887137 0.134984541 0.137416400 0.144294966 0.145723103 0.153648462 0.154571382 0.165983301 0.170555200 0.173590437 0.180569495 0.189095527 0.193416871 0.202202837 0.208365538 0.213300594 0.217767636 0.237854352 0.254533063 0.264318483 0.312474005 0.323229930 0.351120086 0.358944444 0.413837438 0.448964319 0.501759166 0.535371730 0.562118761 0.597185616 0.617103821 0.631832121 0.684413737 0.735233165 0.745361916 0.746288999 0.751481087 0.759285523 0.768395450 0.771226356 0.785082786 0.785553910 0.791284693 0.797689451 0.807034374 0.809306073 0.816002972 0.825046257 0.832740557 0.851121775 0.865240452 0.867914677 0.876820485 0.891975762 0.899347767 0.903972803 0.911482939 0.920740915 0.922275285 0.973463316 1.292861418 1.491281082</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">27</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.01841297" y3="1.06771676" z3="3.82320803">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.39175765" y3="1.41128856" z3="2.83954959">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.03990051" y3="1.37623419" z3="3.90803138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.592365" y3="1.60610615" z3="4.59777012">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16376811" y3="-0.44792865" z3="3.96185806">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79671885" y3="-0.76186801" z3="4.95483286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.51483439" y3="-0.94639945" z3="3.21468915">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59922638" y3="-0.95295683" z3="3.77510988">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.60580407" y3="-2.05645161" z3="3.86240314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.91276728" y3="-0.72186498" z3="2.73616096">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.64843844" y3="-0.38274186" z3="4.74231063">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.64390625" y3="-0.70618234" z3="4.39112013">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.63044384" y3="0.72236507" z3="4.72632049">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.52886907" y3="-0.89020426" z3="6.18770981">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.34753125" y3="-0.76429528" z3="8.40878023">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.2388037" y3="-1.34399884" z3="8.71355092">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.23155742" y3="0.06471276" z3="9.14330474">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.105435" y3="-1.66789922" z3="8.5363567">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.96417154" y3="-1.96829913" z3="9.59689169">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21174125" y3="-1.07395955" z3="8.26014425">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17587811" y3="-2.92421699" z3="7.66850052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.32218464" y3="-2.61801715" z3="6.61674791">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.08788439" y3="-3.48824805" z3="7.93336665">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.04361472" y3="-3.84684594" z3="7.76686121">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.15745462" y3="-4.76492631" z3="7.18249237">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.17926945" y3="-4.17700742" z3="8.81618442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.34719506" y3="-3.22341781" z3="7.26496204">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.66124819" y3="-2.37246694" z3="7.89399384">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.17323883" y3="-3.95834484" z3="7.26177792">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.22617459" y3="-2.84277115" z3="6.2342127">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.29599353" y3="-1.81703902" z3="6.54298855">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.60945994" y3="-0.2340934" z3="7.02951">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84584631" y3="0.40785202" z3="6.57803198">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43422957" y3="1.01580565" z3="7.69897137">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40401326" y3="0.29577553" z3="8.53766417">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21406107" y3="0.67181237" z3="6.99536066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.75754425" y3="1.99229832" z3="8.10867955">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.07338687" y3="1.11598214" z3="7.01452453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80750256" y3="0.13636077" z3="6.58572972">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.11678656" y3="1.83865608" z3="6.18124823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.96080245" y3="1.54066373" z3="7.96632912">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73246888" y3="0.74033218" z3="8.69139432">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.2958142" y3="2.42263453" z3="8.56031972">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.67591608" y3="1.9783828" z3="7.27839374">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.65992844" y3="2.541347" z3="6.1917274">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.81090199" y3="2.07657466" z3="7.97781284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0184,1.0677,3.8232;-1.3918,1.4113,2.8395;.0399,1.3762,3.908;-1.5924,1.6061,4.5978;-1.1638,-.4479,3.9619;-.7967,-.7619,4.9548;-.5148,-.9464,3.2147;-2.5992,-.953,3.7751;-2.6058,-2.0565,3.8624;-2.9128,-.7219,2.7362;-3.6484,-.3827,4.7423;-4.6439,-.7062,4.3911;-3.6304,.7224,4.7263;-3.5289,-.8902,6.1877;-2.3475,-.7643,8.4088;-3.2388,-1.344,8.7136;-2.2316,.0647,9.1433;-1.1054,-1.6679,8.5364;-.9642,-1.9683,9.5969;-.2117,-1.074,8.2601;-1.1759,-2.9242,7.6685;-1.3222,-2.618,6.6167;-2.0879,-3.4882,7.9334;.0436,-3.8468,7.7669;-.1575,-4.7649,7.1825;.1793,-4.177,8.8162;1.3472,-3.2234,7.265;1.6612,-2.3725,7.894;2.1732,-3.9583,7.2618;1.2262,-2.8428,6.2342;-4.296,-1.817,6.543;-2.6095,-.2341,7.0295;-1.8458,.4079,6.578;-7.4342,1.0158,7.699;-7.404,.2958,8.5377;-8.2141,.6718,6.9954;-7.7575,1.9923,8.1087;-6.0734,1.116,7.0145;-5.8075,.1364,6.5857;-6.1168,1.8387,6.1812;-4.9608,1.5407,7.9663;-4.7325,.7403,8.6914;-5.2958,2.4226,8.5603;-3.6759,1.9784,7.2784;-3.6599,2.5413,6.1917;-2.8109,2.0766,7.9778;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723909730429</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001036336819 0.000232156362 0.035148679845 0.008513250733</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000702309 0.000056699 0.000102333 0.000316775 0.000405059 0.000429128 0.000629622 0.000774417 0.001025957 0.001297606 0.002373595 0.002987848 0.003049868 0.003335378 0.003842948 0.005261567 0.005572328 0.005948621 0.007424022 0.008108567 0.009798586 0.010716131 0.011177943 0.013013740 0.018351709 0.019369856 0.021123612 0.023828007 0.027967328 0.030755218 0.032969249 0.033959472 0.035444451 0.038629296 0.043058680 0.043450859 0.045467387 0.048174778 0.049695416 0.049831325 0.050423677 0.051603966 0.052092002 0.052833133 0.054057365 0.054472396 0.056977685 0.058387854 0.061400812 0.061615246 0.066063840 0.069337262 0.072344858 0.075940658 0.077418840 0.078267084 0.078591137 0.082164910 0.084254232 0.090965522 0.096108928 0.098683925 0.104056582 0.105043053 0.107895706 0.111322042 0.113581179 0.113859764 0.116839689 0.118743855 0.130887318 0.134984804 0.137416389 0.144300089 0.145725230 0.153647329 0.154582818 0.165983531 0.170554929 0.173589702 0.180569518 0.189106239 0.193418015 0.202211296 0.208386053 0.213299756 0.217804001 0.237853075 0.254532274 0.264333775 0.312478308 0.323230783 0.351119587 0.358944929 0.413837370 0.448964241 0.501758778 0.535372674 0.562118755 0.597186195 0.617158554 0.631837061 0.684416021 0.735303455 0.745362266 0.746289550 0.751481159 0.759285534 0.768440653 0.771228971 0.785083682 0.785554531 0.791295058 0.797690028 0.807034405 0.809320089 0.816005134 0.825046244 0.832741085 0.851121962 0.865239786 0.867915873 0.876819851 0.891978348 0.899347270 0.903975273 0.911485186 0.920746300 0.922275056 0.973474407 1.292895534 1.491281351</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">28</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-1.00577224" y3="1.06006879" z3="3.81818996">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.37518963" y3="1.40372615" z3="2.83305042">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.05432607" y3="1.3620242" z3="3.90428111">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.57750554" y3="1.60365225" z3="4.59069972">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16136926" y3="-0.45418735" z3="3.96031054">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79774397" y3="-0.7679245" z3="4.95461576">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.51481095" y3="-0.95881204" z3="3.21524764">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.60005591" y3="-0.94980005" z3="3.77312277">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.61402324" y3="-2.05316624" z3="3.86066054">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.91214105" y3="-0.71668505" z3="2.73414896">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.64506403" y3="-0.37296603" z3="4.74086485">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.64250182" y3="-0.6913482" z3="4.39077932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.6214068" y3="0.7319796" z3="4.72442278">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.52518118" y3="-0.88126949" z3="6.18595688">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.34394397" y3="-0.75088618" z3="8.40725546">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.23523129" y3="-1.32861324" z3="8.71573322">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.22444848" y3="0.0793748" z3="9.13975992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10339543" y3="-1.65650829" z3="8.53241028">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.95746141" y3="-1.95317241" z3="9.59341453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.20973784" y3="-1.0657001" z3="8.24933295">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.18172697" y3="-2.91588219" z3="7.66970509">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.32851696" y3="-2.61347089" z3="6.61698039">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09618194" y3="-3.4739997" z3="7.93842818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.03313628" y3="-3.84413231" z3="7.77015412">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.1735092" y3="-4.76389615" z3="7.19045207">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16869878" y3="-4.16989097" z3="8.82082087">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.33889295" y3="-3.2294746" z3="7.26344024">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.65718925" y3="-2.37627814" z3="7.88727914">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.16160472" y3="-3.9681034" z3="7.26378263">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.2185699" y3="-2.85424825" z3="6.23063296">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.28866541" y3="-1.81154724" z3="6.53996072">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.60817789" y3="-0.22203142" z3="7.02804165">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84551313" y3="0.41848479" z3="6.57543022">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43361206" y3="0.9944867" z3="7.70268766">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.39761388" y3="0.26062685" z3="8.52919713">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21302942" y3="0.65785138" z3="6.99554394">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.7620023" y3="1.96248894" z3="8.12954607">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.07445573" y3="1.11400687" z3="7.01610569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80209054" y3="0.14111958" z3="6.57464944">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.12524626" y3="1.84664772" z3="6.19148864">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.96228772" y3="1.5348438" z3="7.97020184">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73398749" y3="0.73108414" z3="8.69107614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.29702555" y3="2.41329355" z3="8.56796573">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.67878721" y3="1.97746138" z3="7.28406745">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.66386729" y3="2.54531782" z3="6.19993645">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.81310572" y3="2.07591135" z3="7.98605619">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-1.0058,1.0601,3.8182;-1.3752,1.4037,2.8331;.0543,1.362,3.9043;-1.5775,1.6037,4.5907;-1.1614,-.4542,3.9603;-.7977,-.7679,4.9546;-.5148,-.9588,3.2152;-2.6001,-.9498,3.7731;-2.614,-2.0532,3.8607;-2.9121,-.7167,2.7341;-3.6451,-.373,4.7409;-4.6425,-.6913,4.3908;-3.6214,.732,4.7244;-3.5252,-.8813,6.186;-2.3439,-.7509,8.4073;-3.2352,-1.3286,8.7157;-2.2244,.0794,9.1398;-1.1034,-1.6565,8.5324;-.9575,-1.9532,9.5934;-.2097,-1.0657,8.2493;-1.1817,-2.9159,7.6697;-1.3285,-2.6135,6.617;-2.0962,-3.474,7.9384;.0331,-3.8441,7.7702;-.1735,-4.7639,7.1905;.1687,-4.1699,8.8208;1.3389,-3.2295,7.2634;1.6572,-2.3763,7.8873;2.1616,-3.9681,7.2638;1.2186,-2.8542,6.2306;-4.2887,-1.8115,6.54;-2.6082,-.222,7.028;-1.8455,.4185,6.5754;-7.4336,.9945,7.7027;-7.3976,.2606,8.5292;-8.213,.6579,6.9955;-7.762,1.9625,8.1295;-6.0745,1.114,7.0161;-5.8021,.1411,6.5746;-6.1252,1.8466,6.1915;-4.9623,1.5348,7.9702;-4.734,.7311,8.6911;-5.297,2.4133,8.568;-3.6788,1.9775,7.2841;-3.6639,2.5453,6.1999;-2.8131,2.0759,7.9861;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723972014101</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001035203496 0.000253305017 0.026572118785 0.008513062072</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000498342 0.000029107 0.000063503 0.000126845 0.000329289 0.000469217 0.000688485 0.000773100 0.001025401 0.001298499 0.002399315 0.002988593 0.003049965 0.003341600 0.003846978 0.005268681 0.005572490 0.005950257 0.007433642 0.008107336 0.009811402 0.010727834 0.011178654 0.013013856 0.018352138 0.019376199 0.021126534 0.023828250 0.027973427 0.030758537 0.032969199 0.033959623 0.035447299 0.038633655 0.043059356 0.043451275 0.045470297 0.048186555 0.049697417 0.049831277 0.050434123 0.051604129 0.052092007 0.052832124 0.054059824 0.054481010 0.056978426 0.058386641 0.061399952 0.061613899 0.066068476 0.069336729 0.072345247 0.075940202 0.077418871 0.078274636 0.078591319 0.082165817 0.084254167 0.090968875 0.096110390 0.098683945 0.104063722 0.105043262 0.107895484 0.111322452 0.113581464 0.113860427 0.116839411 0.118743718 0.130887254 0.134985066 0.137416352 0.144313062 0.145726196 0.153647967 0.154598353 0.165984485 0.170554743 0.173589799 0.180569717 0.189126733 0.193418814 0.202210286 0.208415665 0.213300664 0.217833014 0.237863961 0.254533499 0.264323513 0.312477952 0.323231092 0.351120841 0.358950568 0.413837527 0.448965524 0.501758556 0.535381311 0.562119145 0.597186910 0.617246242 0.631847447 0.684421620 0.735387418 0.745362631 0.746291830 0.751482542 0.759285546 0.768477643 0.771232055 0.785084441 0.785554886 0.791297755 0.797690915 0.807034736 0.809356161 0.816013447 0.825046552 0.832741178 0.851122358 0.865243127 0.867921977 0.876844367 0.891983073 0.899351857 0.903979754 0.911489345 0.920749046 0.922275027 0.973532316 1.292928352 1.491281822</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">29</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.99365016" y3="1.05359064" z3="3.81020883">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.36108465" y3="1.39769362" z3="2.82451727">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.06835865" y3="1.34897954" z3="3.89562374">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.56148354" y3="1.60236073" z3="4.58182182">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15956906" y3="-0.45918748" z3="3.95612241">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79897119" y3="-0.77260006" z3="4.95161463">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.51625368" y3="-0.96985697" z3="3.21237168">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.60165349" y3="-0.94515594" z3="3.77052912">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.62294088" y3="-2.04829059" z3="3.85889792">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.91368934" y3="-0.71040932" z3="2.73186685">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.64046813" y3="-0.36144412" z3="4.74077993">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.64092831" y3="-0.67309884" z3="4.39296057">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.6102935" y3="0.74341129" z3="4.72384172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.51963635" y3="-0.87262057" z3="6.18530647">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33597637" y3="-0.74742959" z3="8.40573092">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22928868" y3="-1.322262" z3="8.71413454">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.21518128" y3="0.08378979" z3="9.13699672">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09843593" y3="-1.6567623" z3="8.53428017">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.95314428" y3="-1.95083663" z3="9.59609425">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.203017" y3="-1.06980946" z3="8.24893341">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.18220231" y3="-2.91795809" z3="7.67501051">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.33117148" y3="-2.61721615" z3="6.62212949">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09752479" y3="-3.47285888" z3="7.94732533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.03042372" y3="-3.84897436" z3="7.77465508">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.18014369" y3="-4.76980404" z3="7.1981269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16828204" y3="-4.17200398" z3="8.82586768">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.33605887" y3="-3.23876313" z3="7.2624382">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.65764535" y3="-2.38411592" z3="7.88255752">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.15731059" y3="-3.97893284" z3="7.26307571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.2135564" y3="-2.86671007" z3="6.22877312">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.2872924" y3="-1.80115907" z3="6.53807632">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59733255" y3="-0.22182785" z3="7.0250985">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8434599" y3="0.43348894" z3="6.57667621">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43618431" y3="0.97671914" z3="7.70552205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.39094217" y3="0.235903" z3="8.52501284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21400323" y3="0.6391947" z3="6.99705932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.77203174" y3="1.93750248" z3="8.14166186">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.08036497" y3="1.1144362" z3="7.01712973">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79867859" y3="0.14691014" z3="6.57089344">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.14058215" y3="1.85075181" z3="6.19683583">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.97117717" y3="1.54121632" z3="7.97202732">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73050616" y3="0.73398516" z3="8.68522408">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.3145945" y3="2.41092745" z3="8.57882038">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.69424806" y3="2.0040335" z3="7.28773054">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.68231693" y3="2.56911052" z3="6.20383792">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.82518152" y3="2.09653946" z3="7.98368938">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9937,1.0536,3.8102;-1.3611,1.3977,2.8245;.0684,1.349,3.8956;-1.5615,1.6024,4.5818;-1.1596,-.4592,3.9561;-.799,-.7726,4.9516;-.5163,-.9699,3.2124;-2.6017,-.9452,3.7705;-2.6229,-2.0483,3.8589;-2.9137,-.7104,2.7319;-3.6405,-.3614,4.7408;-4.6409,-.6731,4.393;-3.6103,.7434,4.7238;-3.5196,-.8726,6.1853;-2.336,-.7474,8.4057;-3.2293,-1.3223,8.7141;-2.2152,.0838,9.137;-1.0984,-1.6568,8.5343;-.9531,-1.9508,9.5961;-.203,-1.0698,8.2489;-1.1822,-2.918,7.675;-1.3312,-2.6172,6.6221;-2.0975,-3.4729,7.9473;.0304,-3.849,7.7747;-.1801,-4.7698,7.1981;.1683,-4.172,8.8259;1.3361,-3.2388,7.2624;1.6576,-2.3841,7.8826;2.1573,-3.9789,7.2631;1.2136,-2.8667,6.2288;-4.2873,-1.8012,6.5381;-2.5973,-.2218,7.0251;-1.8435,.4335,6.5767;-7.4362,.9767,7.7055;-7.3909,.2359,8.525;-8.214,.6392,6.9971;-7.772,1.9375,8.1417;-6.0804,1.1144,7.0171;-5.7987,.1469,6.5709;-6.1406,1.8508,6.1968;-4.9712,1.5412,7.972;-4.7305,.734,8.6852;-5.3146,2.4109,8.5788;-3.6942,2.004,7.2877;-3.6823,2.5691,6.2038;-2.8252,2.0965,7.9837;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723958162961</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000669075778 0.000136782671 0.030646688347 0.008512993041</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000642247 0.000057278 0.000099125 0.000177324 0.000331214 0.000461036 0.000668612 0.000767982 0.001027007 0.001301423 0.002401320 0.002992373 0.003050342 0.003341964 0.003850642 0.005268711 0.005572465 0.005950045 0.007435836 0.008108129 0.009814109 0.010730877 0.011178590 0.013013786 0.018351989 0.019376547 0.021127108 0.023828051 0.027974458 0.030760905 0.032969188 0.033959596 0.035449262 0.038634265 0.043060251 0.043451842 0.045471270 0.048190293 0.049697374 0.049831076 0.050433530 0.051603254 0.052092012 0.052830827 0.054059464 0.054484163 0.056977268 0.058385556 0.061399048 0.061612060 0.066065379 0.069336441 0.072345179 0.075939840 0.077418356 0.078275771 0.078590479 0.082165897 0.084254000 0.090969626 0.096110863 0.098683962 0.104064203 0.105043088 0.107895148 0.111322923 0.113581163 0.113859097 0.116839278 0.118743630 0.130887187 0.134984984 0.137416314 0.144311507 0.145726393 0.153646374 0.154599287 0.165984239 0.170554538 0.173589042 0.180569584 0.189132766 0.193418897 0.202210203 0.208417726 0.213299427 0.217834880 0.237858773 0.254532094 0.264318281 0.312477486 0.323229807 0.351120200 0.358951392 0.413837435 0.448965409 0.501758278 0.535384740 0.562118846 0.597186943 0.617259149 0.631847494 0.684422606 0.735403635 0.745363164 0.746292113 0.751482261 0.759285520 0.768492344 0.771233009 0.785084581 0.785554892 0.791302719 0.797691023 0.807034883 0.809354760 0.816013434 0.825046222 0.832741357 0.851122242 0.865241337 0.867921872 0.876842359 0.891983269 0.899350739 0.903980640 0.911489752 0.920749252 0.922274596 0.973528213 1.292939050 1.491281329</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">30</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.98244075" y3="1.04627777" z3="3.80268222">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.34826735" y3="1.39130025" z3="2.81668831">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.08150434" y3="1.33481906" z3="3.88714935">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.54595915" y3="1.59995855" z3="4.57386209">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15856187" y3="-0.46494301" z3="3.95163846">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.8001535" y3="-0.77841516" z3="4.94787014">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.51900567" y3="-0.98132968" z3="3.20866725">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.60407797" y3="-0.94115266" z3="3.76799003">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.63296662" y3="-2.04398527" z3="3.85757232">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.91599906" y3="-0.70504214" z3="2.72956138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.63661116" y3="-0.34989321" z3="4.74034072">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.64000508" y3="-0.65435901" z3="4.39464668">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.59909291" y3="0.75463471" z3="4.72237955">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.51528131" y3="-0.8634601" z3="6.18448294">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32961865" y3="-0.74152853" z3="8.40405001">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22476633" y3="-1.31324751" z3="8.71327444">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.20684557" y3="0.09100364" z3="9.13364751">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09497588" y3="-1.65450814" z3="8.53554076">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.95035993" y3="-1.94610607" z3="9.59820119">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19766345" y3="-1.07142302" z3="8.24806172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.18397907" y3="-2.91746033" z3="7.67954902">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.33423495" y3="-2.61837353" z3="6.62641134">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.10044664" y3="-3.46893376" z3="7.95489467">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.02600874" y3="-3.85188178" z3="7.77906843">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.18835175" y3="-4.77342646" z3="7.20514071">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16498346" y3="-4.17283724" z3="8.83073304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.3323634" y3="-3.24672723" z3="7.26285778">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.65721758" y3="-2.39119815" z3="7.87997688">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.1516765" y3="-3.98911751" z3="7.26412579">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.20898272" y3="-2.87718832" z3="6.22843923">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.28592875" y3="-1.79106869" z3="6.53603209">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58853768" y3="-0.2193393" z3="7.0219788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84121777" y3="0.44467474" z3="6.57654429">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43659274" y3="0.95582129" z3="7.70843284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37948573" y3="0.20525631" z3="8.51873381">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2127462" y3="0.61699155" z3="6.99817019">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.78328224" y3="1.90783185" z3="8.15705937">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.08422366" y3="1.11748474" z3="7.01736463">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79206266" y3="0.15749022" z3="6.56047533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.15531895" y3="1.86196205" z3="6.20491323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.97736827" y3="1.54562193" z3="7.97416672">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.72779216" y3="0.73353261" z3="8.67875227">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.32616858" y3="2.40650297" z3="8.59040341">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.70673754" y3="2.02540616" z3="7.2919269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.69688679" y3="2.58980344" z3="6.20945271">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.8326912" y3="2.1110282" z3="7.98397767">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9824,1.0463,3.8027;-1.3483,1.3913,2.8167;.0815,1.3348,3.8871;-1.546,1.6,4.5739;-1.1586,-.4649,3.9516;-.8002,-.7784,4.9479;-.519,-.9813,3.2087;-2.6041,-.9412,3.768;-2.633,-2.044,3.8576;-2.916,-.705,2.7296;-3.6366,-.3499,4.7403;-4.64,-.6544,4.3946;-3.5991,.7546,4.7224;-3.5153,-.8635,6.1845;-2.3296,-.7415,8.4041;-3.2248,-1.3132,8.7133;-2.2068,.091,9.1336;-1.095,-1.6545,8.5355;-.9504,-1.9461,9.5982;-.1977,-1.0714,8.2481;-1.184,-2.9175,7.6795;-1.3342,-2.6184,6.6264;-2.1004,-3.4689,7.9549;.026,-3.8519,7.7791;-.1884,-4.7734,7.2051;.165,-4.1728,8.8307;1.3324,-3.2467,7.2629;1.6572,-2.3912,7.88;2.1517,-3.9891,7.2641;1.209,-2.8772,6.2284;-4.2859,-1.7911,6.536;-2.5885,-.2193,7.022;-1.8412,.4447,6.5765;-7.4366,.9558,7.7084;-7.3795,.2053,8.5187;-8.2127,.617,6.9982;-7.7833,1.9078,8.1571;-6.0842,1.1175,7.0174;-5.7921,.1575,6.5605;-6.1553,1.862,6.2049;-4.9774,1.5456,7.9742;-4.7278,.7335,8.6788;-5.3262,2.4065,8.5904;-3.7067,2.0254,7.2919;-3.6969,2.5898,6.2095;-2.8327,2.111,7.984;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723961502918</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001111790762 0.000221989842 0.022495862432 0.008513121982</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000287651 -0.000216302 0.000066810 0.000111705 0.000329618 0.000513869 0.000684853 0.000764128 0.001032623 0.001317176 0.002415613 0.002997984 0.003053265 0.003344342 0.003864969 0.005270034 0.005572471 0.005950243 0.007440000 0.008108314 0.009814310 0.010735543 0.011181917 0.013013842 0.018352092 0.019378978 0.021128553 0.023827956 0.027974401 0.030766893 0.032969163 0.033959570 0.035450947 0.038634652 0.043059856 0.043452340 0.045472413 0.048191989 0.049698939 0.049831634 0.050437416 0.051603967 0.052092073 0.052829211 0.054061541 0.054483932 0.056976833 0.058384498 0.061397341 0.061609528 0.066066037 0.069336151 0.072345391 0.075939297 0.077417941 0.078277335 0.078589727 0.082165705 0.084251913 0.090969586 0.096110923 0.098684061 0.104065991 0.105043688 0.107894888 0.111323188 0.113581606 0.113860429 0.116839181 0.118744114 0.130887109 0.134985090 0.137416261 0.144310561 0.145725988 0.153646155 0.154603303 0.165984461 0.170554359 0.173589288 0.180569532 0.189140896 0.193419161 0.202210588 0.208431873 0.213299916 0.217866131 0.237884637 0.254533324 0.264315199 0.312477568 0.323228465 0.351120056 0.358967494 0.413837504 0.448965505 0.501758409 0.535412009 0.562119035 0.597187052 0.617264529 0.631850438 0.684424079 0.735439709 0.745363081 0.746293090 0.751482413 0.759285508 0.768490995 0.771233116 0.785084521 0.785555258 0.791303975 0.797691039 0.807035060 0.809354836 0.816016055 0.825045960 0.832741298 0.851122166 0.865239787 0.867924923 0.876875021 0.891985499 0.899351444 0.903981887 0.911490705 0.920749795 0.922274208 0.973537675 1.293007893 1.491280818</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">31</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.99729509" y3="1.05475615" z3="3.80324151">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.37076322" y3="1.39822296" z3="2.81955996">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.06499481" y3="1.35079182" z3="3.88238474">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.56050125" y3="1.60364041" z3="4.57819728">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16199988" y3="-0.45771098" z3="3.95110517">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79905127" y3="-0.76947156" z3="4.94616361">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.52047359" y3="-0.96863511" z3="3.20606614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.60414075" y3="-0.94460831" z3="3.76997602">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.62485133" y3="-2.04739615" z3="3.86105018">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.91829652" y3="-0.71245785" z3="2.73131225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.64081692" y3="-0.35926315" z3="4.74150415">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.64223927" y3="-0.66783135" z3="4.39386817">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.60800855" y3="0.74545315" z3="4.72364946">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.52161436" y3="-0.87298734" z3="6.18611103">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33491995" y3="-0.75810318" z3="8.40545391">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22967034" y3="-1.33286795" z3="8.70994845">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.21734443" y3="0.07324148" z3="9.13734473">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09766426" y3="-1.66730172" z3="8.54052169">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.95735735" y3="-1.96191554" z3="9.602925">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.20106017" y3="-1.08009494" z3="8.25968872">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.17732074" y3="-2.92754044" z3="7.67983846">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.32713954" y3="-2.6250475" z3="6.62758456">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.0908801" y3="-3.4856607" z3="7.95138053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.03799132" y3="-3.8552395" z3="7.77833721">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.1694334" y3="-4.77544332" z3="7.19987211">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.17647637" y3="-4.18011995" z3="8.82883365">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.34199346" y3="-3.24033955" z3="7.26804583">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6612115" y3="-2.38659955" z3="7.89038218">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.16518774" y3="-3.97834742" z3="7.26692287">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.21865173" y3="-2.86579249" z3="6.23548184">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.29851113" y3="-1.79593092" z3="6.53784969">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59032371" y3="-0.23508367" z3="7.02299871">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8426426" y3="0.42861456" z3="6.57896645">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43580398" y3="0.97228346" z3="7.70479329">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.38258739" y3="0.22492347" z3="8.51803579">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21151959" y3="0.6330375" z3="6.9953359">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.78039376" y3="1.92689011" z3="8.14923831">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.08183901" y3="1.12759513" z3="7.01419583">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79150027" y3="0.16518118" z3="6.56074734">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.15002415" y3="1.86956366" z3="6.19907455">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.97468241" y3="1.55583097" z3="7.97051338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.72727295" y3="0.74557714" z3="8.67753013">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.32077663" y3="2.41952116" z3="8.58383865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.70330728" y3="2.02968763" z3="7.28766456">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.69035667" y3="2.58917246" z3="6.20329381">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.82609193" y3="2.10826194" z3="7.97706045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9973,1.0548,3.8032;-1.3708,1.3982,2.8196;.065,1.3508,3.8824;-1.5605,1.6036,4.5782;-1.162,-.4577,3.9511;-.7991,-.7695,4.9462;-.5205,-.9686,3.2061;-2.6041,-.9446,3.77;-2.6249,-2.0474,3.8611;-2.9183,-.7125,2.7313;-3.6408,-.3593,4.7415;-4.6422,-.6678,4.3939;-3.608,.7455,4.7236;-3.5216,-.873,6.1861;-2.3349,-.7581,8.4055;-3.2297,-1.3329,8.7099;-2.2173,.0732,9.1373;-1.0977,-1.6673,8.5405;-.9574,-1.9619,9.6029;-.2011,-1.0801,8.2597;-1.1773,-2.9275,7.6798;-1.3271,-2.625,6.6276;-2.0909,-3.4857,7.9514;.038,-3.8552,7.7783;-.1694,-4.7754,7.1999;.1765,-4.1801,8.8288;1.342,-3.2403,7.268;1.6612,-2.3866,7.8904;2.1652,-3.9783,7.2669;1.2187,-2.8658,6.2355;-4.2985,-1.7959,6.5378;-2.5903,-.2351,7.023;-1.8426,.4286,6.579;-7.4358,.9723,7.7048;-7.3826,.2249,8.518;-8.2115,.633,6.9953;-7.7804,1.9269,8.1492;-6.0818,1.1276,7.0142;-5.7915,.1652,6.5607;-6.15,1.8696,6.1991;-4.9747,1.5558,7.9705;-4.7273,.7456,8.6775;-5.3208,2.4195,8.5838;-3.7033,2.0297,7.2877;-3.6904,2.5892,6.2033;-2.8261,2.1083,7.9771;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723890250429</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001565976565 0.000357307016 0.021706958652 0.008511598210</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000358772 0.000019378 0.000090869 0.000313744 0.000422974 0.000501742 0.000688325 0.000774050 0.001030644 0.001313892 0.002428236 0.002995104 0.003052608 0.003344748 0.003869680 0.005279250 0.005572501 0.005951727 0.007466254 0.008108291 0.009818345 0.010745998 0.011196807 0.013013807 0.018352974 0.019383339 0.021128435 0.023830125 0.027982444 0.030776969 0.032969301 0.033959589 0.035454008 0.038642352 0.043061268 0.043454835 0.045476201 0.048196080 0.049705376 0.049832416 0.050463512 0.051612624 0.052092091 0.052830674 0.054063193 0.054487168 0.056981003 0.058388314 0.061395855 0.061610824 0.066089682 0.069337485 0.072347025 0.075941575 0.077418103 0.078307619 0.078590452 0.082168489 0.084252777 0.090970927 0.096112225 0.098684585 0.104075660 0.105045122 0.107895096 0.111325033 0.113584816 0.113874300 0.116840785 0.118747529 0.130887197 0.134985087 0.137416476 0.144331895 0.145731186 0.153651933 0.154633690 0.165984765 0.170554559 0.173590498 0.180569965 0.189160838 0.193419776 0.202210375 0.208455745 0.213302401 0.217978269 0.237900248 0.254533026 0.264318365 0.312478855 0.323230799 0.351119818 0.358989873 0.413837552 0.448965802 0.501760514 0.535423708 0.562121538 0.597186971 0.617370621 0.631872661 0.684436931 0.735676692 0.745364329 0.746298986 0.751485519 0.759285560 0.768500770 0.771234507 0.785084498 0.785559735 0.791303827 0.797694591 0.807038377 0.809459560 0.816044139 0.825050136 0.832741680 0.851122259 0.865250603 0.867927527 0.876969122 0.892002040 0.899357957 0.903999464 0.911498553 0.920765282 0.922274367 0.973740202 1.293209463 1.491291102</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">32</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.9857364" y3="1.04664629" z3="3.79894398">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.35522141" y3="1.39118115" z3="2.81413501">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.07847469" y3="1.33547855" z3="3.87945139">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.54674445" y3="1.60027556" z3="4.57218924">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.16105212" y3="-0.46453628" z3="3.94851436">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80090461" y3="-0.77760553" z3="4.94424812">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.52262666" y3="-0.98101552" z3="3.20462547">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.60666508" y3="-0.9410414" z3="3.76712601">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.63555208" y3="-2.0437975" z3="3.85703626">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.9200871" y3="-0.70526765" z3="2.72909232">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.63761519" y3="-0.3491396" z3="4.74070095">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.64176047" y3="-0.65239368" z3="4.39592716">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.59878439" y3="0.75538629" z3="4.72370982">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.51523124" y3="-0.86308839" z3="6.18435463">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33094898" y3="-0.74127143" z3="8.40452376">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22604496" y3="-1.31367524" z3="8.71253277">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.20901069" y3="0.09041273" z3="9.13512638">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09616499" y3="-1.65385278" z3="8.53579205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.95264561" y3="-1.94685587" z3="9.59819089">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19877906" y3="-1.07005735" z3="8.25022558">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.18354069" y3="-2.91573218" z3="7.67819414">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.3310295" y3="-2.61556044" z3="6.62501706">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.10076707" y3="-3.46720205" z3="7.95066052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.02599332" y3="-3.85052015" z3="7.77993334">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.18673494" y3="-4.77124498" z3="7.20424515">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16182189" y3="-4.17287504" z3="8.83153381">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.33381548" y3="-3.24479305" z3="7.26849194">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.65669109" y3="-2.39004935" z3="7.8875652">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.15313916" y3="-3.98714596" z3="7.27145157">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.21358438" y3="-2.87400877" z3="6.23418545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.28463616" y3="-1.79131552" z3="6.53611459">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58979505" y3="-0.21703567" z3="7.02310446">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8399375" y3="0.44483133" z3="6.57683728">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43451981" y3="0.95765649" z3="7.70682909">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.38035284" y3="0.20321651" z3="8.51329892">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21179902" y3="0.62608477" z3="6.99529908">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.77622049" y3="1.90811634" z3="8.16053841">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.0824686" y3="1.1173356" z3="7.01618976">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79377895" y3="0.15837604" z3="6.55622609">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.15131944" y3="1.86434471" z3="6.206172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.97486437" y3="1.53986964" z3="7.97444266">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7293675" y3="0.72654586" z3="8.67870502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.32135521" y3="2.40129285" z3="8.59099309">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.70164986" y3="2.01584354" z3="7.29399882">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.69055126" y3="2.58376654" z3="6.21241911">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.83122503" y3="2.10487683" z3="7.98899548">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9857,1.0466,3.7989;-1.3552,1.3912,2.8141;.0785,1.3355,3.8795;-1.5467,1.6003,4.5722;-1.1611,-.4645,3.9485;-.8009,-.7776,4.9442;-.5226,-.981,3.2046;-2.6067,-.941,3.7671;-2.6356,-2.0438,3.857;-2.9201,-.7053,2.7291;-3.6376,-.3491,4.7407;-4.6418,-.6524,4.3959;-3.5988,.7554,4.7237;-3.5152,-.8631,6.1844;-2.3309,-.7413,8.4045;-3.226,-1.3137,8.7125;-2.209,.0904,9.1351;-1.0962,-1.6539,8.5358;-.9526,-1.9469,9.5982;-.1988,-1.0701,8.2502;-1.1835,-2.9157,7.6782;-1.331,-2.6156,6.625;-2.1008,-3.4672,7.9507;.026,-3.8505,7.7799;-.1867,-4.7712,7.2042;.1618,-4.1729,8.8315;1.3338,-3.2448,7.2685;1.6567,-2.39,7.8876;2.1531,-3.9871,7.2715;1.2136,-2.874,6.2342;-4.2846,-1.7913,6.5361;-2.5898,-.217,7.0231;-1.8399,.4448,6.5768;-7.4345,.9577,7.7068;-7.3804,.2032,8.5133;-8.2118,.6261,6.9953;-7.7762,1.9081,8.1605;-6.0825,1.1173,7.0162;-5.7938,.1584,6.5562;-6.1513,1.8643,6.2062;-4.9749,1.5399,7.9744;-4.7294,.7265,8.6787;-5.3214,2.4013,8.591;-3.7016,2.0158,7.294;-3.6906,2.5838,6.2124;-2.8312,2.1049,7.989;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723972877259</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000490637224 0.000137865666 0.023403217611 0.008511609626</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000573874 -0.000081482 0.000091752 0.000266724 0.000343062 0.000476242 0.000647601 0.000875142 0.001069571 0.001335276 0.002435739 0.003007823 0.003072820 0.003388898 0.004038804 0.005276348 0.005575260 0.005959584 0.007488303 0.008108101 0.009818150 0.010765805 0.011193409 0.013016588 0.018355824 0.019437699 0.021202154 0.023829622 0.027981692 0.030807411 0.032969270 0.033961549 0.035487089 0.038640881 0.043070219 0.043454885 0.045481218 0.048228336 0.049719838 0.049840751 0.050490463 0.051616389 0.052092117 0.052833991 0.054083171 0.054491628 0.056977529 0.058387017 0.061393268 0.061609772 0.066067232 0.069336979 0.072347110 0.075946254 0.077417622 0.078304883 0.078590101 0.082168192 0.084285073 0.090982106 0.096114495 0.098684569 0.104085406 0.105043443 0.107895010 0.111324940 0.113581459 0.113862353 0.116840756 0.118745454 0.130887617 0.134989231 0.137417356 0.144340217 0.145731693 0.153647643 0.154643790 0.165989066 0.170554376 0.173587375 0.180571056 0.189183142 0.193424152 0.202223319 0.208513869 0.213297976 0.217970393 0.237873286 0.254561308 0.264281478 0.312489165 0.323237501 0.351130862 0.358992602 0.413838780 0.448982460 0.501761851 0.535442236 0.562121825 0.597187246 0.617365030 0.631883634 0.684441413 0.735674755 0.745365797 0.746298477 0.751494019 0.759286261 0.768513466 0.771238310 0.785091125 0.785559770 0.791323164 0.797694526 0.807047423 0.809493856 0.816044506 0.825051032 0.832778743 0.851128614 0.865261522 0.867973806 0.876953973 0.892010643 0.899362054 0.904004843 0.911510386 0.920798823 0.922275443 0.973752545 1.293231621 1.491353834</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">33</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.97054038" y3="1.03930088" z3="3.80156652">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.33181819" y3="1.38423008" z3="2.81385755">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.09467851" y3="1.32239607" z3="3.88832643">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.53338639" y3="1.5971028" z3="4.57036838">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.15501385" y3="-0.47068318" z3="3.95266988">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79972956" y3="-0.78445673" z3="4.94999873">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.51702534" y3="-0.99180099" z3="3.21163179">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.6027496" y3="-0.93909949" z3="3.7673595">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.63785872" y3="-2.0417543" z3="3.8563843">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.91266098" y3="-0.70062897" z3="2.72892343">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.63237645" y3="-0.34280312" z3="4.73947407">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.63712831" y3="-0.64384492" z3="4.39486342">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.59070264" y3="0.76155733" z3="4.72192604">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.51003842" y3="-0.85555219" z3="6.18311446">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32776053" y3="-0.72502072" z3="8.4041775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22269918" y3="-1.29484981" z3="8.71744875">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.20043837" y3="0.10780021" z3="9.13243142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09489764" y3="-1.64057482" z3="8.53066974">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.94527947" y3="-1.9297808" z3="9.59328897">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19770832" y3="-1.06042433" z3="8.23685777">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.19187289" y3="-2.90584889" z3="7.67876176">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.34320073" y3="-2.61023931" z3="6.62474093">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.110342" y3="-3.45210276" z3="7.95795481">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.0140478" y3="-3.84529654" z3="7.77895866">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.20645987" y3="-4.76865516" z3="7.21006969">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.15456579" y3="-4.16171706" z3="8.83194269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.32164736" y3="-3.2483835" z3="7.25584456">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.65137141" y3="-2.3902423" z3="7.86701605">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.1379995" y3="-3.99397715" z3="7.25974165">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.19725468" y3="-2.88476435" z3="6.21927633">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.2726726" y3="-1.78893392" z3="6.53429932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59085334" y3="-0.20109845" z3="7.02337319">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83978071" y3="0.45686145" z3="6.574993">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43640292" y3="0.94499673" z3="7.71011696">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.38275516" y3="0.19063078" z3="8.51636095">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21396568" y3="0.61415973" z3="6.9982495">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.77792824" y3="1.89542901" z3="8.16403959">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.08410664" y3="1.10486874" z3="7.02023321">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79475115" y3="0.14568927" z3="6.56114823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.15313666" y3="1.8508597" z3="6.20957368">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.97675854" y3="1.5294172" z3="7.97816458">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73136929" y3="0.7174108" z3="8.68370884">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.3246054" y3="2.39100296" z3="8.59292392">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.70355298" y3="2.00662954" z3="7.29744696">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.69537647" y3="2.57926122" z3="6.21753687">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.83583023" y3="2.10338544" z3="7.99607366">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9705,1.0393,3.8016;-1.3318,1.3842,2.8139;.0947,1.3224,3.8883;-1.5334,1.5971,4.5704;-1.155,-.4707,3.9527;-.7997,-.7845,4.95;-.517,-.9918,3.2116;-2.6027,-.9391,3.7674;-2.6379,-2.0418,3.8564;-2.9127,-.7006,2.7289;-3.6324,-.3428,4.7395;-4.6371,-.6438,4.3949;-3.5907,.7616,4.7219;-3.51,-.8556,6.1831;-2.3278,-.725,8.4042;-3.2227,-1.2948,8.7174;-2.2004,.1078,9.1324;-1.0949,-1.6406,8.5307;-.9453,-1.9298,9.5933;-.1977,-1.0604,8.2369;-1.1919,-2.9058,7.6788;-1.3432,-2.6102,6.6247;-2.1103,-3.4521,7.958;.014,-3.8453,7.779;-.2065,-4.7687,7.2101;.1546,-4.1617,8.8319;1.3216,-3.2484,7.2558;1.6514,-2.3902,7.867;2.138,-3.994,7.2597;1.1973,-2.8848,6.2193;-4.2727,-1.7889,6.5343;-2.5909,-.2011,7.0234;-1.8398,.4569,6.575;-7.4364,.945,7.7101;-7.3828,.1906,8.5164;-8.214,.6142,6.9982;-7.7779,1.8954,8.164;-6.0841,1.1049,7.0202;-5.7948,.1457,6.5611;-6.1531,1.8509,6.2096;-4.9768,1.5294,7.9782;-4.7314,.7174,8.6837;-5.3246,2.391,8.5929;-3.7036,2.0066,7.2974;-3.6954,2.5793,6.2175;-2.8358,2.1034,7.9961;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724030124375</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000576872953 0.000133510654 0.024616505873 0.008512709349</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000567297 -0.000088292 0.000088114 0.000249386 0.000302579 0.000448301 0.000655483 0.000867731 0.001068403 0.001350811 0.002430669 0.003011233 0.003074734 0.003400560 0.004058855 0.005274784 0.005577004 0.005961641 0.007481290 0.008108476 0.009822067 0.010762403 0.011191089 0.013016359 0.018355467 0.019436111 0.021203222 0.023829841 0.027984225 0.030806791 0.032969242 0.033961567 0.035486300 0.038640715 0.043069776 0.043454808 0.045481063 0.048227677 0.049719972 0.049840826 0.050490502 0.051616364 0.052092326 0.052833491 0.054081830 0.054494860 0.056977265 0.058386220 0.061392711 0.061609118 0.066065605 0.069336297 0.072346863 0.075945652 0.077417336 0.078303777 0.078589981 0.082168299 0.084285325 0.090982182 0.096114461 0.098684474 0.104084234 0.105043099 0.107895154 0.111324787 0.113581281 0.113862322 0.116840635 0.118745899 0.130887561 0.134989097 0.137417283 0.144341031 0.145731208 0.153646012 0.154642377 0.165988767 0.170554104 0.173586192 0.180570941 0.189181208 0.193423977 0.202224158 0.208506149 0.213296962 0.217969284 0.237870115 0.254561817 0.264296853 0.312489718 0.323239036 0.351131339 0.358994736 0.413839014 0.448982637 0.501761474 0.535443069 0.562121835 0.597187454 0.617361937 0.631882196 0.684440686 0.735669241 0.745365636 0.746298433 0.751493536 0.759286283 0.768513307 0.771237945 0.785091210 0.785559668 0.791322673 0.797694570 0.807047485 0.809493002 0.816043940 0.825051164 0.832778880 0.851128394 0.865259631 0.867972840 0.876954027 0.892010052 0.899361230 0.904004307 0.911509714 0.920797344 0.922275523 0.973746663 1.293223842 1.491354319</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">34</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.95411148" y3="1.03062912" z3="3.80477061">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.30720169" y3="1.37616663" z3="2.81429066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.11221413" y3="1.30757292" z3="3.89791545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.51853212" y3="1.59287838" z3="4.56908487">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.14842397" y3="-0.47801102" z3="3.95730386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79851839" y3="-0.79254664" z3="4.95634943">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.51094825" y3="-1.00402301" z3="3.21932287">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59847669" y3="-0.93771992" z3="3.76779624">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.64029868" y3="-2.04022237" z3="3.85626797">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.9048061" y3="-0.6967786" z3="2.72886942">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.626313" y3="-0.33620349" z3="4.73863549">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.63206713" y3="-0.63478389" z3="4.39470831">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.58144574" y3="0.76796961" z3="4.7200504">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50341822" y3="-0.84754463" z3="6.18239067">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32332579" y3="-0.71080754" z3="8.40421792">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21873561" y3="-1.27776714" z3="8.72144282">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.1912024" y3="0.12269574" z3="9.13062925">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09307482" y3="-1.63012446" z3="8.52718142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.93868242" y3="-1.9163234" z3="9.58988314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19560548" y3="-1.0539681" z3="8.22654166">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.19946757" y3="-2.89788108" z3="7.68012382">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.35520565" y3="-2.60561704" z3="6.62598006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.11875692" y3="-3.43917256" z3="7.96570802">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.00335124" y3="-3.841475" z3="7.77705193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.22461283" y3="-4.76695455" z3="7.21470758">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14999827" y3="-4.15265435" z3="8.83068816">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.30922226" y3="-3.25217491" z3="7.24142393">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.64537683" y3="-2.39095471" z3="7.8446161">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.12337591" y3="-4.00013191" z3="7.24487287">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.178932" y3="-2.89509859" z3="6.2033637">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.26035917" y3="-1.78529252" z3="6.53317453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58926143" y3="-0.18725658" z3="7.02382744">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83943947" y3="0.47374972" z3="6.57495501">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43875868" y3="0.93181373" z3="7.71385301">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.38246311" y3="0.17870324" z3="8.52125945">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21606774" y3="0.59779172" z3="7.00285264">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.78242125" y3="1.88205891" z3="8.16630243">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.08700235" y3="1.09401165" z3="7.02364372">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79533373" y3="0.13505898" z3="6.56583999">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.15776457" y3="1.83889804" z3="6.21211197">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.98095799" y3="1.52277319" z3="7.9810823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7319202" y3="0.71129844" z3="8.68650589">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.33272208" y3="2.38278118" z3="8.59662919">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.70937454" y3="2.00522052" z3="7.29982351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70488485" y3="2.58004343" z3="6.22037828">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.84447737" y3="2.10982907" z3="7.99946028">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9541,1.0306,3.8048;-1.3072,1.3762,2.8143;.1122,1.3076,3.8979;-1.5185,1.5929,4.5691;-1.1484,-.478,3.9573;-.7985,-.7925,4.9563;-.5109,-1.004,3.2193;-2.5985,-.9377,3.7678;-2.6403,-2.0402,3.8563;-2.9048,-.6968,2.7289;-3.6263,-.3362,4.7386;-4.6321,-.6348,4.3947;-3.5814,.768,4.7201;-3.5034,-.8475,6.1824;-2.3233,-.7108,8.4042;-3.2187,-1.2778,8.7214;-2.1912,.1227,9.1306;-1.0931,-1.6301,8.5272;-.9387,-1.9163,9.5899;-.1956,-1.054,8.2265;-1.1995,-2.8979,7.6801;-1.3552,-2.6056,6.626;-2.1188,-3.4392,7.9657;.0034,-3.8415,7.7771;-.2246,-4.767,7.2147;.15,-4.1527,8.8307;1.3092,-3.2522,7.2414;1.6454,-2.391,7.8446;2.1234,-4.0001,7.2449;1.1789,-2.8951,6.2034;-4.2604,-1.7853,6.5332;-2.5893,-.1873,7.0238;-1.8394,.4737,6.575;-7.4388,.9318,7.7139;-7.3825,.1787,8.5213;-8.2161,.5978,7.0029;-7.7824,1.8821,8.1663;-6.087,1.094,7.0236;-5.7953,.1351,6.5658;-6.1578,1.8389,6.2121;-4.981,1.5228,7.9811;-4.7319,.7113,8.6865;-5.3327,2.3828,8.5966;-3.7094,2.0052,7.2998;-3.7049,2.58,6.2204;-2.8445,2.1098,7.9995;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724066849291</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001049590095 0.000192939657 0.026602245974 0.008512170443</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000422145 -0.000086309 0.000083747 0.000150023 0.000304289 0.000436191 0.000614488 0.000863775 0.001068251 0.001350124 0.002434080 0.003011042 0.003074857 0.003403420 0.004060109 0.005274884 0.005577463 0.005961652 0.007486878 0.008108653 0.009821365 0.010763728 0.011191350 0.013016381 0.018355543 0.019437732 0.021204015 0.023830417 0.027991492 0.030808985 0.032969219 0.033961592 0.035494341 0.038640452 0.043076333 0.043455878 0.045481499 0.048237302 0.049720014 0.049840785 0.050490560 0.051615681 0.052092225 0.052832721 0.054083179 0.054498491 0.056976576 0.058385649 0.061392763 0.061608119 0.066065829 0.069335321 0.072346990 0.075944964 0.077417113 0.078305363 0.078589831 0.082171074 0.084285091 0.090987696 0.096115338 0.098684460 0.104084195 0.105043963 0.107894775 0.111324993 0.113581344 0.113862109 0.116840560 0.118746019 0.130887497 0.134988912 0.137417139 0.144341126 0.145730571 0.153644974 0.154644785 0.165988425 0.170553748 0.173585042 0.180571638 0.189183901 0.193423831 0.202229989 0.208512154 0.213295277 0.217974955 0.237870100 0.254563368 0.264294706 0.312490290 0.323240309 0.351131453 0.358995209 0.413839647 0.448983010 0.501761290 0.535447062 0.562121973 0.597187558 0.617371616 0.631889510 0.684444415 0.735679397 0.745366354 0.746299403 0.751495280 0.759286316 0.768519452 0.771238941 0.785092406 0.785559712 0.791326768 0.797695203 0.807047557 0.809494939 0.816051669 0.825051693 0.832778889 0.851128165 0.865262061 0.867976327 0.876953995 0.892017198 0.899363638 0.904011117 0.911512465 0.920800677 0.922275876 0.973801114 1.293261692 1.491356433</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">35</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.93873514" y3="1.02549351" z3="3.80447469">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.28693143" y3="1.37077851" z3="2.81226153">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.12863899" y3="1.29717864" z3="3.90046261">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.50230849" y3="1.59212234" z3="4.56615402">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.14164214" y3="-0.48162262" z3="3.95977283">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79602245" y3="-0.79544635" z3="4.96048417">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.50522357" y3="-1.01260392" z3="3.22440804">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59366152" y3="-0.933907" z3="3.76819577">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.64122449" y3="-2.03605276" z3="3.85708248">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.89748346" y3="-0.69169365" z3="2.72882817">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.61905464" y3="-0.3274129" z3="4.73853155">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62618107" y3="-0.62171698" z3="4.39466109">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.56984195" y3="0.77657436" z3="4.71917065">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.4968763" y3="-0.84033547" z3="6.18199443">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31845867" y3="-0.70321147" z3="8.40467015">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.2150435" y3="-1.26726146" z3="8.72389485">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.18278298" y3="0.13073715" z3="9.12984677">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09086872" y3="-1.62640552" z3="8.5271701">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.93355679" y3="-1.90864789" z3="9.59057783">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19260899" y3="-1.0544874" z3="8.22068912">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.20478438" y3="-2.8976593" z3="7.68611853">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.36857604" y3="-2.60993141" z3="6.63173307">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.12260677" y3="-3.43681274" z3="7.98102646">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.00221205" y3="-3.84210381" z3="7.77817375">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.23711039" y3="-4.77150867" z3="7.22479014">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.15454589" y3="-4.14580416" z3="8.83285671">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.29939961" y3="-3.25862727" z3="7.2249681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.64284866" y3="-2.39290951" z3="7.81801386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.11257097" y3="-4.00768861" z3="7.22640211">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.15943208" y3="-2.90970827" z3="6.18514805">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.25207764" y3="-1.78110473" z3="6.53011481">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58425185" y3="-0.18036859" z3="7.02403469">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83857921" y3="0.48496998" z3="6.57757441">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44310601" y3="0.91977725" z3="7.7163102">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.38609765" y3="0.17396632" z3="8.52957743">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21715091" y3="0.57737383" z3="7.00612106">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79119084" y3="1.87166395" z3="8.16056107">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.0912134" y3="1.08217017" z3="7.0278469">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79403357" y3="0.12094061" z3="6.57902735">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.16458749" y3="1.8195266" z3="6.21017036">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.98864408" y3="1.52498359" z3="7.98363592">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73136596" y3="0.71896653" z3="8.69160679">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34764819" y3="2.38374183" z3="8.59558685">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72185109" y3="2.01868994" z3="7.30154099">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72140285" y3="2.59214873" z3="6.22250562">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.85440836" y3="2.12368487" z3="7.99911217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9387,1.0255,3.8045;-1.2869,1.3708,2.8123;.1286,1.2972,3.9005;-1.5023,1.5921,4.5662;-1.1416,-.4816,3.9598;-.796,-.7954,4.9605;-.5052,-1.0126,3.2244;-2.5937,-.9339,3.7682;-2.6412,-2.0361,3.8571;-2.8975,-.6917,2.7288;-3.6191,-.3274,4.7385;-4.6262,-.6217,4.3947;-3.5698,.7766,4.7192;-3.4969,-.8403,6.182;-2.3185,-.7032,8.4047;-3.215,-1.2673,8.7239;-2.1828,.1307,9.1298;-1.0909,-1.6264,8.5272;-.9336,-1.9086,9.5906;-.1926,-1.0545,8.2207;-1.2048,-2.8977,7.6861;-1.3686,-2.6099,6.6317;-2.1226,-3.4368,7.981;-.0022,-3.8421,7.7782;-.2371,-4.7715,7.2248;.1545,-4.1458,8.8329;1.2994,-3.2586,7.225;1.6428,-2.3929,7.818;2.1126,-4.0077,7.2264;1.1594,-2.9097,6.1851;-4.2521,-1.7811,6.5301;-2.5843,-.1804,7.024;-1.8386,.485,6.5776;-7.4431,.9198,7.7163;-7.3861,.174,8.5296;-8.2172,.5774,7.0061;-7.7912,1.8717,8.1606;-6.0912,1.0822,7.0278;-5.794,.1209,6.579;-6.1646,1.8195,6.2102;-4.9886,1.525,7.9836;-4.7314,.719,8.6916;-5.3476,2.3837,8.5956;-3.7219,2.0187,7.3015;-3.7214,2.5921,6.2225;-2.8544,2.1237,7.9991;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724071113657</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000942922323 0.000217170797 0.023488533573 0.008512226814</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000505240 -0.000138946 0.000037273 0.000181003 0.000294463 0.000447462 0.000655270 0.000863542 0.001069042 0.001360632 0.002434500 0.003012042 0.003074817 0.003419695 0.004097573 0.005277821 0.005586463 0.005961750 0.007488584 0.008109144 0.009822264 0.010763467 0.011191260 0.013015980 0.018355249 0.019438158 0.021205234 0.023830298 0.028007536 0.030807933 0.032969208 0.033961555 0.035503822 0.038640579 0.043089700 0.043463687 0.045481476 0.048249054 0.049720470 0.049841424 0.050491655 0.051614694 0.052092160 0.052831480 0.054085894 0.054505219 0.056976139 0.058384779 0.061392116 0.061607381 0.066068590 0.069332985 0.072346781 0.075944250 0.077417414 0.078305377 0.078589697 0.082173185 0.084285062 0.090997305 0.096116321 0.098684368 0.104083482 0.105044522 0.107894710 0.111325077 0.113582965 0.113866033 0.116840818 0.118746674 0.130887584 0.134989157 0.137416972 0.144339984 0.145732044 0.153644129 0.154643515 0.165988131 0.170553526 0.173584104 0.180572048 0.189183607 0.193424430 0.202253438 0.208522919 0.213295285 0.217973474 0.237874972 0.254564632 0.264337347 0.312489891 0.323255547 0.351132508 0.359025852 0.413839503 0.448982956 0.501763589 0.535451581 0.562123121 0.597187564 0.617373675 0.631894782 0.684445511 0.735689890 0.745366132 0.746299883 0.751496850 0.759286301 0.768519981 0.771239334 0.785092614 0.785559794 0.791329781 0.797695227 0.807047502 0.809496275 0.816051533 0.825051862 0.832780002 0.851130394 0.865277083 0.867983385 0.876990500 0.892020669 0.899363268 0.904011206 0.911511739 0.920801630 0.922276369 0.973819293 1.293278707 1.491356107</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">36</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.92618435" y3="1.01463447" z3="3.8056113">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.2679663" y3="1.36133884" z3="2.81159314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.14241405" y3="1.27967225" z3="3.90611625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.48964139" y3="1.58529724" z3="4.56395882">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.13911455" y3="-0.49116953" z3="3.96202638">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79739494" y3="-0.80633392" z3="4.96378946">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.50455097" y3="-1.02707289" z3="3.2287311">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59388351" y3="-0.93405574" z3="3.76800876">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.64865904" y3="-2.03603509" z3="3.85618795">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.89532686" y3="-0.68897556" z3="2.72861138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.61616951" y3="-0.32210638" z3="4.737972">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62416868" y3="-0.61424851" z3="4.3958589">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.56370373" y3="0.78143054" z3="4.71730887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49249128" y3="-0.8328055" z3="6.18158928">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.316093" y3="-0.68717154" z3="8.40462422">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21250647" y3="-1.24903704" z3="8.72814247">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.1760959" y3="0.14767359" z3="9.12782232">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.0905924" y3="-1.61293625" z3="8.52261625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.92922851" y3="-1.89476139" z3="9.58538936">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.1923803" y3="-1.04353867" z3="8.21177681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.21222192" y3="-2.8841264" z3="7.68289272">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.37515823" y3="-2.59667766" z3="6.62882713">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13278039" y3="-3.41732391" z3="7.97854258">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.01495246" y3="-3.83505234" z3="7.77481487">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.25473022" y3="-4.76333243" z3="7.22273595">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14063737" y3="-4.13844632" z3="8.82896642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.28840514" y3="-3.25900278" z3="7.22074059">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.63455927" y3="-2.39346448" z3="7.81125809">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.09849434" y3="-4.01140922" z3="7.22425044">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.14987875" y3="-2.91212662" z3="6.18074877">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24031512" y3="-1.77844646" z3="6.53013957">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58525204" y3="-0.16469228" z3="7.0244247">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83805512" y3="0.49700551" z3="6.57536507">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44141328" y3="0.9034811" z3="7.71902576">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37673803" y3="0.15047779" z3="8.52710605">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21547123" y3="0.55916092" z3="7.00779364">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79777458" y3="1.85144316" z3="8.17087722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.08954523" y3="1.08001171" z3="7.02906729">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.78892684" y3="0.1242717" z3="6.56789211">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.16563489" y3="1.82715809" z3="6.21942861">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.98705951" y3="1.51404448" z3="7.98754905">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73140253" y3="0.70099913" z3="8.68961304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.345636" y3="2.36857741" z3="8.6078245">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72058213" y3="2.00898951" z3="7.3055841">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72262394" y3="2.58808328" z3="6.2283542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.85593236" y3="2.1210544" z3="8.00633075">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9262,1.0146,3.8056;-1.268,1.3613,2.8116;.1424,1.2797,3.9061;-1.4896,1.5853,4.564;-1.1391,-.4912,3.962;-.7974,-.8063,4.9638;-.5046,-1.0271,3.2287;-2.5939,-.9341,3.768;-2.6487,-2.036,3.8562;-2.8953,-.689,2.7286;-3.6162,-.3221,4.738;-4.6242,-.6142,4.3959;-3.5637,.7814,4.7173;-3.4925,-.8328,6.1816;-2.3161,-.6872,8.4046;-3.2125,-1.249,8.7281;-2.1761,.1477,9.1278;-1.0906,-1.6129,8.5226;-.9292,-1.8948,9.5854;-.1924,-1.0435,8.2118;-1.2122,-2.8841,7.6829;-1.3752,-2.5967,6.6288;-2.1328,-3.4173,7.9785;-.015,-3.8351,7.7748;-.2547,-4.7633,7.2227;.1406,-4.1384,8.829;1.2884,-3.259,7.2207;1.6346,-2.3935,7.8113;2.0985,-4.0114,7.2243;1.1499,-2.9121,6.1807;-4.2403,-1.7784,6.5301;-2.5853,-.1647,7.0244;-1.8381,.497,6.5754;-7.4414,.9035,7.719;-7.3767,.1505,8.5271;-8.2155,.5592,7.0078;-7.7978,1.8514,8.1709;-6.0895,1.08,7.0291;-5.7889,.1243,6.5679;-6.1656,1.8272,6.2194;-4.9871,1.514,7.9875;-4.7314,.701,8.6896;-5.3456,2.3686,8.6078;-3.7206,2.009,7.3056;-3.7226,2.5881,6.2284;-2.8559,2.1211,8.0063;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724106020499</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001588149383 0.000373622057 0.029422303306 0.008512615841</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000642230 0.000003928 0.000061761 0.000177714 0.000312337 0.000446303 0.000653921 0.000885316 0.001070507 0.001412596 0.002447476 0.003023521 0.003097021 0.003482123 0.004316427 0.005301904 0.005604611 0.005983475 0.007493519 0.008114123 0.009834569 0.010766615 0.011191085 0.013017265 0.018355248 0.019438770 0.021214228 0.023830634 0.028043976 0.030840269 0.032969478 0.033962247 0.035502538 0.038640593 0.043087484 0.043463600 0.045481901 0.048247928 0.049733910 0.049848927 0.050551346 0.051622666 0.052095308 0.052833389 0.054086906 0.054549646 0.056990861 0.058384744 0.061394478 0.061607038 0.066095490 0.069335771 0.072347171 0.075946420 0.077418767 0.078311772 0.078595818 0.082173216 0.084292670 0.090995970 0.096116213 0.098684365 0.104083884 0.105045610 0.107896222 0.111324991 0.113586763 0.113895709 0.116845364 0.118759116 0.130887728 0.134990199 0.137416878 0.144349079 0.145732261 0.153642993 0.154656975 0.165987745 0.170557236 0.173584928 0.180571817 0.189217021 0.193426473 0.202307584 0.208522166 0.213314302 0.218082375 0.237967792 0.254565085 0.264628133 0.312508119 0.323315009 0.351165027 0.359234230 0.413841121 0.448984998 0.501773874 0.535633399 0.562125353 0.597188135 0.617374776 0.631894754 0.684451082 0.735928461 0.745369409 0.746313166 0.751497023 0.759286717 0.768520046 0.771239391 0.785100262 0.785565075 0.791329871 0.797697015 0.807051591 0.809532238 0.816063072 0.825052174 0.832827248 0.851134531 0.865288809 0.867983767 0.877209668 0.892022702 0.899376373 0.904018960 0.911538755 0.920813743 0.922288537 0.973852280 1.293280388 1.491363885</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">37</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.92149253" y3="1.01069544" z3="3.80803387">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.25980301" y3="1.35573897" z3="2.81237699">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.14719689" y3="1.27400778" z3="3.91080724">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.48598801" y3="1.58367333" z3="4.56421717">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.1370151" y3="-0.49419347" z3="3.96587691">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.7968155" y3="-0.80840485" z3="4.96840029">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.50224088" y3="-1.03207336" z3="3.23429404">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59163205" y3="-0.93525459" z3="3.7697571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.64807536" y3="-2.03684416" z3="3.85858161">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.89065034" y3="-0.69059292" z3="2.72970586">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.61492972" y3="-0.32115402" z3="4.73715377">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.62298849" y3="-0.61369726" z3="4.3946582">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.56224201" y3="0.78258579" z3="4.7164301">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49097615" y3="-0.82829675" z3="6.18122627">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31510434" y3="-0.67126963" z3="8.40422942">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20959072" y3="-1.23286455" z3="8.73331336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.17066585" y3="0.1636848" z3="9.12618952">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08976671" y3="-1.59762504" z3="8.51450921">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.92252928" y3="-1.87862871" z3="9.57671666">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19259167" y3="-1.02946799" z3="8.19777039">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.21780685" y3="-2.87012818" z3="7.67718132">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.37775365" y3="-2.58520954" z3="6.62164808">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.1422223" y3="-3.39706242" z3="7.97280821">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02626809" y3="-3.8276244" z3="7.77355182">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27120911" y3="-4.75662137" z3="7.2239231">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.12602869" y3="-4.1284269" z3="8.82947766">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.28168128" y3="-3.26041807" z3="7.21916551">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.63198593" y3="-2.39407477" z3="7.80719947">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.08761949" y3="-4.01731886" z3="7.22693036">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.14687369" y3="-2.91693228" z3="6.17704517">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23114739" y3="-1.77802206" z3="6.5317622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59186807" y3="-0.14675468" z3="7.02603504">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8382135" y3="0.50336938" z3="6.57082995">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43997965" y3="0.89780505" z3="7.72095863">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.3827987" y3="0.13194264" z3="8.51624785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21845144" y3="0.57668746" z3="7.00659736">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.78068699" y3="1.8400647" z3="8.19039206">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.0907228" y3="1.07169615" z3="7.02953211">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79864389" y3="0.11954253" z3="6.55905312">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.16526888" y3="1.82613602" z3="6.2268923">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.98380955" y3="1.49445696" z3="7.98876877">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73868097" y3="0.6818481" z3="8.69302428">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.33455297" y3="2.35285705" z3="8.60434053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71099294" y3="1.97956721" z3="7.30813779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71377438" y3="2.56797098" z3="6.23369338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.85540492" y3="2.10508672" z3="8.01844418">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9215,1.0107,3.808;-1.2598,1.3557,2.8124;.1472,1.274,3.9108;-1.486,1.5837,4.5642;-1.137,-.4942,3.9659;-.7968,-.8084,4.9684;-.5022,-1.0321,3.2343;-2.5916,-.9353,3.7698;-2.6481,-2.0368,3.8586;-2.8907,-.6906,2.7297;-3.6149,-.3212,4.7372;-4.623,-.6137,4.3947;-3.5622,.7826,4.7164;-3.491,-.8283,6.1812;-2.3151,-.6713,8.4042;-3.2096,-1.2329,8.7333;-2.1707,.1637,9.1262;-1.0898,-1.5976,8.5145;-.9225,-1.8786,9.5767;-.1926,-1.0295,8.1978;-1.2178,-2.8701,7.6772;-1.3778,-2.5852,6.6216;-2.1422,-3.3971,7.9728;-.0263,-3.8276,7.7736;-.2712,-4.7566,7.2239;.126,-4.1284,8.8295;1.2817,-3.2604,7.2192;1.632,-2.3941,7.8072;2.0876,-4.0173,7.2269;1.1469,-2.9169,6.177;-4.2311,-1.778,6.5318;-2.5919,-.1468,7.026;-1.8382,.5034,6.5708;-7.44,.8978,7.721;-7.3828,.1319,8.5162;-8.2185,.5767,7.0066;-7.7807,1.8401,8.1904;-6.0907,1.0717,7.0295;-5.7986,.1195,6.5591;-6.1653,1.8261,6.2269;-4.9838,1.4945,7.9888;-4.7387,.6818,8.693;-5.3346,2.3529,8.6043;-3.711,1.9796,7.3081;-3.7138,2.568,6.2337;-2.8554,2.1051,8.0184;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724137730964</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001532760144 0.000323880941 0.024175662739 0.008511712461</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000951451 0.000012339 0.000131805 0.000202304 0.000319861 0.000447430 0.000703962 0.000926129 0.001076188 0.001430829 0.002456536 0.003023154 0.003112623 0.003519262 0.004454396 0.005316915 0.005628932 0.006034972 0.007494956 0.008122558 0.009881355 0.010767421 0.011192363 0.013017677 0.018355277 0.019439273 0.021233248 0.023831789 0.028135656 0.030859762 0.032969393 0.033962414 0.035502193 0.038643790 0.043086625 0.043464033 0.045481941 0.048249201 0.049744547 0.049861978 0.050601213 0.051635422 0.052096069 0.052836489 0.054088717 0.054621343 0.057001282 0.058387106 0.061395498 0.061611231 0.066099781 0.069343297 0.072347275 0.075947523 0.077418732 0.078311576 0.078602020 0.082175783 0.084302929 0.091001011 0.096116273 0.098684955 0.104090168 0.105048285 0.107898170 0.111327535 0.113589275 0.113907856 0.116850833 0.118762650 0.130887846 0.134991833 0.137419577 0.144400205 0.145735940 0.153643325 0.154662695 0.165989926 0.170559987 0.173584244 0.180575103 0.189215452 0.193430097 0.202307602 0.208547097 0.213325275 0.218070037 0.237980003 0.254567150 0.265010164 0.312531670 0.323372466 0.351175045 0.359268592 0.413843835 0.448986351 0.501780378 0.535687408 0.562126434 0.597188652 0.617478546 0.631907388 0.684454309 0.735977000 0.745369280 0.746313004 0.751498840 0.759286743 0.768542596 0.771241085 0.785100530 0.785565715 0.791336682 0.797697313 0.807053758 0.809652031 0.816071111 0.825053004 0.832945075 0.851134546 0.865320798 0.867987490 0.877239858 0.892028367 0.899376641 0.904020529 0.911540813 0.920835499 0.922321336 0.973926522 1.293396572 1.491413270</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">38</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.90559612" y3="0.9993243" z3="3.81065154">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.23562735" y3="1.34321849" z3="2.81168467">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.16434769" y3="1.25616776" z3="3.91910331">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.47133294" y3="1.57839748" z3="4.56137549">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.13184338" y3="-0.50400166" z3="3.97292757">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79805136" y3="-0.81725085" z3="4.97809913">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.4974079" y3="-1.04871271" z3="3.24575396">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58902293" y3="-0.93595588" z3="3.77286364">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65266875" y3="-2.0374033" z3="3.86252814">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88420668" y3="-0.69009344" z3="2.73195715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.61075466" y3="-0.315339" z3="4.73806741">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61941898" y3="-0.60641818" z3="4.39638619">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.55518174" y3="0.78821355" z3="4.71483686">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48631367" y3="-0.81994207" z3="6.18275503">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30821835" y3="-0.65954694" z3="8.40440078">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20211118" y3="-1.21916818" z3="8.73830766">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15873274" y3="0.17557552" z3="9.12486408">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08499992" y3="-1.58909882" z3="8.50935635">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91248335" y3="-1.86872134" z3="9.57094653">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18812713" y3="-1.02412825" z3="8.18656336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22210397" y3="-2.86248439" z3="7.67499608">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.38419616" y3="-2.57888763" z3="6.61966145">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14828983" y3="-3.38379831" z3="7.97423774">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03497262" y3="-3.82537503" z3="7.76901509">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.28602692" y3="-4.75383568" z3="7.2220138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.11967029" y3="-4.12485202" z3="8.82468612">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.27297995" y3="-3.26502361" z3="7.20908962">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62757353" y3="-2.3983232" z3="7.79324662">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07628521" y3="-4.02450155" z3="7.21684091">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.13592543" y3="-2.92433481" z3="6.16657752">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22188853" y3="-1.77220827" z3="6.53401887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58984374" y3="-0.13483471" z3="7.02717548">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83930719" y3="0.52103875" z3="6.57143291">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44321845" y3="0.88244021" z3="7.72386445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37696496" y3="0.10942641" z3="8.51214924">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22218893" y3="0.56043235" z3="7.00914688">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79141862" y3="1.81866487" z3="8.20244965">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.09618471" y3="1.07216407" z3="7.03055002">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79853122" y3="0.12536732" z3="6.55151065">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.17674084" y3="1.83231752" z3="6.23404188">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.98981791" y3="1.49324993" z3="7.99055664">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7400427" y3="0.67514926" z3="8.68854517">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34446735" y3="2.3459824" z3="8.61493731">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71963928" y3="1.98522333" z3="7.30952358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.7263125" y3="2.57474685" z3="6.23476278">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.86649535" y3="2.11759568" z3="8.01942899">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9056,.9993,3.8107;-1.2356,1.3432,2.8117;.1643,1.2562,3.9191;-1.4713,1.5784,4.5614;-1.1318,-.504,3.9729;-.7981,-.8173,4.9781;-.4974,-1.0487,3.2458;-2.589,-.936,3.7729;-2.6527,-2.0374,3.8625;-2.8842,-.6901,2.732;-3.6108,-.3153,4.7381;-4.6194,-.6064,4.3964;-3.5552,.7882,4.7148;-3.4863,-.8199,6.1828;-2.3082,-.6595,8.4044;-3.2021,-1.2192,8.7383;-2.1587,.1756,9.1249;-1.085,-1.5891,8.5094;-.9125,-1.8687,9.5709;-.1881,-1.0241,8.1866;-1.2221,-2.8625,7.675;-1.3842,-2.5789,6.6197;-2.1483,-3.3838,7.9742;-.035,-3.8254,7.769;-.286,-4.7538,7.222;.1197,-4.1249,8.8247;1.273,-3.265,7.2091;1.6276,-2.3983,7.7932;2.0763,-4.0245,7.2168;1.1359,-2.9243,6.1666;-4.2219,-1.7722,6.534;-2.5898,-.1348,7.0272;-1.8393,.521,6.5714;-7.4432,.8824,7.7239;-7.377,.1094,8.5121;-8.2222,.5604,7.0091;-7.7914,1.8187,8.2024;-6.0962,1.0722,7.0306;-5.7985,.1254,6.5515;-6.1767,1.8323,6.234;-4.9898,1.4932,7.9906;-4.74,.6751,8.6885;-5.3445,2.346,8.6149;-3.7196,1.9852,7.3095;-3.7263,2.5747,6.2348;-2.8665,2.1176,8.0194;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724149463239</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002398937618 0.000329303776 0.025328453293 0.008516970234</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.001065235 0.000013422 0.000134170 0.000227001 0.000334078 0.000451697 0.000703552 0.000925986 0.001076342 0.001430769 0.002459045 0.003025387 0.003116322 0.003517223 0.004459653 0.005315672 0.005640821 0.006044762 0.007504103 0.008121843 0.009909098 0.010767306 0.011198727 0.013018126 0.018356887 0.019439151 0.021229857 0.023831556 0.028189986 0.030857414 0.032969356 0.033962410 0.035514051 0.038644806 0.043097191 0.043464091 0.045481942 0.048263066 0.049743951 0.049862924 0.050599794 0.051633353 0.052097359 0.052834785 0.054088612 0.054651019 0.057000146 0.058393104 0.061394727 0.061608843 0.066102931 0.069340894 0.072349133 0.075947081 0.077420751 0.078310312 0.078602827 0.082179379 0.084299624 0.091000239 0.096117090 0.098686511 0.104096590 0.105053255 0.107899071 0.111330485 0.113590914 0.113913114 0.116851632 0.118762826 0.130887709 0.134992843 0.137419718 0.144399190 0.145735038 0.153641984 0.154661773 0.165991314 0.170560403 0.173582966 0.180574070 0.189217609 0.193434126 0.202348520 0.208579147 0.213336673 0.218091114 0.237984684 0.254568536 0.265116636 0.312542311 0.323390697 0.351185202 0.359275726 0.413843594 0.448987148 0.501785419 0.535686055 0.562127798 0.597189084 0.617523042 0.631929805 0.684467779 0.735980874 0.745370115 0.746313591 0.751501563 0.759287190 0.768547333 0.771241345 0.785102476 0.785565674 0.791348487 0.797698598 0.807054314 0.809652639 0.816084592 0.825053268 0.832945905 0.851134983 0.865329925 0.868006964 0.877278300 0.892038709 0.899376378 0.904031314 0.911544545 0.920837236 0.922326126 0.974030427 1.293686576 1.491415464</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">39</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.89459309" y3="0.99259497" z3="3.81429545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.21875508" y3="1.33233294" z3="2.81216066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.17486136" y3="1.24766974" z3="3.9271114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.46247346" y3="1.57594423" z3="4.55971179">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12482545" y3="-0.50877686" z3="3.98178221">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79422408" y3="-0.8182566" z3="4.98891552">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48994094" y3="-1.05784627" z3="3.2587119">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58195805" y3="-0.93801216" z3="3.77894673">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.64818225" y3="-2.03861615" z3="3.87225922">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87302749" y3="-0.69535468" z3="2.73625638">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60581899" y3="-0.31228767" z3="4.73855353">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61382005" y3="-0.60343025" z3="4.39485266">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54924252" y3="0.79107439" z3="4.71200529">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48523315" y3="-0.81177466" z3="6.18503746">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30491156" y3="-0.64468092" z3="8.40551937">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19763083" y3="-1.20226329" z3="8.74611067">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14879139" y3="0.19071323" z3="9.12424174">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08287776" y3="-1.5769266" z3="8.50234682">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.9025315" y3="-1.85412486" z3="9.56338631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.187168" y3="-1.01488559" z3="8.17071953">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22917702" y3="-2.85278834" z3="7.67289252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.39502687" y3="-2.57334446" z3="6.61676633">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15596229" y3="-3.36954546" z3="7.97866669">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.04606114" y3="-3.82078741" z3="7.76531358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.30459419" y3="-4.75036275" z3="7.22303093">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.11156254" y3="-4.11690046" z3="8.8217908">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26282859" y3="-3.26960935" z3="7.19721363">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62500662" y3="-2.40216504" z3="7.77639553">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06194765" y3="-4.03369554" z3="7.20468713">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.1235079" y3="-2.93269902" z3="6.15355304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.21857081" y3="-1.76495112" z3="6.53743876">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59285354" y3="-0.1189945" z3="7.02970397">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83864623" y3="0.52554433" z3="6.57033801">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44422424" y3="0.86669356" z3="7.72786363">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.3695442" y3="0.08409795" z3="8.50612181">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22529029" y3="0.5489607" z3="7.012897">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79561922" y3="1.7952629" z3="8.21951878">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10106606" y3="1.07261636" z3="7.03035055">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80183652" y3="0.13342545" z3="6.53710964">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.18929623" y3="1.84296541" z3="6.24375252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99207466" y3="1.48670356" z3="7.99026415">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74749397" y3="0.66742691" z3="8.68752729">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34196611" y3="2.34003196" z3="8.6140663">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71999881" y3="1.97561398" z3="7.30846992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72808243" y3="2.56729458" z3="6.23483631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87029305" y3="2.11656908" z3="8.02439477">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8946,.9926,3.8143;-1.2188,1.3323,2.8122;.1749,1.2477,3.9271;-1.4625,1.5759,4.5597;-1.1248,-.5088,3.9818;-.7942,-.8183,4.9889;-.4899,-1.0578,3.2587;-2.582,-.938,3.7789;-2.6482,-2.0386,3.8723;-2.873,-.6954,2.7363;-3.6058,-.3123,4.7386;-4.6138,-.6034,4.3949;-3.5492,.7911,4.712;-3.4852,-.8118,6.185;-2.3049,-.6447,8.4055;-3.1976,-1.2023,8.7461;-2.1488,.1907,9.1242;-1.0829,-1.5769,8.5023;-.9025,-1.8541,9.5634;-.1872,-1.0149,8.1707;-1.2292,-2.8528,7.6729;-1.395,-2.5733,6.6168;-2.156,-3.3695,7.9787;-.0461,-3.8208,7.7653;-.3046,-4.7504,7.223;.1116,-4.1169,8.8218;1.2628,-3.2696,7.1972;1.625,-2.4022,7.7764;2.0619,-4.0337,7.2047;1.1235,-2.9327,6.1536;-4.2186,-1.765,6.5374;-2.5929,-.119,7.0297;-1.8386,.5255,6.5703;-7.4442,.8667,7.7279;-7.3695,.0841,8.5061;-8.2253,.549,7.0129;-7.7956,1.7953,8.2195;-6.1011,1.0726,7.0304;-5.8018,.1334,6.5371;-6.1893,1.843,6.2438;-4.9921,1.4867,7.9903;-4.7475,.6674,8.6875;-5.342,2.34,8.6141;-3.72,1.9756,7.3085;-3.7281,2.5673,6.2348;-2.8703,2.1166,8.0244;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724153668611</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002498084387 0.000439930525 0.028477164653 0.008504841320</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.001059984 -0.000221813 0.000127562 0.000198691 0.000329133 0.000452086 0.000703160 0.000925871 0.001078380 0.001431397 0.002465196 0.003033940 0.003142890 0.003517911 0.004460538 0.005321852 0.005650374 0.006044654 0.007520962 0.008133860 0.009928758 0.010767344 0.011198306 0.013020694 0.018357393 0.019442615 0.021233378 0.023832137 0.028229953 0.030873863 0.032969346 0.033962382 0.035555489 0.038644814 0.043125581 0.043472705 0.045482001 0.048284629 0.049745348 0.049862754 0.050601733 0.051633989 0.052097358 0.052834281 0.054099854 0.054668805 0.056999062 0.058405143 0.061393773 0.061608341 0.066100962 0.069339149 0.072351040 0.075946688 0.077420398 0.078311950 0.078603765 0.082186822 0.084303550 0.091006341 0.096118702 0.098687967 0.104104240 0.105057239 0.107900305 0.111332825 0.113590428 0.113911834 0.116852652 0.118766293 0.130887612 0.134994334 0.137420608 0.144409417 0.145734347 0.153641755 0.154668331 0.165992851 0.170560182 0.173582083 0.180573608 0.189256329 0.193435749 0.202339323 0.208635873 0.213351552 0.218142172 0.237994479 0.254593006 0.265118366 0.312541635 0.323392405 0.351185161 0.359306495 0.413843711 0.448991699 0.501789252 0.535706229 0.562131322 0.597189363 0.617605025 0.631979541 0.684489528 0.735990197 0.745373283 0.746315860 0.751512886 0.759287334 0.768551040 0.771245268 0.785104385 0.785565528 0.791361394 0.797703508 0.807057504 0.809654140 0.816112879 0.825054259 0.832951439 0.851135026 0.865377531 0.868037591 0.877279127 0.892067358 0.899380267 0.904055030 0.911557730 0.920841136 0.922335845 0.974276684 1.293957759 1.491415789</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">40</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.87651451" y3="0.97910578" z3="3.82160878">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.19027792" y3="1.31810488" z3="2.81560405">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.19484717" y3="1.226447" z3="3.94205527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.44662316" y3="1.56960543" z3="4.56032098">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11914511" y3="-0.52103498" z3="3.99316748">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79695794" y3="-0.82989322" z3="5.00357648">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48323478" y3="-1.07750243" z3="3.27609678">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57898911" y3="-0.9406339" z3="3.7832669">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65294286" y3="-2.04145846" z3="3.87630689">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86451864" y3="-0.695758" z3="2.73936087">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60276911" y3="-0.30850715" z3="4.73910722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61136101" y3="-0.59676861" z3="4.39374419">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.5419056" y3="0.7949043" z3="4.71188126">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48475388" y3="-0.80665104" z3="6.18602749">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30418221" y3="-0.63724379" z3="8.4071334">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19547159" y3="-1.19479541" z3="8.75085012">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14623293" y3="0.19830352" z3="9.12472404">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08214108" y3="-1.5693934" z3="8.49945962">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89502768" y3="-1.84457097" z3="9.55986571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18879884" y3="-1.00810554" z3="8.16105039">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23475917" y3="-2.8462847" z3="7.67333892">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.40864309" y3="-2.56826634" z3="6.61844722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15921274" y3="-3.36215068" z3="7.98649695">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.05118277" y3="-3.81367588" z3="7.75780188">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.31385528" y3="-4.74341277" z3="7.21873155">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.11532036" y3="-4.10828752" z3="8.81324077">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25174077" y3="-3.26210176" z3="7.17837028">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61697261" y3="-2.393559" z3="7.75303741">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05189791" y3="-4.02450698" z3="7.18086747">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.10276135" y3="-2.92715425" z3="6.13539873">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.21569872" y3="-1.76123238" z3="6.53800918">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.5956597" y3="-0.11141872" z3="7.03228117">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84209799" y3="0.53945253" z3="6.57202593">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44515479" y3="0.85867225" z3="7.72925789">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36930042" y3="0.07219153" z3="8.50211177">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2275106" y3="0.54668169" z3="7.01438582">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79349334" y3="1.78315624" z3="8.22764465">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10453315" y3="1.06854666" z3="7.03109189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8045166" y3="0.13187701" z3="6.53580395">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19494775" y3="1.8396424" z3="6.24699942">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99542323" y3="1.48280858" z3="7.99089819">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74900235" y3="0.6615855" z3="8.68634746">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34744254" y3="2.33444964" z3="8.61753756">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72344055" y3="1.97314003" z3="7.30995787">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73224401" y3="2.56682616" z3="6.23569498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87754225" y3="2.11932301" z3="8.02690141">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8765,.9791,3.8216;-1.1903,1.3181,2.8156;.1948,1.2264,3.9421;-1.4466,1.5696,4.5603;-1.1191,-.521,3.9932;-.797,-.8299,5.0036;-.4832,-1.0775,3.2761;-2.579,-.9406,3.7833;-2.6529,-2.0415,3.8763;-2.8645,-.6958,2.7394;-3.6028,-.3085,4.7391;-4.6114,-.5968,4.3937;-3.5419,.7949,4.7119;-3.4848,-.8067,6.186;-2.3042,-.6372,8.4071;-3.1955,-1.1948,8.7509;-2.1462,.1983,9.1247;-1.0821,-1.5694,8.4995;-.895,-1.8446,9.5599;-.1888,-1.0081,8.1611;-1.2348,-2.8463,7.6733;-1.4086,-2.5683,6.6184;-2.1592,-3.3622,7.9865;-.0512,-3.8137,7.7578;-.3139,-4.7434,7.2187;.1153,-4.1083,8.8132;1.2517,-3.2621,7.1784;1.617,-2.3936,7.753;2.0519,-4.0245,7.1809;1.1028,-2.9272,6.1354;-4.2157,-1.7612,6.538;-2.5957,-.1114,7.0323;-1.8421,.5395,6.572;-7.4452,.8587,7.7293;-7.3693,.0722,8.5021;-8.2275,.5467,7.0144;-7.7935,1.7832,8.2276;-6.1045,1.0685,7.0311;-5.8045,.1319,6.5358;-6.1949,1.8396,6.247;-4.9954,1.4828,7.9909;-4.749,.6616,8.6863;-5.3474,2.3344,8.6175;-3.7234,1.9731,7.31;-3.7322,2.5668,6.2357;-2.8775,2.1193,8.0269;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724150231445</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002496442344 0.000449963748 0.029750231908 0.008505195112</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.001067290 -0.000503009 0.000140347 0.000196645 0.000354326 0.000551374 0.000711513 0.000925744 0.001077946 0.001456104 0.002468761 0.003037801 0.003173357 0.003517719 0.004460609 0.005330799 0.005658938 0.006053587 0.007544204 0.008190212 0.009935184 0.010774430 0.011198342 0.013026968 0.018357208 0.019444477 0.021247546 0.023832191 0.028254043 0.030918477 0.032969523 0.033962361 0.035653871 0.038648044 0.043184724 0.043526116 0.045481965 0.048323499 0.049751735 0.049862787 0.050607196 0.051641048 0.052099603 0.052839261 0.054137117 0.054676380 0.056998264 0.058436783 0.061399588 0.061607481 0.066100974 0.069337374 0.072356584 0.075945617 0.077439221 0.078323612 0.078603605 0.082206859 0.084325427 0.091043713 0.096124543 0.098690351 0.104104545 0.105061572 0.107900385 0.111334461 0.113592121 0.113915455 0.116852882 0.118785958 0.130887911 0.134996601 0.137423503 0.144410494 0.145733222 0.153646429 0.154687822 0.165992424 0.170563683 0.173581269 0.180573847 0.189306735 0.193438952 0.202338742 0.208648079 0.213415852 0.218282058 0.238003849 0.254678931 0.265114811 0.312543952 0.323396965 0.351187641 0.359354102 0.413844640 0.449005821 0.501789190 0.535763126 0.562135036 0.597189748 0.617660476 0.632062211 0.684529284 0.735993009 0.745396497 0.746326501 0.751536313 0.759290014 0.768551133 0.771249361 0.785116856 0.785567191 0.791385787 0.797716213 0.807076393 0.809660507 0.816190803 0.825054819 0.832951542 0.851136720 0.865410837 0.868092847 0.877284082 0.892158656 0.899381784 0.904114095 0.911634551 0.920854287 0.922338712 0.974741733 1.294290293 1.491432217</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">41</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.86466212" y3="0.96776463" z3="3.82317042">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.17579307" y3="1.30694108" z3="2.81692216">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.20669064" y3="1.2105856" z3="3.9446334">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.43161453" y3="1.56145622" z3="4.56068188">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11561519" y3="-0.52981324" z3="3.99556709">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79667799" y3="-0.83887161" z3="5.00657208">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48268334" y3="-1.09033833" z3="3.27969156">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5773681" y3="-0.94067632" z3="3.78484143">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65795106" y3="-2.04058394" z3="3.87842563">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86076445" y3="-0.69476328" z3="2.7407193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59729849" y3="-0.30166913" z3="4.74032528">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60760745" y3="-0.58328105" z3="4.39466366">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.5299891" y3="0.80110101" z3="4.71163298">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48364923" y3="-0.80091736" z3="6.18755001">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.3066932" y3="-0.63850412" z3="8.41021464">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19998017" y3="-1.19528834" z3="8.75009848">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14998827" y3="0.19606719" z3="9.12940052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.0856938" y3="-1.57238432" z3="8.50644269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90099841" y3="-1.8460778" z3="9.56741877">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19121884" y3="-1.01263357" z3="8.16882334">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23730483" y3="-2.85112904" z3="7.68305851">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.42279074" y3="-2.57583994" z3="6.62902278">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15525938" y3="-3.37308217" z3="8.00607438">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.04670319" y3="-3.81107678" z3="7.75768492">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.31139435" y3="-4.745812" z3="7.22662219">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.13509375" y3="-4.09931786" z3="8.81316453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.2466633" y3="-3.25528575" z3="7.15749447">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61661698" y3="-2.38159521" z3="7.72328718">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05041031" y3="-4.01429442" z3="7.15248858">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.0824302" y3="-2.92591599" z3="6.11438079">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.21979882" y3="-1.75319771" z3="6.53659521">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59243555" y3="-0.11116331" z3="7.03452089">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83855747" y3="0.5355068" z3="6.57878041">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44658033" y3="0.84863182" z3="7.72803037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36376273" y3="0.05646088" z3="8.49564034">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22600861" y3="0.5340267" z3="7.01100125">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80424856" y3="1.76742864" z3="8.2332196">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10708337" y3="1.07407112" z3="7.02958545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79937112" y3="0.14171241" z3="6.52879425">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20442622" y3="1.84967601" z3="6.2493257">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00075511" y3="1.49118454" z3="7.99116578">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75182823" y3="0.67103585" z3="8.68544865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35517382" y3="2.34036398" z3="8.61777063">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73060143" y3="1.98892877" z3="7.31140958">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73960584" y3="2.57998292" z3="6.238036">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88193749" y3="2.1310426" z3="8.0274905">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8647,.9678,3.8232;-1.1758,1.3069,2.8169;.2067,1.2106,3.9446;-1.4316,1.5615,4.5607;-1.1156,-.5298,3.9956;-.7967,-.8389,5.0066;-.4827,-1.0903,3.2797;-2.5774,-.9407,3.7848;-2.658,-2.0406,3.8784;-2.8608,-.6948,2.7407;-3.5973,-.3017,4.7403;-4.6076,-.5833,4.3947;-3.53,.8011,4.7116;-3.4836,-.8009,6.1876;-2.3067,-.6385,8.4102;-3.2,-1.1953,8.7501;-2.15,.1961,9.1294;-1.0857,-1.5724,8.5064;-.901,-1.8461,9.5674;-.1912,-1.0126,8.1688;-1.2373,-2.8511,7.6831;-1.4228,-2.5758,6.629;-2.1553,-3.3731,8.0061;-.0467,-3.8111,7.7577;-.3114,-4.7458,7.2266;.1351,-4.0993,8.8132;1.2467,-3.2553,7.1575;1.6166,-2.3816,7.7233;2.0504,-4.0143,7.1525;1.0824,-2.9259,6.1144;-4.2198,-1.7532,6.5366;-2.5924,-.1112,7.0345;-1.8386,.5355,6.5788;-7.4466,.8486,7.728;-7.3638,.0565,8.4956;-8.226,.534,7.011;-7.8042,1.7674,8.2332;-6.1071,1.0741,7.0296;-5.7994,.1417,6.5288;-6.2044,1.8497,6.2493;-5.0008,1.4912,7.9912;-4.7518,.671,8.6854;-5.3552,2.3404,8.6178;-3.7306,1.9889,7.3114;-3.7396,2.58,6.238;-2.8819,2.131,8.0275;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724145826905</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002860634836 0.000534436622 0.029482663406 0.008517393379</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.001739734 -0.000136974 0.000141107 0.000195911 0.000353846 0.000560625 0.000721577 0.000925889 0.001078083 0.001478855 0.002469201 0.003040329 0.003198110 0.003519252 0.004473194 0.005329021 0.005689742 0.006053412 0.007572437 0.008246545 0.009944877 0.010809792 0.011198756 0.013032922 0.018357112 0.019444731 0.021248911 0.023832030 0.028287653 0.030935802 0.032970049 0.033962781 0.035770386 0.038652593 0.043225942 0.043647555 0.045482174 0.048392103 0.049757753 0.049862438 0.050611149 0.051641114 0.052102722 0.052834566 0.054174773 0.054697237 0.056998347 0.058443684 0.061397219 0.061607239 0.066109026 0.069338172 0.072358871 0.075944731 0.077449097 0.078335115 0.078613167 0.082234677 0.084334623 0.091125737 0.096133702 0.098690255 0.104111366 0.105065364 0.107904675 0.111334768 0.113592365 0.113919864 0.116852756 0.118810302 0.130888220 0.134997926 0.137423107 0.144440731 0.145742541 0.153649205 0.154705262 0.165994641 0.170562434 0.173584899 0.180604142 0.189343406 0.193463190 0.202343330 0.208730447 0.213469215 0.218300374 0.238026151 0.254775181 0.265104810 0.312588062 0.323398436 0.351206896 0.359364644 0.413844901 0.449054180 0.501792198 0.535777506 0.562152732 0.597189977 0.617763930 0.632197450 0.684571780 0.736047079 0.745400510 0.746327946 0.751564368 0.759291375 0.768552219 0.771250524 0.785120198 0.785566748 0.791390357 0.797717642 0.807080666 0.809697877 0.816241789 0.825055314 0.832986121 0.851160195 0.865520660 0.868261596 0.877308983 0.892190776 0.899392460 0.904135249 0.911639565 0.920890537 0.922378893 0.975251787 1.294561250 1.491464965</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">42</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.85804678" y3="0.95747972" z3="3.83111202">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.16360875" y3="1.29291932" z3="2.82155421">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.21393061" y3="1.19774311" z3="3.95592247">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.42738672" y3="1.55581271" z3="4.56413071">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11233964" y3="-0.53920905" z3="4.00899183">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79827432" y3="-0.84461512" z3="5.02286669">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47693825" y3="-1.10393072" z3="3.29805353">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57315122" y3="-0.94922134" z3="3.79374499">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65492096" y3="-2.04854035" z3="3.89085893">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.85150309" y3="-0.70670155" z3="2.74751447">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59675631" y3="-0.30734926" z3="4.74300915">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60521605" y3="-0.59002755" z3="4.39410561">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.52880172" y3="0.79521479" z3="4.71265796">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48701064" y3="-0.80324234" z3="6.19140823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31065575" y3="-0.63668701" z3="8.4148586">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20239079" y3="-1.19524882" z3="8.75612439">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15422463" y3="0.19808349" z3="9.13395511">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08758361" y3="-1.56770491" z3="8.5064608">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89628515" y3="-1.83997586" z3="9.56692922">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19612412" y3="-1.00596902" z3="8.16341342">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.24188683" y3="-2.84662119" z3="7.6834605">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.43688246" y3="-2.57078901" z3="6.63167679">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15592985" y3="-3.37138873" z3="8.01326732">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.04687346" y3="-3.80226421" z3="7.74604624">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.31092789" y3="-4.73553663" z3="7.21441309">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14453482" y3="-4.09313391" z3="8.79811699">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.23800323" y3="-3.23906104" z3="7.1381053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.60743313" y3="-2.36726217" z3="7.70422551">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.04541889" y3="-3.99411972" z3="7.12300592">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.06310397" y3="-2.90555301" z3="6.09899632">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22091218" y3="-1.75627816" z3="6.54113774">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59873876" y3="-0.10996277" z3="7.03968601">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.842841" y3="0.53831476" z3="6.58139474">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44594183" y3="0.85193063" z3="7.72277738">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36300664" y3="0.05220383" z3="8.48268225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22757702" y3="0.54480415" z3="7.00337424">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80162622" y3="1.7670161" z3="8.23699507">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10655605" y3="1.08141632" z3="7.02587186">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80127218" y3="0.15292827" z3="6.51594715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20171471" y3="1.86378375" z3="6.25250772">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99927408" y3="1.48682988" z3="7.99118197">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75636671" y3="0.65936623" z3="8.68111518">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35086042" y3="2.33477844" z3="8.62433044">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72557856" y3="1.97792906" z3="7.31482745">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72990917" y3="2.57101504" z3="6.24078921">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88049895" y3="2.1212801" z3="8.03428352">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.858,.9575,3.8311;-1.1636,1.2929,2.8216;.2139,1.1977,3.9559;-1.4274,1.5558,4.5641;-1.1123,-.5392,4.009;-.7983,-.8446,5.0229;-.4769,-1.1039,3.2981;-2.5732,-.9492,3.7937;-2.6549,-2.0485,3.8909;-2.8515,-.7067,2.7475;-3.5968,-.3073,4.743;-4.6052,-.59,4.3941;-3.5288,.7952,4.7127;-3.487,-.8032,6.1914;-2.3107,-.6367,8.4149;-3.2024,-1.1952,8.7561;-2.1542,.1981,9.134;-1.0876,-1.5677,8.5065;-.8963,-1.84,9.5669;-.1961,-1.006,8.1634;-1.2419,-2.8466,7.6835;-1.4369,-2.5708,6.6317;-2.1559,-3.3714,8.0133;-.0469,-3.8023,7.746;-.3109,-4.7355,7.2144;.1445,-4.0931,8.7981;1.238,-3.2391,7.1381;1.6074,-2.3673,7.7042;2.0454,-3.9941,7.123;1.0631,-2.9056,6.099;-4.2209,-1.7563,6.5411;-2.5987,-.11,7.0397;-1.8428,.5383,6.5814;-7.4459,.8519,7.7228;-7.363,.0522,8.4827;-8.2276,.5448,7.0034;-7.8016,1.767,8.237;-6.1066,1.0814,7.0259;-5.8013,.1529,6.5159;-6.2017,1.8638,6.2525;-4.9993,1.4868,7.9912;-4.7564,.6594,8.6811;-5.3509,2.3348,8.6243;-3.7256,1.9779,7.3148;-3.7299,2.571,6.2408;-2.8805,2.1213,8.0343;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724150077421</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001731794840 0.000373844722 0.028116892524 0.008514296168</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.001975168 -0.000406133 0.000191555 0.000224928 0.000364061 0.000584409 0.000785969 0.000953086 0.001096675 0.001482643 0.002479217 0.003042782 0.003208818 0.003523166 0.004497650 0.005336695 0.005725808 0.006054117 0.007579382 0.008254135 0.009955877 0.010847740 0.011198720 0.013033564 0.018357347 0.019445319 0.021249186 0.023832433 0.028350403 0.030934915 0.032972235 0.033964501 0.035824104 0.038653170 0.043239769 0.043723034 0.045483295 0.048435429 0.049756366 0.049862708 0.050610626 0.051642268 0.052115651 0.052838398 0.054174452 0.054737560 0.056996027 0.058442579 0.061401178 0.061611260 0.066104853 0.069338966 0.072360460 0.075944915 0.077472069 0.078337006 0.078622437 0.082250945 0.084346192 0.091152631 0.096136798 0.098691007 0.104120514 0.105065813 0.107909328 0.111335394 0.113590966 0.113920477 0.116857196 0.118807270 0.130888108 0.134997665 0.137424561 0.144463759 0.145757896 0.153667617 0.154703129 0.166000291 0.170564279 0.173584284 0.180613184 0.189339835 0.193497495 0.202370934 0.208741016 0.213475424 0.218294678 0.238064411 0.254783558 0.265198532 0.312584041 0.323437317 0.351251365 0.359403150 0.413844859 0.449081462 0.501794723 0.535788353 0.562158915 0.597190077 0.617804916 0.632245015 0.684593642 0.736138950 0.745400535 0.746327839 0.751574805 0.759293002 0.768557959 0.771251401 0.785129083 0.785566754 0.791390665 0.797717786 0.807081954 0.809735876 0.816271687 0.825058559 0.832999196 0.851164438 0.865543487 0.868369922 0.877388406 0.892193397 0.899397312 0.904135255 0.911667190 0.920891941 0.922396377 0.975490444 1.294633682 1.491464818</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">43</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.8486368" y3="0.94487656" z3="3.83971069">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.1500421" y3="1.28328334" z3="2.8298989">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.22425293" y3="1.17991737" z3="3.96834951">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.41703821" y3="1.54522235" z3="4.57107692">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11174009" y3="-0.55095052" z3="4.01562504">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80101604" y3="-0.85906556" z3="5.02956268">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47804485" y3="-1.11841549" z3="3.30564889">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57564943" y3="-0.95225636" z3="3.79729023">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.6647049" y3="-2.05185581" z3="3.8925791">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.85182332" y3="-0.7061551" z3="2.75121537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.5963488" y3="-0.30518913" z3="4.74677679">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60712324" y3="-0.58159734" z3="4.39721735">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.52236779" y3="0.79742318" z3="4.71759071">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48957536" y3="-0.80350675" z3="6.19466739">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31520935" y3="-0.64272846" z3="8.41902008">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20665131" y3="-1.20423644" z3="8.75578555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.16270828" y3="0.19016567" z3="9.14110586">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09005731" y3="-1.5711149" z3="8.51146135">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90112191" y3="-1.84687115" z3="9.57098574">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.199428" y3="-1.00612057" z3="8.17338523">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23813235" y3="-2.84746115" z3="7.6845491">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.43893377" y3="-2.56911759" z3="6.63495534">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14653779" y3="-3.37985559" z3="8.01581344">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03668963" y3="-3.79540399" z3="7.73903983">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.3000689" y3="-4.73247757" z3="7.21209384">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16611577" y3="-4.08228737" z3="8.7905212">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.23938686" y3="-3.22542583" z3="7.11688241">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.60964422" y3="-2.34805276" z3="7.67610862">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05102236" y3="-3.975763" z3="7.09708911">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.05294298" y3="-2.89703929" z3="6.07754303">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22708754" y3="-1.75546879" z3="6.5417813">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.60041809" y3="-0.11339425" z3="7.04417764">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84364856" y3="0.5319582" z3="6.58803167">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45110028" y3="0.86099513" z3="7.71564038">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37526335" y3="0.07189954" z3="8.48377678">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22969017" y3="0.54951645" z3="6.99627881">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80467588" y3="1.78094279" z3="8.21614662">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10834898" y3="1.07939281" z3="7.02521949">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80432097" y3="0.14734838" z3="6.524875">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19787594" y3="1.85548189" z3="6.24643219">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00401804" y3="1.4892609" z3="7.99223521">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.76235265" y3="0.66655805" z3="8.68603893">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35697382" y3="2.3391688" z3="8.61852289">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72842889" y3="1.98212337" z3="7.31903738">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73001282" y3="2.57490106" z3="6.24597399">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88346843" y3="2.12183112" z3="8.0401707">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8486,.9449,3.8397;-1.15,1.2833,2.8299;.2243,1.1799,3.9683;-1.417,1.5452,4.5711;-1.1117,-.551,4.0156;-.801,-.8591,5.0296;-.478,-1.1184,3.3056;-2.5756,-.9523,3.7973;-2.6647,-2.0519,3.8926;-2.8518,-.7062,2.7512;-3.5963,-.3052,4.7468;-4.6071,-.5816,4.3972;-3.5224,.7974,4.7176;-3.4896,-.8035,6.1947;-2.3152,-.6427,8.419;-3.2067,-1.2042,8.7558;-2.1627,.1902,9.1411;-1.0901,-1.5711,8.5115;-.9011,-1.8469,9.571;-.1994,-1.0061,8.1734;-1.2381,-2.8475,7.6845;-1.4389,-2.5691,6.635;-2.1465,-3.3799,8.0158;-.0367,-3.7954,7.739;-.3001,-4.7325,7.2121;.1661,-4.0823,8.7905;1.2394,-3.2254,7.1169;1.6096,-2.3481,7.6761;2.051,-3.9758,7.0971;1.0529,-2.897,6.0775;-4.2271,-1.7555,6.5418;-2.6004,-.1134,7.0442;-1.8436,.532,6.588;-7.4511,.861,7.7156;-7.3753,.0719,8.4838;-8.2297,.5495,6.9963;-7.8047,1.7809,8.2161;-6.1083,1.0794,7.0252;-5.8043,.1473,6.5249;-6.1979,1.8555,6.2464;-5.004,1.4893,7.9922;-4.7624,.6666,8.686;-5.357,2.3392,8.6185;-3.7284,1.9821,7.319;-3.73,2.5749,6.246;-2.8835,2.1218,8.0402;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724144794179</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002250872127 0.000464877575 0.025438612380 0.008513772487</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002020208 -0.000646641 0.000190015 0.000200389 0.000365744 0.000708873 0.000900125 0.000948518 0.001241886 0.001496280 0.002500410 0.003042216 0.003228891 0.003523094 0.004499496 0.005356587 0.005745282 0.006070486 0.007581484 0.008257136 0.009958216 0.010845380 0.011207801 0.013033330 0.018357574 0.019446161 0.021253480 0.023831529 0.028460156 0.030936856 0.032976113 0.033965445 0.035828230 0.038655187 0.043245538 0.043741625 0.045483319 0.048450751 0.049763092 0.049865485 0.050612140 0.051645903 0.052122843 0.052859496 0.054174120 0.054782398 0.057000012 0.058451769 0.061427484 0.061613774 0.066136192 0.069339765 0.072359708 0.075948897 0.077475179 0.078395412 0.078621543 0.082265547 0.084344980 0.091155281 0.096137180 0.098692203 0.104121557 0.105067836 0.107910545 0.111337004 0.113592878 0.113941021 0.116861338 0.118823833 0.130888623 0.134997062 0.137424238 0.144467292 0.145762341 0.153663505 0.154707856 0.166008206 0.170569926 0.173587041 0.180616583 0.189384858 0.193563434 0.202561985 0.208798473 0.213487857 0.218337632 0.238251675 0.254797474 0.265564633 0.312583256 0.323592835 0.351306083 0.359574858 0.413852532 0.449100015 0.501807099 0.535885077 0.562182068 0.597191156 0.617863048 0.632277963 0.684606894 0.736142636 0.745406696 0.746328697 0.751575418 0.759293204 0.768588654 0.771264436 0.785129561 0.785577333 0.791393168 0.797718275 0.807082669 0.809748937 0.816290702 0.825062053 0.832999426 0.851172969 0.865553557 0.868407099 0.877783440 0.892193278 0.899427309 0.904139311 0.911670748 0.920902422 0.922403960 0.975675438 1.294842575 1.491470339</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">44</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.84999137" y3="0.93874931" z3="3.85052095">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.14992904" y3="1.27990303" z3="2.84132891">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.22256236" y3="1.17292252" z3="3.98116797">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.41887062" y3="1.53727131" z3="4.58287928">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11353029" y3="-0.55676303" z3="4.02129785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80382199" y3="-0.86822738" z3="5.03450724">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47975931" y3="-1.12219956" z3="3.31020833">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57638424" y3="-0.95729486" z3="3.8000742">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.66476481" y3="-2.05634091" z3="3.89288377">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.85106005" y3="-0.70941182" z3="2.75400882">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59847347" y3="-0.3123564" z3="4.74848782">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60733391" y3="-0.59001288" z3="4.39714867">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.52554262" y3="0.78971377" z3="4.719463">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49449507" y3="-0.81020685" z3="6.19678297">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32189159" y3="-0.65341841" z3="8.42250883">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21247679" y3="-1.21903909" z3="8.75489297">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.17526385" y3="0.17862065" z3="9.14686809">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09287819" y3="-1.57654732" z3="8.51690826">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90394397" y3="-1.85094722" z3="9.57727961">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.20405665" y3="-1.00733195" z3="8.17918189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23479461" y3="-2.85453696" z3="7.68987811">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.44597348" y3="-2.57770952" z3="6.64094564">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13614447" y3="-3.39649505" z3="8.02857263">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02366337" y3="-3.79071183" z3="7.73555588">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.28279097" y3="-4.73154493" z3="7.21329335">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.19155439" y3="-4.07288734" z3="8.78627755">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24137946" y3="-3.21000953" z3="7.10016345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.60693091" y3="-2.32674026" z3="7.65271623">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06045998" y3="-3.95200463" z3="7.07732223">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.04319581" y3="-2.88802082" z3="6.0606743">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23437572" y3="-1.7599321" z3="6.54346854">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.6046655" y3="-0.12289542" z3="7.0475849">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84634242" y3="0.52496204" z3="6.59299778">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4527458" y3="0.87363488" z3="7.70872877">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37974075" y3="0.07272492" z3="8.47024148">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23011553" y3="0.57114291" z3="6.98371795">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80780983" y3="1.79144005" z3="8.2212548">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10749497" y3="1.09389548" z3="7.01946048">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80314205" y3="0.16176933" z3="6.51520804">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19400646" y3="1.87415695" z3="6.24255617">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.0036601" y3="1.4964093" z3="7.99001166">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.76641612" y3="0.66962231" z3="8.68231098">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35501725" y3="2.34659526" z3="8.61928758">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72494612" y3="1.98092727" z3="7.3200811">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72077729" y3="2.57303113" z3="6.24575125">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88096108" y3="2.11654986" z3="8.04142797">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.85,.9387,3.8505;-1.1499,1.2799,2.8413;.2226,1.1729,3.9812;-1.4189,1.5373,4.5829;-1.1135,-.5568,4.0213;-.8038,-.8682,5.0345;-.4798,-1.1222,3.3102;-2.5764,-.9573,3.8001;-2.6648,-2.0563,3.8929;-2.8511,-.7094,2.754;-3.5985,-.3124,4.7485;-4.6073,-.59,4.3971;-3.5255,.7897,4.7195;-3.4945,-.8102,6.1968;-2.3219,-.6534,8.4225;-3.2125,-1.219,8.7549;-2.1753,.1786,9.1469;-1.0929,-1.5765,8.5169;-.9039,-1.8509,9.5773;-.2041,-1.0073,8.1792;-1.2348,-2.8545,7.6899;-1.446,-2.5777,6.6409;-2.1361,-3.3965,8.0286;-.0237,-3.7907,7.7356;-.2828,-4.7315,7.2133;.1916,-4.0729,8.7863;1.2414,-3.21,7.1002;1.6069,-2.3267,7.6527;2.0605,-3.952,7.0773;1.0432,-2.888,6.0607;-4.2344,-1.7599,6.5435;-2.6047,-.1229,7.0476;-1.8463,.525,6.593;-7.4527,.8736,7.7087;-7.3797,.0727,8.4702;-8.2301,.5711,6.9837;-7.8078,1.7914,8.2213;-6.1075,1.0939,7.0195;-5.8031,.1618,6.5152;-6.194,1.8742,6.2426;-5.0037,1.4964,7.99;-4.7664,.6696,8.6823;-5.355,2.3466,8.6193;-3.7249,1.9809,7.3201;-3.7208,2.573,6.2458;-2.881,2.1165,8.0414;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724144518040</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002547053412 0.000537274511 0.026790835157 0.008519459765</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002071469 -0.000687080 0.000181320 0.000205099 0.000374740 0.000743284 0.000894238 0.001031505 0.001261109 0.001679002 0.002509605 0.003042423 0.003242622 0.003537818 0.004524507 0.005395067 0.005748126 0.006118302 0.007581386 0.008263949 0.009958657 0.010848605 0.011210849 0.013033654 0.018357822 0.019453588 0.021252274 0.023831467 0.028635812 0.030949302 0.032975903 0.033966390 0.035837781 0.038666116 0.043258500 0.043767349 0.045484567 0.048471414 0.049765111 0.049868573 0.050618160 0.051646419 0.052122227 0.052873235 0.054175271 0.054818598 0.056999742 0.058455321 0.061427848 0.061614352 0.066208887 0.069348177 0.072361025 0.075953452 0.077474791 0.078482268 0.078662366 0.082280992 0.084353300 0.091165903 0.096137195 0.098695896 0.104122096 0.105077630 0.107910499 0.111338519 0.113610752 0.113968431 0.116861221 0.118859167 0.130888647 0.134996806 0.137424407 0.144468353 0.145763130 0.153666631 0.154722909 0.166009510 0.170571128 0.173593508 0.180622529 0.189465000 0.193560294 0.202927583 0.208796365 0.213586041 0.218332557 0.238636388 0.254855894 0.265742928 0.312663173 0.323712396 0.351320137 0.359823806 0.413857018 0.449104255 0.501830270 0.536018108 0.562192739 0.597199464 0.617915812 0.632312693 0.684612509 0.736144921 0.745406544 0.746337368 0.751578900 0.759297712 0.768723924 0.771276604 0.785130524 0.785600399 0.791400539 0.797718637 0.807085868 0.809767948 0.816375325 0.825062952 0.833028459 0.851205593 0.865552936 0.868407780 0.878341666 0.892230578 0.899448738 0.904140530 0.911730954 0.920903070 0.922403746 0.975894778 1.295277388 1.491470684</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">45</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.84446066" y3="0.92734823" z3="3.85196602">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.14341796" y3="1.26961937" z3="2.84300726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.22927883" y3="1.15639144" z3="3.98119795">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.40960816" y3="1.5293035" z3="4.58500557">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11533207" y3="-0.56748659" z3="4.02453302">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80898802" y3="-0.87876452" z3="5.03896411">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48287632" y3="-1.1372142" z3="3.31468412">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58008439" y3="-0.96128099" z3="3.803091">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.67477496" y3="-2.06023133" z3="3.89842222">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.85207446" y3="-0.7139099" z3="2.75636025">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59937712" y3="-0.30920817" z3="4.7506799">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6109388" y3="-0.57903197" z3="4.39835624">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.51839354" y3="0.79301528" z3="4.72196358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.499132" y3="-0.81052827" z3="6.19841272">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32756673" y3="-0.6626905" z3="8.42501562">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21900267" y3="-1.23029235" z3="8.75202198">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.18536908" y3="0.16825095" z3="9.15199956">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09652094" y3="-1.5832156" z3="8.52291733">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90897954" y3="-1.85699609" z3="9.5834955">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.2088758" y3="-1.01108596" z3="8.18737691">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23180954" y3="-2.86127019" z3="7.69513961">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.45395596" y3="-2.58436027" z3="6.64876103">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.12416796" y3="-3.4139384" z3="8.03997614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.01045035" y3="-3.7854852" z3="7.72886365">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.2625498" y3="-4.72567361" z3="7.20428571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.21453804" y3="-4.07089793" z3="8.77541685">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24373822" y3="-3.1905998" z3="7.08870936">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.60555063" y3="-2.30969843" z3="7.64445153">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06979336" y3="-3.9252138" z3="7.05326518">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.03441432" y3="-2.86248061" z3="6.05486973">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.2453498" y3="-1.75733642" z3="6.5420352">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.60463415" y3="-0.13121474" z3="7.04958217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84610373" y3="0.51422815" z3="6.59780774">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4555502" y3="0.88411735" z3="7.70139586">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.38765789" y3="0.09196805" z3="8.46765298">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23276624" y3="0.57963965" z3="6.97692788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80549416" y3="1.80482617" z3="8.20265474">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10843127" y3="1.09784627" z3="7.01735307">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80725159" y3="0.1663507" z3="6.51278298">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19013838" y3="1.87959242" z3="6.24196524">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00623014" y3="1.4958054" z3="7.99177101">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.76934054" y3="0.66515229" z3="8.67931053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35847773" y3="2.34244988" z3="8.62514203">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.7262794" y3="1.98850777" z3="7.3259084">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71858255" y3="2.58178995" z3="6.2542818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88028761" y3="2.11435925" z3="8.04810696">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8445,.9273,3.852;-1.1434,1.2696,2.843;.2293,1.1564,3.9812;-1.4096,1.5293,4.585;-1.1153,-.5675,4.0245;-.809,-.8788,5.039;-.4829,-1.1372,3.3147;-2.5801,-.9613,3.8031;-2.6748,-2.0602,3.8984;-2.8521,-.7139,2.7564;-3.5994,-.3092,4.7507;-4.6109,-.579,4.3984;-3.5184,.793,4.722;-3.4991,-.8105,6.1984;-2.3276,-.6627,8.425;-3.219,-1.2303,8.752;-2.1854,.1683,9.152;-1.0965,-1.5832,8.5229;-.909,-1.857,9.5835;-.2089,-1.0111,8.1874;-1.2318,-2.8613,7.6951;-1.454,-2.5844,6.6488;-2.1242,-3.4139,8.04;-.0105,-3.7855,7.7289;-.2625,-4.7257,7.2043;.2145,-4.0709,8.7754;1.2437,-3.1906,7.0887;1.6056,-2.3097,7.6445;2.0698,-3.9252,7.0533;1.0344,-2.8625,6.0549;-4.2453,-1.7573,6.542;-2.6046,-.1312,7.0496;-1.8461,.5142,6.5978;-7.4556,.8841,7.7014;-7.3877,.092,8.4677;-8.2328,.5796,6.9769;-7.8055,1.8048,8.2027;-6.1084,1.0978,7.0174;-5.8073,.1664,6.5128;-6.1901,1.8796,6.242;-5.0062,1.4958,7.9918;-4.7693,.6652,8.6793;-5.3585,2.3424,8.6251;-3.7263,1.9885,7.3259;-3.7186,2.5818,6.2543;-2.8803,2.1144,8.0481;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724143852211</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002046064146 0.000524790725 0.029972745605 0.008508807254</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002247794 -0.000704287 0.000182178 0.000206267 0.000378102 0.000804513 0.000892147 0.001108663 0.001289521 0.001768917 0.002512087 0.003042754 0.003240872 0.003610863 0.004591505 0.005431728 0.005748247 0.006196940 0.007584607 0.008263534 0.009959767 0.010859825 0.011212364 0.013044909 0.018358412 0.019463132 0.021252568 0.023831896 0.028829129 0.030994998 0.032981318 0.033968124 0.035858240 0.038694173 0.043275465 0.043824374 0.045488068 0.048524146 0.049765768 0.049871288 0.050620494 0.051648596 0.052128996 0.052881242 0.054201686 0.054821338 0.057033344 0.058461929 0.061429372 0.061614197 0.066265830 0.069369257 0.072363351 0.075954962 0.077478631 0.078513758 0.078748507 0.082293109 0.084377170 0.091187989 0.096137480 0.098701207 0.104122973 0.105106273 0.107910911 0.111340755 0.113643995 0.113978837 0.116866330 0.118905407 0.130891370 0.134997025 0.137427356 0.144475939 0.145770199 0.153708489 0.154764899 0.166012812 0.170579063 0.173602964 0.180621946 0.189561898 0.193679900 0.203095003 0.208822118 0.213663404 0.218348821 0.238677802 0.254868715 0.265743273 0.312797133 0.323811551 0.351319326 0.360140091 0.413967186 0.449105333 0.501852397 0.536163759 0.562197892 0.597199188 0.617947546 0.632439290 0.684616903 0.736157604 0.745406134 0.746343938 0.751588257 0.759308185 0.768984000 0.771276365 0.785132136 0.785600074 0.791433470 0.797722346 0.807091100 0.809860892 0.816462379 0.825065377 0.833044299 0.851289541 0.865553058 0.868431438 0.878534355 0.892334352 0.899565507 0.904259685 0.911730363 0.920919514 0.922414379 0.976199045 1.295637003 1.491470977</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">46</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.84220425" y3="0.91882739" z3="3.8578693">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.13963068" y3="1.26289045" z3="2.84892275">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.23196669" y3="1.1447395" z3="3.98845255">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.4064" y3="1.5206624" z3="4.59082342">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11689508" y3="-0.57489848" z3="4.02802584">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81144743" y3="-0.88828469" z3="5.04176772">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48584233" y3="-1.14462002" z3="3.317987">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58244176" y3="-0.96444207" z3="3.80428429">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.67967209" y3="-2.06293984" z3="3.89614722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.85391009" y3="-0.71371095" z3="2.75811438">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60056874" y3="-0.31289769" z3="4.75238334">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61119506" y3="-0.58099452" z3="4.39839191">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.518441" y3="0.78847651" z3="4.72627381">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50341566" y3="-0.81572237" z3="6.19963105">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33636627" y3="-0.67074981" z3="8.42928025">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22589884" y3="-1.24402647" z3="8.75087236">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.20161391" y3="0.15862203" z3="9.15918705">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10089291" y3="-1.58452192" z3="8.52900502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91525255" y3="-1.86094793" z3="9.58883268">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21544827" y3="-1.00714756" z3="8.19855579">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22730022" y3="-2.86036078" z3="7.69782059">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.4508978" y3="-2.58193391" z3="6.65351596">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.11512196" y3="-3.41895455" z3="8.0406735">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.00052012" y3="-3.77613211" z3="7.72872692">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.25185452" y3="-4.72391145" z3="7.21321635">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.23536716" y3="-4.05080302" z3="8.77717775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24466273" y3="-3.17551223" z3="7.07098809">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.60618017" y3="-2.28320314" z3="7.61447878">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07520912" y3="-3.90387225" z3="7.03652017">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.02343075" y3="-2.86036544" z3="6.03359682">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.25069387" y3="-1.76188707" z3="6.54125408">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61134368" y3="-0.13654785" z3="7.05439128">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8484137" y3="0.5083213" z3="6.60333618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45786776" y3="0.89774654" z3="7.69325256">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.39579668" y3="0.09701614" z3="8.45405871">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23421329" y3="0.60123809" z3="6.96379905">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80890112" y3="1.81774789" z3="8.20333887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10671109" y3="1.10727745" z3="7.01438051">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80986905" y3="0.17495832" z3="6.50832667">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.18004921" y3="1.8905604" z3="6.24087359">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00401096" y3="1.49344425" z3="7.99286634">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.77628745" y3="0.6599368" z3="8.67939586">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35049931" y3="2.34127288" z3="8.62649603">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71952202" y3="1.97458474" z3="7.33185118">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70643107" y3="2.57206569" z3="6.26111202">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87694367" y3="2.09945557" z3="8.05763266">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8422,.9188,3.8579;-1.1396,1.2629,2.8489;.232,1.1447,3.9885;-1.4064,1.5207,4.5908;-1.1169,-.5749,4.028;-.8114,-.8883,5.0418;-.4858,-1.1446,3.318;-2.5824,-.9644,3.8043;-2.6797,-2.0629,3.8961;-2.8539,-.7137,2.7581;-3.6006,-.3129,4.7524;-4.6112,-.581,4.3984;-3.5184,.7885,4.7263;-3.5034,-.8157,6.1996;-2.3364,-.6707,8.4293;-3.2259,-1.244,8.7509;-2.2016,.1586,9.1592;-1.1009,-1.5845,8.529;-.9153,-1.8609,9.5888;-.2154,-1.0071,8.1986;-1.2273,-2.8604,7.6978;-1.4509,-2.5819,6.6535;-2.1151,-3.419,8.0407;-.0005,-3.7761,7.7287;-.2519,-4.7239,7.2132;.2354,-4.0508,8.7772;1.2447,-3.1755,7.071;1.6062,-2.2832,7.6145;2.0752,-3.9039,7.0365;1.0234,-2.8604,6.0336;-4.2507,-1.7619,6.5413;-2.6113,-.1365,7.0544;-1.8484,.5083,6.6033;-7.4579,.8977,7.6933;-7.3958,.097,8.4541;-8.2342,.6012,6.9638;-7.8089,1.8177,8.2033;-6.1067,1.1073,7.0144;-5.8099,.175,6.5083;-6.18,1.8906,6.2409;-5.004,1.4934,7.9929;-4.7763,.6599,8.6794;-5.3505,2.3413,8.6265;-3.7195,1.9746,7.3319;-3.7064,2.5721,6.2611;-2.8769,2.0995,8.0576;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724140505119</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001752939779 0.000510193428 0.025485264563 0.008504526711</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002604137 -0.000600541 0.000184350 0.000213451 0.000379463 0.000809906 0.000898075 0.001124941 0.001425941 0.001836473 0.002554255 0.003043093 0.003260618 0.003719274 0.004588017 0.005426279 0.005755490 0.006291212 0.007592973 0.008266616 0.009963593 0.010861536 0.011239341 0.013070034 0.018358623 0.019461873 0.021255903 0.023833596 0.028951839 0.031109285 0.033012546 0.033969717 0.035885694 0.038747195 0.043289135 0.043897346 0.045489431 0.048563480 0.049772826 0.049871421 0.050620453 0.051649922 0.052163017 0.052885438 0.054225257 0.054821420 0.057116456 0.058465755 0.061452357 0.061619917 0.066278869 0.069388414 0.072380951 0.075954821 0.077503846 0.078516032 0.078818213 0.082290292 0.084391419 0.091212857 0.096137459 0.098714592 0.104126704 0.105130705 0.107911784 0.111341526 0.113680454 0.113978938 0.116870199 0.118937222 0.130895034 0.135010617 0.137433920 0.144476929 0.145817353 0.153763878 0.154796694 0.166013015 0.170591869 0.173609310 0.180628218 0.189575062 0.194148346 0.203125254 0.208817874 0.213709883 0.218369559 0.238696960 0.254880591 0.265759343 0.313092489 0.323835696 0.351364546 0.360324318 0.414302233 0.449161344 0.501859902 0.536414461 0.562202958 0.597237855 0.617970593 0.632551556 0.684618757 0.736158646 0.745405851 0.746344025 0.751596588 0.759308267 0.769274831 0.771292395 0.785140427 0.785619356 0.791504629 0.797722277 0.807096208 0.809885092 0.816511256 0.825077980 0.833044781 0.851476706 0.865554596 0.868474355 0.878563013 0.892437536 0.899650394 0.904542074 0.911729697 0.920964381 0.922423225 0.976362521 1.295714568 1.491512744</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">47</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.83288845" y3="0.9058214" z3="3.86100279">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.12687902" y3="1.25378447" z3="2.85225193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.24329049" y3="1.12342605" z3="3.99308849">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.39333849" y3="1.51166112" z3="4.59410272">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11908188" y3="-0.58644447" z3="4.02945849">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81716882" y3="-0.90308694" z3="5.04343654">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49129778" y3="-1.16042082" z3="3.31951434">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58742013" y3="-0.96544066" z3="3.80440026">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.69225935" y3="-2.06363768" z3="3.89413885">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.85694605" y3="-0.7104297" z3="2.75866985">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60086549" y3="-0.30858733" z3="4.75420932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61406425" y3="-0.56860859" z3="4.4001691">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.51061687" y3="0.79270478" z3="4.7294465">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50623108" y3="-0.81537438" z3="6.20062651">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33934523" y3="-0.67927628" z3="8.43105151">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.2288083" y3="-1.25592825" z3="8.74733429">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.21029501" y3="0.14886911" z3="9.16379385">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10094465" y3="-1.58903271" z3="8.53343242">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91328178" y3="-1.86050494" z3="9.59484439">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21734219" y3="-1.00947894" z3="8.19921217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22526146" y3="-2.86916824" z3="7.70635847">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.46851314" y3="-2.59632102" z3="6.66221785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.10341492" y3="-3.43796111" z3="8.06615876">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.01261176" y3="-3.77223886" z3="7.72310625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.23168283" y3="-4.71885919" z3="7.20652979">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.25949113" y3="-4.04900944" z3="8.76720627">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24612367" y3="-3.15915684" z3="7.06013287">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.60089283" y3="-2.26942443" z3="7.60569149">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.08335643" y3="-3.88038895" z3="7.01633258">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.01621629" y3="-2.8402164" z3="6.02806905">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.25850055" y3="-1.75891586" z3="6.5395615">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.60989143" y3="-0.14407133" z3="7.05580096">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84833459" y3="0.50333538" z3="6.6081806">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.46135429" y3="0.9022147" z3="7.68829793">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40239567" y3="0.09911781" z3="8.44565368">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23682551" y3="0.61263487" z3="6.95633058">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80761061" y3="1.81999975" z3="8.20043037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10990547" y3="1.11360297" z3="7.01128347">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.81094138" y3="0.18383566" z3="6.5010097">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.18439142" y3="1.90184526" z3="6.24152967">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00882709" y3="1.49737909" z3="7.99275726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.77886084" y3="0.66038298" z3="8.67433406">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35833739" y3="2.34096942" z3="8.63129712">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72402777" y3="1.98559503" z3="7.33662533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70754539" y3="2.58319526" z3="6.26718681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88025482" y3="2.10206444" z3="8.06162149">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8329,.9058,3.861;-1.1269,1.2538,2.8523;.2433,1.1234,3.9931;-1.3933,1.5117,4.5941;-1.1191,-.5864,4.0295;-.8172,-.9031,5.0434;-.4913,-1.1604,3.3195;-2.5874,-.9654,3.8044;-2.6923,-2.0636,3.8941;-2.8569,-.7104,2.7587;-3.6009,-.3086,4.7542;-4.6141,-.5686,4.4002;-3.5106,.7927,4.7294;-3.5062,-.8154,6.2006;-2.3393,-.6793,8.4311;-3.2288,-1.2559,8.7473;-2.2103,.1489,9.1638;-1.1009,-1.589,8.5334;-.9133,-1.8605,9.5948;-.2173,-1.0095,8.1992;-1.2253,-2.8692,7.7064;-1.4685,-2.5963,6.6622;-2.1034,-3.438,8.0662;.0126,-3.7722,7.7231;-.2317,-4.7189,7.2065;.2595,-4.049,8.7672;1.2461,-3.1592,7.0601;1.6009,-2.2694,7.6057;2.0834,-3.8804,7.0163;1.0162,-2.8402,6.0281;-4.2585,-1.7589,6.5396;-2.6099,-.1441,7.0558;-1.8483,.5033,6.6082;-7.4614,.9022,7.6883;-7.4024,.0991,8.4457;-8.2368,.6126,6.9563;-7.8076,1.82,8.2004;-6.1099,1.1136,7.0113;-5.8109,.1838,6.501;-6.1844,1.9018,6.2415;-5.0088,1.4974,7.9928;-4.7789,.6604,8.6743;-5.3583,2.341,8.6313;-3.724,1.9856,7.3366;-3.7075,2.5832,6.2672;-2.8803,2.1021,8.0616;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724139101368</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001711231353 0.000433183195 0.028114823281 0.008519159533</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002903218 -0.000577980 0.000187105 0.000252547 0.000384569 0.000811024 0.000910011 0.001127639 0.001544105 0.001870564 0.002631587 0.003043820 0.003263350 0.003813643 0.004606566 0.005469784 0.005773822 0.006390094 0.007590636 0.008289815 0.009962725 0.010861472 0.011299868 0.013110309 0.018363310 0.019484777 0.021286996 0.023834215 0.028962935 0.031213046 0.033064879 0.033971511 0.035901114 0.038789111 0.043293001 0.043906135 0.045490809 0.048567708 0.049773083 0.049871312 0.050622612 0.051654936 0.052212738 0.052884332 0.054226225 0.054821209 0.057150121 0.058472894 0.061468189 0.061625902 0.066280391 0.069390380 0.072389170 0.075955922 0.077522754 0.078520873 0.078826790 0.082298950 0.084389938 0.091210567 0.096138446 0.098723725 0.104127002 0.105134465 0.107915812 0.111341431 0.113702365 0.113979226 0.116870489 0.118949223 0.130896005 0.135024945 0.137433355 0.144477118 0.145924898 0.153799122 0.154818131 0.166013291 0.170590734 0.173612481 0.180658330 0.189586433 0.194674195 0.203124711 0.208816548 0.213700803 0.218394849 0.238703544 0.254879147 0.265761343 0.313236145 0.323838255 0.351452895 0.360349984 0.414647014 0.449354186 0.501875026 0.536551191 0.562204836 0.597374888 0.617970034 0.632620817 0.684620942 0.736159988 0.745414393 0.746354935 0.751596819 0.759309029 0.769293719 0.771335540 0.785141024 0.785738347 0.791512588 0.797722343 0.807102589 0.809893367 0.816538047 0.825092505 0.833065241 0.851622886 0.865599768 0.868483536 0.878562112 0.892445005 0.899730169 0.904850119 0.911760564 0.921041574 0.922424530 0.976359730 1.295781798 1.491514543</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">48</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.82366581" y3="0.88990755" z3="3.86593915">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.11342226" y3="1.23694258" z3="2.85592686">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.25243431" y3="1.10265494" z3="3.99993832">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.38218648" y3="1.49987665" z3="4.5967961">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11858549" y3="-0.59987706" z3="4.03671165">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82178399" y3="-0.91600692" z3="5.05243766">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49221527" y3="-1.1791504" z3="3.32973964">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58838917" y3="-0.97021645" z3="3.80875778">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.70048831" y3="-2.06761763" z3="3.90051191">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.85341918" y3="-0.71536183" z3="2.76197056">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60014317" y3="-0.30600234" z3="4.75575217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61412861" y3="-0.56115479" z3="4.40068161">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.50452374" y3="0.79463761" z3="4.72996282">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50890859" y3="-0.81250003" z3="6.20239757">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.34342043" y3="-0.67866571" z3="8.43324556">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.23205347" y3="-1.25734765" z3="8.74788206">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.21613588" y3="0.14831533" z3="9.16755922">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10356556" y3="-1.58652245" z3="8.53500605">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91628659" y3="-1.8600936" z3="9.59518246">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22121135" y3="-1.00490623" z3="8.20357002">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22257222" y3="-2.86439154" z3="7.70572375">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.46146106" y3="-2.58908571" z3="6.66495392">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09790563" y3="-3.43471474" z3="8.0585875">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.01717666" y3="-3.76294504" z3="7.7210837">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.2270552" y3="-4.71510671" z3="7.21191806">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.27289282" y3="-4.0314649" z3="8.76572523">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24253171" y3="-3.14652629" z3="7.04304509">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.59802743" y3="-2.24746269" z3="7.57757666">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.08398129" y3="-3.86205541" z3="6.99813779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.00034305" y3="-2.83824425" z3="6.00865108">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.26141185" y3="-1.75592975" z3="6.5397906">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61353162" y3="-0.14099987" z3="7.05883499">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84901207" y3="0.50039979" z3="6.61101263">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.46415794" y3="0.90556056" z3="7.68251308">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40669286" y3="0.09167806" z3="8.4286865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.24143091" y3="0.62705182" z3="6.94685799">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80894668" y3="1.81765802" z3="8.2077799">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11196766" y3="1.12233016" z3="7.00875696">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8169311" y3="0.19801175" z3="6.48691913">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.18288511" y3="1.91959259" z3="6.24845377">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.01035377" y3="1.48985882" z3="7.99595386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.78513265" y3="0.64285462" z3="8.66808292">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35693981" y3="2.32787317" z3="8.64452206">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72270247" y3="1.98041337" z3="7.34362439">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70419078" y3="2.58404395" z3="6.27761433">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88154135" y3="2.09514485" z3="8.07311316">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8237,.8899,3.8659;-1.1134,1.2369,2.8559;.2524,1.1027,3.9999;-1.3822,1.4999,4.5968;-1.1186,-.5999,4.0367;-.8218,-.916,5.0524;-.4922,-1.1792,3.3297;-2.5884,-.9702,3.8088;-2.7005,-2.0676,3.9005;-2.8534,-.7154,2.762;-3.6001,-.306,4.7558;-4.6141,-.5612,4.4007;-3.5045,.7946,4.73;-3.5089,-.8125,6.2024;-2.3434,-.6787,8.4332;-3.2321,-1.2573,8.7479;-2.2161,.1483,9.1676;-1.1036,-1.5865,8.535;-.9163,-1.8601,9.5952;-.2212,-1.0049,8.2036;-1.2226,-2.8644,7.7057;-1.4615,-2.5891,6.665;-2.0979,-3.4347,8.0586;.0172,-3.7629,7.7211;-.2271,-4.7151,7.2119;.2729,-4.0315,8.7657;1.2425,-3.1465,7.043;1.598,-2.2475,7.5776;2.084,-3.8621,6.9981;1.0003,-2.8382,6.0087;-4.2614,-1.7559,6.5398;-2.6135,-.141,7.0588;-1.849,.5004,6.611;-7.4642,.9056,7.6825;-7.4067,.0917,8.4287;-8.2414,.6271,6.9469;-7.8089,1.8177,8.2078;-6.112,1.1223,7.0088;-5.8169,.198,6.4869;-6.1829,1.9196,6.2485;-5.0104,1.4899,7.996;-4.7851,.6429,8.6681;-5.3569,2.3279,8.6445;-3.7227,1.9804,7.3436;-3.7042,2.584,6.2776;-2.8815,2.0951,8.0731;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724133833944</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001625313727 0.000485582252 0.028352804075 0.008514861533</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002910526 -0.000783163 0.000215740 0.000241748 0.000404855 0.000811169 0.000919589 0.001130179 0.001535181 0.001892818 0.002691309 0.003047538 0.003263550 0.003867398 0.004678209 0.005579444 0.005797832 0.006458571 0.007622027 0.008341087 0.009984664 0.010865038 0.011369273 0.013128424 0.018383071 0.019529345 0.021436336 0.023834773 0.028965881 0.031250355 0.033115497 0.033971485 0.035900871 0.038801403 0.043292686 0.043935016 0.045493319 0.048590704 0.049773050 0.049875499 0.050623939 0.051667426 0.052235377 0.052883103 0.054237356 0.054831188 0.057149967 0.058470198 0.061468993 0.061623746 0.066283568 0.069391319 0.072391284 0.075969512 0.077542904 0.078519097 0.078827923 0.082331947 0.084388372 0.091240187 0.096146950 0.098728427 0.104132424 0.105135374 0.107926664 0.111345194 0.113701959 0.113979112 0.116872726 0.118949657 0.130896128 0.135032770 0.137444756 0.144480649 0.146054197 0.153815198 0.154827205 0.166014604 0.170595358 0.173612098 0.180684344 0.189669855 0.195012878 0.203123975 0.208831320 0.213703899 0.218530774 0.238703159 0.254892765 0.265797693 0.313348622 0.323837371 0.351531352 0.360384284 0.414808660 0.449648987 0.501949199 0.536628551 0.562205018 0.597542749 0.617984146 0.632650999 0.684620823 0.736160897 0.745420959 0.746407894 0.751615510 0.759309537 0.769296139 0.771366299 0.785140898 0.785924186 0.791515314 0.797722305 0.807104432 0.809959388 0.816732720 0.825106813 0.833089162 0.851727990 0.865639190 0.868484902 0.878563055 0.892446997 0.899737710 0.904911695 0.911811280 0.921072451 0.922459916 0.976555481 1.295879380 1.491554005</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">49</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.80951011" y3="0.87651795" z3="3.87092218">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.09278919" y3="1.22216974" z3="2.8584209">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.26825707" y3="1.08145869" z3="4.00837292">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.36684198" y3="1.49245723" z3="4.59780246">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11456115" y3="-0.61071767" z3="4.04572205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82215611" y3="-0.92472196" z3="5.06302196">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48971425" y3="-1.19578624" z3="3.34244784">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58528604" y3="-0.97337112" z3="3.81443235">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.7027199" y3="-2.06952395" z3="3.90638931">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.84668617" y3="-0.71824124" z3="2.76684657">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59569187" y3="-0.30415902" z3="4.75838886">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60952018" y3="-0.5552229" z3="4.40090547">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.49527024" y3="0.79582618" z3="4.73231315">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.51005783" y3="-0.80902905" z3="6.20572765">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.34386849" y3="-0.67635877" z3="8.43759355">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.23073143" y3="-1.25772564" z3="8.75206135">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.21783517" y3="0.14949294" z3="9.17327015">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10174647" y3="-1.58120465" z3="8.53458987">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90829912" y3="-1.85277286" z3="9.59459898">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22195744" y3="-0.99841448" z3="8.19709402">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22560137" y3="-2.86160457" z3="7.7086237">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.48498871" y3="-2.59179219" z3="6.66707199">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09444578" y3="-3.4374818" z3="8.08071774">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.01950048" y3="-3.75458016" z3="7.71114826">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.22679678" y3="-4.70845186" z3="7.20736545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.28663953" y3="-4.01925453" z3="8.75391553">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.23649709" y3="-3.13741258" z3="7.02081396">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.59083731" y3="-2.2360494" z3="7.54922386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.0798743" y3="-3.85059846" z3="6.97385017">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.98811008" y3="-2.83481717" z3="5.98805259">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.26547906" y3="-1.75057399" z3="6.54250991">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61648656" y3="-0.13681581" z3="7.0645318">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85095106" y3="0.50858967" z3="6.61661473">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.46923049" y3="0.90320064" z3="7.67854887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.41138158" y3="0.0823268" z3="8.41641636">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.24593132" y3="0.63131346" z3="6.94059404">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.81527113" y3="1.80963114" z3="8.21237492">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11660253" y3="1.12724797" z3="7.00750182">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.81989875" y3="0.20780609" z3="6.47829739">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.18781169" y3="1.93016089" z3="6.25382154">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.01532464" y3="1.48798507" z3="7.99681444">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.79649133" y3="0.64207134" z3="8.66906433">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35819205" y3="2.32647687" z3="8.64282916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72540493" y3="1.97258594" z3="7.34966914">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70372853" y3="2.57844235" z3="6.28394248">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88842328" y3="2.09137733" z3="8.08265247">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8095,.8765,3.8709;-1.0928,1.2222,2.8584;.2683,1.0815,4.0084;-1.3668,1.4925,4.5978;-1.1146,-.6107,4.0457;-.8222,-.9247,5.063;-.4897,-1.1958,3.3424;-2.5853,-.9734,3.8144;-2.7027,-2.0695,3.9064;-2.8467,-.7182,2.7668;-3.5957,-.3042,4.7584;-4.6095,-.5552,4.4009;-3.4953,.7958,4.7323;-3.5101,-.809,6.2057;-2.3439,-.6764,8.4376;-3.2307,-1.2577,8.7521;-2.2178,.1495,9.1733;-1.1017,-1.5812,8.5346;-.9083,-1.8528,9.5946;-.222,-.9984,8.1971;-1.2256,-2.8616,7.7086;-1.485,-2.5918,6.6671;-2.0944,-3.4375,8.0807;.0195,-3.7546,7.7111;-.2268,-4.7085,7.2074;.2866,-4.0193,8.7539;1.2365,-3.1374,7.0208;1.5908,-2.236,7.5492;2.0799,-3.8506,6.9739;.9881,-2.8348,5.9881;-4.2655,-1.7506,6.5425;-2.6165,-.1368,7.0645;-1.851,.5086,6.6166;-7.4692,.9032,7.6785;-7.4114,.0823,8.4164;-8.2459,.6313,6.9406;-7.8153,1.8096,8.2124;-6.1166,1.1272,7.0075;-5.8199,.2078,6.4783;-6.1878,1.9302,6.2538;-5.0153,1.488,7.9968;-4.7965,.6421,8.6691;-5.3582,2.3265,8.6428;-3.7254,1.9726,7.3497;-3.7037,2.5784,6.2839;-2.8884,2.0914,8.0827;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724127173786</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002285734971 0.000573329633 0.029945980011 0.008508950273</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002912303 -0.001046674 0.000197291 0.000246418 0.000395858 0.000812320 0.000918460 0.001131956 0.001538079 0.001895358 0.002723849 0.003050225 0.003271740 0.003876433 0.004715875 0.005669511 0.005818858 0.006481468 0.007688331 0.008435663 0.010058582 0.010888400 0.011435209 0.013137676 0.018407868 0.019570517 0.021771125 0.023844689 0.028991884 0.031262877 0.033170515 0.033971468 0.035902544 0.038800953 0.043294300 0.044032187 0.045496670 0.048688682 0.049772907 0.049877968 0.050625837 0.051683631 0.052247052 0.052883118 0.054270739 0.054924634 0.057146046 0.058475998 0.061469400 0.061654941 0.066284469 0.069397218 0.072391460 0.075980886 0.077551637 0.078522178 0.078828561 0.082343075 0.084393328 0.091316328 0.096161142 0.098732085 0.104150509 0.105140404 0.107941333 0.111351695 0.113701682 0.113979808 0.116873540 0.118972296 0.130897670 0.135033016 0.137484342 0.144487632 0.146184094 0.153820011 0.154841129 0.166023687 0.170613475 0.173632498 0.180705949 0.189827338 0.195185549 0.203123479 0.208851107 0.213766397 0.218789140 0.238704249 0.254899028 0.265942570 0.313409939 0.323836774 0.351574414 0.360530415 0.414890957 0.450056301 0.502140009 0.536643118 0.562205329 0.597779691 0.618038871 0.632725282 0.684621426 0.736170093 0.745420996 0.746501557 0.751677896 0.759309444 0.769349934 0.771392751 0.785140995 0.786161267 0.791536417 0.797722338 0.807118074 0.810003595 0.817191268 0.825134832 0.833104928 0.851809984 0.865643152 0.868484451 0.878596038 0.892451950 0.899737581 0.904929535 0.911870473 0.921075023 0.922580252 0.976927799 1.295960505 1.491678841</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">50</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.79672726" y3="0.86348077" z3="3.87975422">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.07274521" y3="1.20771861" z3="2.86466813">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.28066592" y3="1.06424102" z3="4.02322818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.35516859" y3="1.48430852" z3="4.60143686">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.1103221" y3="-0.62166849" z3="4.05726757">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82392577" y3="-0.93457841" z3="5.07689242">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48537325" y3="-1.21224488" z3="3.35868649">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5826569" y3="-0.97712247" z3="3.82052742">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.70686267" y3="-2.07318194" z3="3.91362038">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.83893259" y3="-0.72152102" z3="2.77165272">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59369093" y3="-0.30177299" z3="4.76027625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60762389" y3="-0.5512949" z3="4.40141003">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.49008118" y3="0.79792823" z3="4.73213989">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50958403" y3="-0.80427634" z3="6.20838191">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.343882" y3="-0.66831938" z3="8.43945886">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22999481" y3="-1.24917956" z3="8.75708932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.21473362" y3="0.15733684" z3="9.17470837">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10187387" y3="-1.57422129" z3="8.53243816">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90212909" y3="-1.84188109" z3="9.59240461">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22394998" y3="-0.9925047" z3="8.18781262">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22838981" y3="-2.85715492" z3="7.71068593">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.48762113" y3="-2.5887466" z3="6.6726536">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09399361" y3="-3.43154975" z3="8.08211097">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.01725444" y3="-3.74829213" z3="7.70759677">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.23117498" y3="-4.7044069" z3="7.20928406">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.29473707" y3="-4.00863089" z3="8.74868662">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.22618025" y3="-3.13071156" z3="7.00118299">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.5839128" y3="-2.22356433" z3="7.51927788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07252826" y3="-3.84056091" z3="6.94976294">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.96384381" y3="-2.83641766" z3="5.96732488">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.25956987" y3="-1.7487094" z3="6.54505017">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61891896" y3="-0.12749539" z3="7.06687506">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8511432" y3="0.50746394" z3="6.61749358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.47143349" y3="0.89904893" z3="7.67597822">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.41285644" y3="0.06852924" z3="8.40354288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25007151" y3="0.63846021" z3="6.93568826">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.81397274" y3="1.79908976" z3="8.22205581">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12044714" y3="1.13023672" z3="7.00459259">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8243154" y3="0.21658489" z3="6.46494719">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.1941545" y3="1.94165478" z3="6.25928565">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.01850324" y3="1.48152072" z3="7.99701071">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.79917405" y3="0.62479751" z3="8.65995454">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36409561" y3="2.31386458" z3="8.65519693">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.7262998" y3="1.97162437" z3="7.35140736">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70448467" y3="2.58129634" z3="6.28782323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.89221346" y3="2.09127814" z3="8.08856502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7967,.8635,3.8798;-1.0727,1.2077,2.8647;.2807,1.0642,4.0232;-1.3552,1.4843,4.6014;-1.1103,-.6217,4.0573;-.8239,-.9346,5.0769;-.4854,-1.2122,3.3587;-2.5827,-.9771,3.8205;-2.7069,-2.0732,3.9136;-2.8389,-.7215,2.7717;-3.5937,-.3018,4.7603;-4.6076,-.5513,4.4014;-3.4901,.7979,4.7321;-3.5096,-.8043,6.2084;-2.3439,-.6683,8.4395;-3.23,-1.2492,8.7571;-2.2147,.1573,9.1747;-1.1019,-1.5742,8.5324;-.9021,-1.8419,9.5924;-.2239,-.9925,8.1878;-1.2284,-2.8572,7.7107;-1.4876,-2.5887,6.6727;-2.094,-3.4315,8.0821;.0173,-3.7483,7.7076;-.2312,-4.7044,7.2093;.2947,-4.0086,8.7487;1.2262,-3.1307,7.0012;1.5839,-2.2236,7.5193;2.0725,-3.8406,6.9498;.9638,-2.8364,5.9673;-4.2596,-1.7487,6.5451;-2.6189,-.1275,7.0669;-1.8511,.5075,6.6175;-7.4714,.899,7.676;-7.4129,.0685,8.4035;-8.2501,.6385,6.9357;-7.814,1.7991,8.2221;-6.1204,1.1302,7.0046;-5.8243,.2166,6.4649;-6.1942,1.9417,6.2593;-5.0185,1.4815,7.997;-4.7992,.6248,8.66;-5.3641,2.3139,8.6552;-3.7263,1.9716,7.3514;-3.7045,2.5813,6.2878;-2.8922,2.0913,8.0886;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724121709878</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002471702215 0.000610570121 0.027646159222 0.008511196182</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002909133 -0.001021202 0.000177472 0.000245957 0.000393998 0.000816587 0.000921008 0.001142985 0.001541150 0.001896314 0.002737681 0.003050915 0.003279058 0.003877319 0.004743283 0.005699284 0.005818907 0.006481273 0.007714253 0.008527818 0.010118407 0.010912854 0.011464351 0.013135017 0.018420096 0.019585385 0.022186003 0.023865122 0.029023414 0.031265888 0.033235426 0.033971780 0.035903054 0.038805404 0.043302911 0.044183920 0.045500780 0.048856479 0.049772910 0.049877605 0.050626517 0.051700612 0.052248006 0.052882104 0.054331908 0.055147862 0.057143327 0.058483214 0.061483005 0.061730888 0.066287839 0.069403877 0.072395104 0.075984202 0.077556485 0.078527776 0.078830670 0.082346428 0.084392105 0.091458562 0.096179028 0.098734639 0.104174618 0.105144803 0.107967456 0.111351125 0.113701297 0.113980194 0.116873157 0.119030878 0.130900906 0.135036403 0.137533951 0.144501374 0.146254809 0.153832236 0.154866997 0.166028108 0.170646591 0.173651854 0.180708439 0.189966444 0.195226007 0.203127533 0.208952488 0.213762872 0.218909064 0.238772113 0.254958993 0.266044321 0.313516462 0.323841093 0.351579166 0.360746118 0.414933413 0.450442520 0.502405481 0.536646608 0.562206045 0.597919338 0.618226520 0.632816170 0.684625188 0.736234698 0.745422516 0.746615014 0.751739572 0.759309540 0.769424148 0.771394453 0.785143240 0.786376924 0.791558631 0.797727392 0.807120869 0.810141274 0.817638875 0.825161442 0.833125173 0.851915906 0.865661303 0.868492605 0.878681639 0.892476255 0.899743470 0.904941699 0.911887312 0.921077029 0.922817909 0.977480026 1.296014354 1.491942583</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">51</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.78400765" y3="0.850806" z3="3.88631059">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.0537915" y3="1.19214609" z3="2.86889603">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.29401385" y3="1.04624644" z3="4.03332134">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.3421232" y3="1.47741319" z3="4.60344105">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10581511" y3="-0.632061" z3="4.06818962">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82523211" y3="-0.94227794" z3="5.09014405">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48074606" y3="-1.2287066" z3="3.37463906">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57847742" y3="-0.98143612" z3="3.82724195">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.70698008" y3="-2.07631594" z3="3.92267046">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.83003616" y3="-0.7276134" z3="2.77698254">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58911205" y3="-0.29941713" z3="4.76260162">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60367181" y3="-0.54560805" z3="4.40228848">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.48145582" y3="0.80011222" z3="4.73305667">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50908068" y3="-0.79886321" z3="6.211575">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.34167964" y3="-0.66110873" z3="8.44279778">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22700946" y3="-1.24187569" z3="8.76251286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.21030008" y3="0.16418873" z3="9.17791229">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09984216" y3="-1.56729072" z3="8.53039883">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89676117" y3="-1.83653962" z3="9.58861025">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22315513" y3="-0.98628723" z3="8.1838986">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23160209" y3="-2.84973363" z3="7.70957982">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.50450427" y3="-2.58412293" z3="6.67183261">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09359091" y3="-3.4256147" z3="8.0937727">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.01450233" y3="-3.74012493" z3="7.69758882">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.23843479" y3="-4.69944565" z3="7.20668079">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.30086863" y3="-3.99499593" z3="8.73762654">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.21631486" y3="-3.12529049" z3="6.9800593">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.5745373" y3="-2.21582898" z3="7.49163172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06254938" y3="-3.83440483" z3="6.92716687">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.9492479" y3="-2.83573958" z3="5.94857902">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.26067257" y3="-1.74218364" z3="6.54899787">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62091433" y3="-0.11877113" z3="7.07198842">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85192066" y3="0.52091762" z3="6.62068542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.47446588" y3="0.89109579" z3="7.6732249">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.41355061" y3="0.05082262" z3="8.38948628">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25356148" y3="0.63800397" z3="6.93100494">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.81926813" y3="1.78331321" z3="8.23249501">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12400893" y3="1.13380941" z3="7.00347422">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8270538" y3="0.22672892" z3="6.45318895">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19836069" y3="1.95216708" z3="6.26662696">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.0218824" y3="1.47687961" z3="7.99800559">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.81034697" y3="0.62329924" z3="8.66229386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36076855" y3="2.31077779" z3="8.65046736">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72758711" y3="1.96068961" z3="7.3553541">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70513843" y3="2.57328953" z3="6.29196058">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.8990932" y3="2.08940695" z3="8.09662653">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.784,.8508,3.8863;-1.0538,1.1921,2.8689;.294,1.0462,4.0333;-1.3421,1.4774,4.6034;-1.1058,-.6321,4.0682;-.8252,-.9423,5.0901;-.4807,-1.2287,3.3746;-2.5785,-.9814,3.8272;-2.707,-2.0763,3.9227;-2.83,-.7276,2.777;-3.5891,-.2994,4.7626;-4.6037,-.5456,4.4023;-3.4815,.8001,4.7331;-3.5091,-.7989,6.2116;-2.3417,-.6611,8.4428;-3.227,-1.2419,8.7625;-2.2103,.1642,9.1779;-1.0998,-1.5673,8.5304;-.8968,-1.8365,9.5886;-.2232,-.9863,8.1839;-1.2316,-2.8497,7.7096;-1.5045,-2.5841,6.6718;-2.0936,-3.4256,8.0938;.0145,-3.7401,7.6976;-.2384,-4.6994,7.2067;.3009,-3.995,8.7376;1.2163,-3.1253,6.9801;1.5745,-2.2158,7.4916;2.0625,-3.8344,6.9272;.9492,-2.8357,5.9486;-4.2607,-1.7422,6.549;-2.6209,-.1188,7.072;-1.8519,.5209,6.6207;-7.4745,.8911,7.6732;-7.4136,.0508,8.3895;-8.2536,.638,6.931;-7.8193,1.7833,8.2325;-6.124,1.1338,7.0035;-5.8271,.2267,6.4532;-6.1984,1.9522,6.2666;-5.0219,1.4769,7.998;-4.8103,.6233,8.6623;-5.3608,2.3108,8.6505;-3.7276,1.9607,7.3554;-3.7051,2.5733,6.292;-2.8991,2.0894,8.0966;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724116015354</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002465227190 0.000590757291 0.037246198754 0.008512436554</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002986365 -0.001084429 0.000166861 0.000273106 0.000426913 0.000916285 0.000972880 0.001170949 0.001543916 0.001901507 0.002742170 0.003050967 0.003279936 0.003878599 0.004766239 0.005703695 0.005818810 0.006482829 0.007712657 0.008556710 0.010165782 0.010923576 0.011459872 0.013151623 0.018427836 0.019590481 0.022495675 0.023884247 0.029023618 0.031265624 0.033326097 0.033972824 0.035903365 0.038820642 0.043311169 0.044312068 0.045506052 0.049001969 0.049773336 0.049882461 0.050627929 0.051717944 0.052247729 0.052888926 0.054365320 0.055435522 0.057141095 0.058482862 0.061508360 0.061848904 0.066297626 0.069423244 0.072402528 0.075982366 0.077561648 0.078535307 0.078841958 0.082349874 0.084391098 0.091650200 0.096197536 0.098738785 0.104199508 0.105149952 0.107984223 0.111351791 0.113701090 0.113980621 0.116874013 0.119099195 0.130901189 0.135036201 0.137568855 0.144513124 0.146308390 0.153851112 0.154901430 0.166027826 0.170687677 0.173666300 0.180708525 0.190148494 0.195226145 0.203130704 0.209023024 0.213753257 0.218923483 0.238800119 0.255032164 0.266095592 0.313574844 0.323844136 0.351579699 0.361069841 0.414947570 0.450683533 0.502671362 0.536651647 0.562210200 0.597976321 0.618541045 0.632914238 0.684632819 0.736512719 0.745422728 0.746784137 0.751790948 0.759309426 0.769539604 0.771394347 0.785154156 0.786578826 0.791618471 0.797738834 0.807122842 0.810230122 0.817958633 0.825170943 0.833165268 0.852005195 0.865672951 0.868519709 0.878715970 0.892504793 0.899772372 0.904968472 0.911904695 0.921078058 0.923047521 0.978046983 1.296039694 1.492131067</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">52</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.77264088" y3="0.84586284" z3="3.88845875">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.03895002" y3="1.18479462" z3="2.86932967">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.30569756" y3="1.03749745" z3="4.03688905">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.32947848" y3="1.47644065" z3="4.60290472">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10010392" y3="-0.63474901" z3="4.07425674">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82201339" y3="-0.94196194" z3="5.09740234">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47640014" y3="-1.23556216" z3="3.38351086">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57306524" y3="-0.97984955" z3="3.83160971">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.70526259" y3="-2.07407185" z3="3.92809498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.82236421" y3="-0.72681895" z3="2.78068966">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.5834771" y3="-0.2950391" z3="4.76435784">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.59653141" y3="-0.541373" z3="4.40269913">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.47485657" y3="0.80367118" z3="4.73353418">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50525232" y3="-0.79302638" z3="6.21380378">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.34125744" y3="-0.65361242" z3="8.44609205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22680507" y3="-1.23329883" z3="8.76734719">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.20729902" y3="0.17117742" z3="9.18117362">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10069515" y3="-1.56198544" z3="8.53180827">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89059338" y3="-1.82334809" z3="9.59169934">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22478436" y3="-0.98432424" z3="8.17426949">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23931731" y3="-2.85117875" z3="7.72066633">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.52283194" y3="-2.59242791" z3="6.68465484">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09555851" y3="-3.42740378" z3="8.11605874">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.0104172" y3="-3.73753199" z3="7.69956403">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.24651798" y3="-4.70013225" z3="7.21736424">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.31259615" y3="-3.98525118" z3="8.73817249">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.20221421" y3="-3.12364842" z3="6.95773796">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.5671753" y3="-2.206037" z3="7.45438552">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05096622" y3="-3.8301208" z3="6.89991331">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.91620245" y3="-2.8469407" z3="5.92369681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.25240573" y3="-1.73935941" z3="6.5500874">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62089416" y3="-0.10928183" z3="7.07545887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85066468" y3="0.52403076" z3="6.62462512">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.47495283" y3="0.88360872" z3="7.66919592">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.41091967" y3="0.04495995" z3="8.38441122">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25300468" y3="0.62800201" z3="6.9271859">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82264817" y3="1.77315573" z3="8.22651943">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.1251742" y3="1.13140966" z3="7.00161127">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82611298" y3="0.2278948" z3="6.44849628">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20190352" y3="1.95217857" z3="6.26825581">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.02448998" y3="1.47277932" z3="7.99817084">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.81077992" y3="0.61063164" z3="8.65613699">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36969937" y3="2.30162209" z3="8.66179674">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72956831" y3="1.96133151" z3="7.35714404">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70694356" y3="2.57601738" z3="6.29476516">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90301973" y3="2.09172488" z3="8.1018816">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7726,.8459,3.8885;-1.039,1.1848,2.8693;.3057,1.0375,4.0369;-1.3295,1.4764,4.6029;-1.1001,-.6347,4.0743;-.822,-.942,5.0974;-.4764,-1.2356,3.3835;-2.5731,-.9798,3.8316;-2.7053,-2.0741,3.9281;-2.8224,-.7268,2.7807;-3.5835,-.295,4.7644;-4.5965,-.5414,4.4027;-3.4749,.8037,4.7335;-3.5053,-.793,6.2138;-2.3413,-.6536,8.4461;-3.2268,-1.2333,8.7673;-2.2073,.1712,9.1812;-1.1007,-1.562,8.5318;-.8906,-1.8233,9.5917;-.2248,-.9843,8.1743;-1.2393,-2.8512,7.7207;-1.5228,-2.5924,6.6847;-2.0956,-3.4274,8.1161;.0104,-3.7375,7.6996;-.2465,-4.7001,7.2174;.3126,-3.9853,8.7382;1.2022,-3.1236,6.9577;1.5672,-2.206,7.4544;2.051,-3.8301,6.8999;.9162,-2.8469,5.9237;-4.2524,-1.7394,6.5501;-2.6209,-.1093,7.0755;-1.8507,.524,6.6246;-7.475,.8836,7.6692;-7.4109,.045,8.3844;-8.253,.628,6.9272;-7.8226,1.7732,8.2265;-6.1252,1.1314,7.0016;-5.8261,.2279,6.4485;-6.2019,1.9522,6.2683;-5.0245,1.4728,7.9982;-4.8108,.6106,8.6561;-5.3697,2.3016,8.6618;-3.7296,1.9613,7.3571;-3.7069,2.576,6.2948;-2.903,2.0917,8.1019;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724099292390</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003135256588 0.000706929896 0.029353165678 0.008512568480</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002997685 -0.001351270 0.000161430 0.000299388 0.000511489 0.000915917 0.001028903 0.001389058 0.001708131 0.001914383 0.002749571 0.003060429 0.003300866 0.003907568 0.004843445 0.005712775 0.005827157 0.006482242 0.007712379 0.008575921 0.010190930 0.010924896 0.011500513 0.013197429 0.018436130 0.019595019 0.022638448 0.023900279 0.029029205 0.031274721 0.033485760 0.033973843 0.035905207 0.038858619 0.043315563 0.044338643 0.045510740 0.049035865 0.049773280 0.049897742 0.050629145 0.051737691 0.052247443 0.052924008 0.054403698 0.055736389 0.057245357 0.058493142 0.061531495 0.061895385 0.066314639 0.069431448 0.072458348 0.076030302 0.077569749 0.078543302 0.078868630 0.082360433 0.084409901 0.091746582 0.096214635 0.098757349 0.104212391 0.105151131 0.108013869 0.111362260 0.113707627 0.113980227 0.116889260 0.119199712 0.130901528 0.135050979 0.137574425 0.144518289 0.146331429 0.153864768 0.154920370 0.166043548 0.170691845 0.173664731 0.180720218 0.190455649 0.195231566 0.203183121 0.209200135 0.214139570 0.219182019 0.238958642 0.255271039 0.266138017 0.313764807 0.323847454 0.351587721 0.361527427 0.415026630 0.450817609 0.502818351 0.536711093 0.562233777 0.597975220 0.618941894 0.632974489 0.684641781 0.737331350 0.745438767 0.746875184 0.751801907 0.759309474 0.769706203 0.771394750 0.785169039 0.786611290 0.791735427 0.797756894 0.807134224 0.810275354 0.817953596 0.825170964 0.833261173 0.852370680 0.865827585 0.868600428 0.878714591 0.892510533 0.899772604 0.904996045 0.911974855 0.921082548 0.923189518 0.978169585 1.296042042 1.492160935</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">53</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.75801009" y3="0.8331871" z3="3.89158784">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.01741993" y3="1.17058324" z3="2.86977361">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.32119609" y3="1.01870366" z3="4.04456432">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.31458984" y3="1.47037036" z3="4.60053252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.09618327" y3="-0.64565002" z3="4.08256923">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82480067" y3="-0.95135433" z3="5.10862484">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47268824" y3="-1.25357431" z3="3.39724579">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57179925" y3="-0.98186648" z3="3.83568356">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.71148316" y3="-2.07604437" z3="3.93204423">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.81770084" y3="-0.72654159" z3="2.78431555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.57961739" y3="-0.29022458" z3="4.767183">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.59541453" y3="-0.531222" z3="4.40567672">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.46529367" y3="0.80872624" z3="4.7360927">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50240375" y3="-0.78772936" z3="6.21669715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33902993" y3="-0.64503925" z3="8.44953763">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22436236" y3="-1.22342898" z3="8.77344225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.20260129" y3="0.18030919" z3="9.18337236">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09939859" y3="-1.55499667" z3="8.53229484">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88591375" y3="-1.81585352" z3="9.59069941">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22487253" y3="-0.97907025" z3="8.17217159">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.24238654" y3="-2.84342271" z3="7.72265679">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.53273109" y3="-2.58509794" z3="6.69019438">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09479749" y3="-3.41853766" z3="8.1237745">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.00554267" y3="-3.73072016" z3="7.69092288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.25476972" y3="-4.69423465" z3="7.21385928">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.31517838" y3="-3.97633405" z3="8.72561522">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.18857064" y3="-3.11991556" z3="6.94107434">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.55434891" y3="-2.20561095" z3="7.43571727">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.03632506" y3="-3.82671581" z3="6.87506353">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.89857853" y3="-2.84062275" z3="5.91407533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24780363" y3="-1.73529082" z3="6.55271521">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62078419" y3="-0.10097669" z3="7.07933207">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84945715" y3="0.53210029" z3="6.6275094">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4757695" y3="0.86988862" z3="7.66792576">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40776158" y3="0.01560678" z3="8.3693785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25335028" y3="0.62455014" z3="6.920802">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82681529" y3="1.75020514" z3="8.24472765">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12789623" y3="1.13228164" z3="7.00048654">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82480497" y3="0.23494533" z3="6.43743299">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20945753" y3="1.96019755" z3="6.27463074">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.02720191" y3="1.46973582" z3="7.99857812">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.81619686" y3="0.61146695" z3="8.65751138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36889981" y3="2.29894757" z3="8.65570808">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73095794" y3="1.95831248" z3="7.35956225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70967396" y3="2.57519985" z3="6.29796214">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.9086103" y3="2.09521372" z3="8.10656271">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.758,.8332,3.8916;-1.0174,1.1706,2.8698;.3212,1.0187,4.0446;-1.3146,1.4704,4.6005;-1.0962,-.6457,4.0826;-.8248,-.9514,5.1086;-.4727,-1.2536,3.3972;-2.5718,-.9819,3.8357;-2.7115,-2.076,3.932;-2.8177,-.7265,2.7843;-3.5796,-.2902,4.7672;-4.5954,-.5312,4.4057;-3.4653,.8087,4.7361;-3.5024,-.7877,6.2167;-2.339,-.645,8.4495;-3.2244,-1.2234,8.7734;-2.2026,.1803,9.1834;-1.0994,-1.555,8.5323;-.8859,-1.8159,9.5907;-.2249,-.9791,8.1722;-1.2424,-2.8434,7.7227;-1.5327,-2.5851,6.6902;-2.0948,-3.4185,8.1238;.0055,-3.7307,7.6909;-.2548,-4.6942,7.2139;.3152,-3.9763,8.7256;1.1886,-3.1199,6.9411;1.5543,-2.2056,7.4357;2.0363,-3.8267,6.8751;.8986,-2.8406,5.9141;-4.2478,-1.7353,6.5527;-2.6208,-.101,7.0793;-1.8495,.5321,6.6275;-7.4758,.8699,7.6679;-7.4078,.0156,8.3694;-8.2534,.6246,6.9208;-7.8268,1.7502,8.2447;-6.1279,1.1323,7.0005;-5.8248,.2349,6.4374;-6.2095,1.9602,6.2746;-5.0272,1.4697,7.9986;-4.8162,.6115,8.6575;-5.3689,2.2989,8.6557;-3.731,1.9583,7.3596;-3.7097,2.5752,6.298;-2.9086,2.0952,8.1066;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724092829697</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003095297578 0.000652560229 0.038077461464 0.008507292797</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.003000944 -0.001384958 0.000159691 0.000302926 0.000520026 0.000916070 0.001036160 0.001423490 0.001907737 0.002087381 0.002748351 0.003097517 0.003397099 0.003948648 0.004999070 0.005721764 0.005885018 0.006485912 0.007712411 0.008590376 0.010195302 0.010928939 0.011548929 0.013251596 0.018452742 0.019597813 0.022628138 0.023897799 0.029037400 0.031368910 0.033678059 0.033974893 0.035904778 0.038984580 0.043315221 0.044337215 0.045512771 0.049033091 0.049778127 0.049902966 0.050632296 0.051758551 0.052247688 0.052949154 0.054406337 0.055845085 0.057285901 0.058561149 0.061545363 0.061894996 0.066342483 0.069465823 0.072504770 0.076151440 0.077575989 0.078555119 0.078907492 0.082424831 0.084472770 0.091743239 0.096238317 0.098779603 0.104215121 0.105156294 0.108018127 0.111374902 0.113722537 0.113982170 0.116934001 0.119346179 0.130904798 0.135049607 0.137586769 0.144522529 0.146343498 0.153873518 0.154920364 0.166065045 0.170691477 0.173680014 0.180735699 0.190870183 0.195242162 0.203304074 0.209235959 0.214727358 0.219816747 0.239055246 0.255466651 0.266294527 0.313828940 0.323846592 0.351620930 0.362138072 0.415075598 0.450836611 0.502890328 0.537057259 0.562265687 0.598093751 0.619171403 0.632974848 0.684645783 0.738447387 0.745469226 0.746952462 0.751803377 0.759312083 0.769970313 0.771397017 0.785177669 0.786610447 0.791891104 0.797789195 0.807154616 0.810309114 0.818114593 0.825193535 0.833421661 0.852757144 0.866100823 0.868733588 0.878743579 0.892510379 0.899792145 0.904999931 0.912038488 0.921084735 0.923222837 0.978177802 1.296044119 1.492161538</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">54</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.74705017" y3="0.82584556" z3="3.89563909">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.00511532" y3="1.16153388" z3="2.8736251">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.3323941" y3="1.00734453" z3="4.04840032">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.30031598" y3="1.46674645" z3="4.60347363">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.09164158" y3="-0.64991483" z3="4.08766527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82248956" y3="-0.95499403" z3="5.11389081">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.470609" y3="-1.26126959" z3="3.40404027">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.567326" y3="-0.98012851" z3="3.83890919">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.71074471" y3="-2.07282051" z3="3.93620341">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.81005936" y3="-0.72529131" z3="2.78682074">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.57386429" y3="-0.28374664" z3="4.76795052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.58923233" y3="-0.52186152" z3="4.40535154">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.45631836" y3="0.81453874" z3="4.73641074">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50002876" y3="-0.7804865" z3="6.21765248">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33799083" y3="-0.63801806" z3="8.4518955">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22314961" y3="-1.21638476" z3="8.77636501">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.20036591" y3="0.1865822" z3="9.1862341">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09892386" y3="-1.5485515" z3="8.53202895">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88148141" y3="-1.80650443" z3="9.59053526">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22483103" y3="-0.974916" z3="8.16613775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.24808983" y3="-2.84130908" z3="7.7293166">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.55305655" y3="-2.59061735" z3="6.69652575">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09556812" y3="-3.41712195" z3="8.14583869">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.00123093" y3="-3.72614275" z3="7.69255295">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.26414408" y3="-4.69564171" z3="7.22766892">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.32467253" y3="-3.96048818" z3="8.72738036">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.17513343" y3="-3.11908147" z3="6.92045699">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.54676728" y3="-2.19346535" z3="7.39763981">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.02329145" y3="-3.82438085" z3="6.85530092">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.86786119" y3="-2.85619842" z3="5.88967075">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24496716" y3="-1.7288119" z3="6.55232381">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62095853" y3="-0.09166893" z3="7.08275569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.848995" y3="0.54234581" z3="6.63103732">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.47472879" y3="0.85742842" z3="7.66464702">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40227228" y3="0.00910447" z3="8.36650913">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25203597" y3="0.60753611" z3="6.92024931">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82823153" y3="1.73495474" z3="8.23562106">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12799214" y3="1.12958071" z3="6.99874787">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82119072" y3="0.23794143" z3="6.42884292">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21321752" y3="1.96264355" z3="6.27883719">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.02922036" y3="1.46550839" z3="7.99939311">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.81949817" y3="0.60236841" z3="8.65537172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37427922" y3="2.29223489" z3="8.66286151">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73229467" y3="1.95530835" z3="7.36295866">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70991566" y3="2.5750263" z3="6.30205189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.91312536" y3="2.09569939" z3="8.11409858">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7471,.8258,3.8956;-1.0051,1.1615,2.8736;.3324,1.0073,4.0484;-1.3003,1.4667,4.6035;-1.0916,-.6499,4.0877;-.8225,-.955,5.1139;-.4706,-1.2613,3.404;-2.5673,-.9801,3.8389;-2.7107,-2.0728,3.9362;-2.8101,-.7253,2.7868;-3.5739,-.2837,4.768;-4.5892,-.5219,4.4054;-3.4563,.8145,4.7364;-3.5,-.7805,6.2177;-2.338,-.638,8.4519;-3.2231,-1.2164,8.7764;-2.2004,.1866,9.1862;-1.0989,-1.5486,8.532;-.8815,-1.8065,9.5905;-.2248,-.9749,8.1661;-1.2481,-2.8413,7.7293;-1.5531,-2.5906,6.6965;-2.0956,-3.4171,8.1458;.0012,-3.7261,7.6926;-.2641,-4.6956,7.2277;.3247,-3.9605,8.7274;1.1751,-3.1191,6.9205;1.5468,-2.1935,7.3976;2.0233,-3.8244,6.8553;.8679,-2.8562,5.8897;-4.245,-1.7288,6.5523;-2.621,-.0917,7.0828;-1.849,.5423,6.631;-7.4747,.8574,7.6646;-7.4023,.0091,8.3665;-8.252,.6075,6.9202;-7.8282,1.735,8.2356;-6.128,1.1296,6.9987;-5.8212,.2379,6.4288;-6.2132,1.9626,6.2788;-5.0292,1.4655,7.9994;-4.8195,.6024,8.6554;-5.3743,2.2922,8.6629;-3.7323,1.9553,7.363;-3.7099,2.575,6.3021;-2.9131,2.0957,8.1141;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724084868376</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002627594794 0.000689637253 0.035039715498 0.008520606023</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002999774 -0.001283118 0.000159164 0.000306204 0.000523653 0.000915933 0.001032573 0.001422711 0.001936176 0.002096357 0.002748017 0.003104668 0.003475269 0.004010358 0.005134287 0.005729866 0.005911560 0.006507391 0.007725198 0.008587715 0.010197390 0.010934459 0.011556753 0.013280380 0.018466241 0.019597228 0.022679817 0.023904349 0.029043128 0.031677912 0.033834898 0.033979162 0.035910183 0.039251337 0.043315053 0.044353443 0.045512794 0.049067323 0.049792728 0.049905674 0.050654626 0.051773579 0.052251890 0.052949593 0.054405090 0.055855553 0.057288235 0.058591418 0.061543910 0.061901444 0.066351794 0.069469174 0.072525326 0.076219590 0.077579601 0.078575088 0.078923242 0.082505004 0.084529784 0.091795848 0.096254769 0.098790650 0.104216712 0.105164965 0.108017294 0.111378228 0.113743653 0.113989557 0.116962909 0.119484361 0.130906524 0.135052356 0.137654350 0.144576898 0.146346247 0.153872813 0.154919134 0.166064351 0.170709062 0.173693034 0.180750092 0.191054018 0.195300020 0.203312932 0.209241699 0.215026515 0.220498902 0.239185414 0.255561385 0.266427577 0.313875774 0.323847264 0.351729616 0.362441438 0.415106774 0.450835971 0.502895805 0.537767165 0.562274285 0.598397635 0.619180702 0.633055989 0.684648016 0.739071108 0.745475036 0.746954589 0.751833512 0.759327358 0.770159631 0.771430979 0.785182752 0.786699788 0.791963317 0.797789409 0.807183769 0.810352296 0.818572999 0.825218584 0.833523743 0.853167898 0.866398588 0.868933887 0.878778711 0.892590874 0.899836864 0.905010993 0.912169274 0.921091512 0.923222408 0.978222184 1.296074398 1.492192639</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">55</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.73326182" y3="0.8185919" z3="3.89823909">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.98516386" y3="1.1533577" z3="2.87359236">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.34729029" y3="0.99375006" z3="4.0544142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.28583296" y3="1.46449176" z3="4.60237225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.08661282" y3="-0.65532004" z3="4.09466487">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82292301" y3="-0.95836559" z3="5.12341612">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.46606152" y3="-1.27261347" z3="3.41504155">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56311896" y3="-0.97888475" z3="3.842301">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.7121941" y3="-2.07120916" z3="3.93995638">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.80230101" y3="-0.72358284" z3="2.78952101">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.56887572" y3="-0.27909158" z3="4.76906002">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.5838215" y3="-0.51549441" z3="4.40508209">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.44918363" y3="0.81852961" z3="4.73680778">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49713404" y3="-0.7750645" z3="6.21908022">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33799577" y3="-0.63030422" z3="8.45471788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22321528" y3="-1.20761468" z3="8.7810325">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.19849585" y3="0.19476165" z3="9.18811348">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09970424" y3="-1.54239676" z3="8.5336052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.87473473" y3="-1.79207927" z3="9.59320826">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22736604" y3="-0.97184939" z3="8.15679609">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.25511252" y3="-2.8402576" z3="7.73967905">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.56791423" y3="-2.59399931" z3="6.71074383">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09652711" y3="-3.41532708" z3="8.1643893">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.00286279" y3="-3.7219964" z3="7.69028926">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27125315" y3="-4.69363008" z3="7.23444638">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.33632226" y3="-3.95007693" z3="8.72144432">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.15836139" y3="-3.11636919" z3="6.89837618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.53366382" y3="-2.1937371" z3="7.37018009">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.00849123" y3="-3.82016522" z3="6.82026121">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.83896085" y3="-2.85367609" z3="5.87456473">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24002872" y3="-1.72488691" z3="6.55249468">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62140094" y3="-0.08370671" z3="7.08535954">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84787027" y3="0.54518179" z3="6.63399188">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4746853" y3="0.84950338" z3="7.66099047">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.39979233" y3="-0.01242273" z3="8.35286179">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.24990761" y3="0.60452526" z3="6.91133158">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.83430397" y3="1.72038977" z3="8.24801229">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12849227" y3="1.12629309" z3="6.99870639">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82176065" y3="0.23527051" z3="6.43356714">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21306605" y3="1.95451702" z3="6.27759719">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03131674" y3="1.46301131" z3="8.00047975">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.82150938" y3="0.60134829" z3="8.65680077">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37776003" y3="2.28907208" z3="8.66134833">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.7336734" y3="1.95541652" z3="7.36507609">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71309744" y3="2.57763837" z3="6.30580358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.91672691" y3="2.09892815" z3="8.11807009">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7333,.8186,3.8982;-.9852,1.1534,2.8736;.3473,.9938,4.0544;-1.2858,1.4645,4.6024;-1.0866,-.6553,4.0947;-.8229,-.9584,5.1234;-.4661,-1.2726,3.415;-2.5631,-.9789,3.8423;-2.7122,-2.0712,3.94;-2.8023,-.7236,2.7895;-3.5689,-.2791,4.7691;-4.5838,-.5155,4.4051;-3.4492,.8185,4.7368;-3.4971,-.7751,6.2191;-2.338,-.6303,8.4547;-3.2232,-1.2076,8.781;-2.1985,.1948,9.1881;-1.0997,-1.5424,8.5336;-.8747,-1.7921,9.5932;-.2274,-.9718,8.1568;-1.2551,-2.8403,7.7397;-1.5679,-2.594,6.7107;-2.0965,-3.4153,8.1644;-.0029,-3.722,7.6903;-.2713,-4.6936,7.2344;.3363,-3.9501,8.7214;1.1584,-3.1164,6.8984;1.5337,-2.1937,7.3702;2.0085,-3.8202,6.8203;.839,-2.8537,5.8746;-4.24,-1.7249,6.5525;-2.6214,-.0837,7.0854;-1.8479,.5452,6.634;-7.4747,.8495,7.661;-7.3998,-.0124,8.3529;-8.2499,.6045,6.9113;-7.8343,1.7204,8.248;-6.1285,1.1263,6.9987;-5.8218,.2353,6.4336;-6.2131,1.9545,6.2776;-5.0313,1.463,8.0005;-4.8215,.6013,8.6568;-5.3778,2.2891,8.6613;-3.7337,1.9554,7.3651;-3.7131,2.5776,6.3058;-2.9167,2.0989,8.1181;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724062946732</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.004483702959 0.000829816988 0.032552771326 0.008514557643</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.003079572 -0.002138531 0.000162216 0.000304407 0.000538954 0.000917759 0.001063900 0.001435087 0.002040305 0.002096182 0.002750119 0.003104957 0.003518321 0.004060246 0.005256596 0.005749299 0.005908781 0.006552984 0.007776016 0.008616060 0.010198755 0.010933503 0.011556340 0.013284440 0.018480977 0.019597931 0.022802547 0.023913427 0.029228264 0.032379204 0.033960446 0.034202011 0.035920333 0.040021157 0.043317293 0.044379959 0.045526264 0.049131706 0.049815495 0.049909938 0.050772624 0.051801292 0.052252490 0.052948752 0.054411439 0.055857551 0.057310808 0.058588128 0.061570721 0.061916847 0.066353260 0.069476687 0.072521045 0.076223853 0.077584095 0.078590827 0.078924938 0.082588037 0.084538979 0.091938783 0.096262748 0.098791707 0.104223488 0.105193917 0.108028908 0.111378019 0.113750145 0.114005627 0.116980641 0.119649340 0.130906480 0.135104606 0.137765034 0.144720386 0.146343230 0.153891638 0.154923546 0.166065152 0.170706350 0.173690260 0.180750926 0.191203160 0.195381761 0.203350888 0.209252525 0.215049033 0.220476192 0.239220303 0.255556680 0.266407282 0.313873650 0.323846541 0.351791197 0.362631249 0.415105708 0.450842480 0.502900795 0.539469985 0.562274855 0.599034694 0.619691269 0.633453731 0.684648073 0.739472789 0.745476638 0.746964022 0.751950432 0.759346002 0.770393892 0.771572869 0.785188870 0.786733242 0.791995564 0.797793850 0.807189182 0.810703689 0.818848514 0.825220414 0.833734402 0.853345745 0.866522880 0.869052595 0.878778463 0.892658028 0.899872826 0.905118521 0.912184946 0.921091517 0.923227715 0.978305585 1.296148230 1.492207709</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">56</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.71916248" y3="0.80796889" z3="3.89896324">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.96729844" y3="1.14230311" z3="2.87359699">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.3616904" y3="0.97727163" z3="4.05674017">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.26866033" y3="1.45912839" z3="4.60060932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.08291153" y3="-0.66326479" z3="4.09790189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82439392" y3="-0.96571528" z3="5.12809842">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.46425373" y3="-1.28555128" z3="3.42151481">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56158538" y3="-0.97720491" z3="3.84248684">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.71793054" y3="-2.06871604" z3="3.93885547">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.79801388" y3="-0.7187137" z3="2.78977642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.56321926" y3="-0.27124139" z3="4.76965641">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.58096862" y3="-0.49966853" z3="4.4054202">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.43581515" y3="0.82633543" z3="4.73857577">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49347425" y3="-0.77086154" z3="6.21875642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33634744" y3="-0.62936395" z3="8.45653707">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22247417" y3="-1.20585526" z3="8.78180542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.19784025" y3="0.19628807" z3="9.18946544">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09856051" y3="-1.54169737" z3="8.53787742">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.87406154" y3="-1.79047211" z3="9.59654362">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.2270026" y3="-0.9726383" z3="8.16153474">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.25492544" y3="-2.84021709" z3="7.74728973">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.58062325" y3="-2.59751617" z3="6.72055017">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.0902591" y3="-3.417311" z3="8.18301785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.00203059" y3="-3.71909459" z3="7.69016529">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27210985" y3="-4.6946566" z3="7.24292097">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.34610148" y3="-3.94089044" z3="8.71773189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.14757241" y3="-3.11547791" z3="6.88224877">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.52638973" y3="-2.18162224" z3="7.33762732">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="1.99767616" y3="-3.81684155" z3="6.80234598">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.81230306" y3="-2.86593312" z3="5.85726925">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23785366" y3="-1.72140734" z3="6.54888106">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61716703" y3="-0.08446057" z3="7.08656644">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84808924" y3="0.55763184" z3="6.63864964">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.47621651" y3="0.8330746" z3="7.66208455">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.39820774" y3="-0.02055427" z3="8.35586842">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.24982419" y3="0.58548369" z3="6.91310745">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.83672483" y3="1.70213415" z3="8.24018291">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.13139134" y3="1.12474843" z3="6.99913193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.81009662" y3="0.24065763" z3="6.41918015">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.22687935" y3="1.96592302" z3="6.2860032">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03722165" y3="1.46704973" z3="8.00232611">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.82099581" y3="0.60536344" z3="8.65693281">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38897646" y3="2.28984497" z3="8.66540396">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.74361935" y3="1.96828051" z3="7.36929024">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72355732" y3="2.58884843" z3="6.30944918">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.92495872" y3="2.10906761" z3="8.11894688">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7192,.808,3.899;-.9673,1.1423,2.8736;.3617,.9773,4.0567;-1.2687,1.4591,4.6006;-1.0829,-.6633,4.0979;-.8244,-.9657,5.1281;-.4643,-1.2856,3.4215;-2.5616,-.9772,3.8425;-2.7179,-2.0687,3.9389;-2.798,-.7187,2.7898;-3.5632,-.2712,4.7697;-4.581,-.4997,4.4054;-3.4358,.8263,4.7386;-3.4935,-.7709,6.2188;-2.3363,-.6294,8.4565;-3.2225,-1.2059,8.7818;-2.1978,.1963,9.1895;-1.0986,-1.5417,8.5379;-.8741,-1.7905,9.5965;-.227,-.9726,8.1615;-1.2549,-2.8402,7.7473;-1.5806,-2.5975,6.7206;-2.0903,-3.4173,8.183;-.002,-3.7191,7.6902;-.2721,-4.6947,7.2429;.3461,-3.9409,8.7177;1.1476,-3.1155,6.8822;1.5264,-2.1816,7.3376;1.9977,-3.8168,6.8023;.8123,-2.8659,5.8573;-4.2379,-1.7214,6.5489;-2.6172,-.0845,7.0866;-1.8481,.5576,6.6386;-7.4762,.8331,7.6621;-7.3982,-.0206,8.3559;-8.2498,.5855,6.9131;-7.8367,1.7021,8.2402;-6.1314,1.1247,6.9991;-5.8101,.2407,6.4192;-6.2269,1.9659,6.286;-5.0372,1.467,8.0023;-4.821,.6054,8.6569;-5.389,2.2898,8.6654;-3.7436,1.9683,7.3693;-3.7236,2.5888,6.3094;-2.925,2.1091,8.1189;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724039077215</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.005571215486 0.001073708846 0.028178211133 0.008521180184</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.005631297 -0.001243365 0.000167971 0.000303661 0.000550114 0.000923249 0.001063350 0.001442103 0.002056626 0.002136175 0.002749642 0.003174695 0.003561777 0.004068648 0.005239234 0.005745577 0.005945710 0.006618824 0.007777947 0.008716794 0.010201357 0.010950147 0.011561145 0.013313504 0.018502660 0.019686160 0.022817238 0.023911379 0.029504956 0.032921555 0.033966841 0.035093738 0.035921530 0.041633536 0.043327610 0.044407088 0.045607700 0.049213359 0.049839873 0.049926017 0.051080516 0.051862654 0.052252134 0.052951309 0.054406803 0.055857290 0.057315118 0.058600684 0.061627119 0.061971863 0.066370987 0.069472292 0.072520775 0.076229931 0.077587881 0.078607399 0.078935698 0.082643480 0.084542080 0.092050842 0.096262482 0.098793272 0.104294849 0.105259203 0.108031396 0.111382140 0.113752074 0.114027237 0.116982795 0.119756791 0.130906471 0.135165366 0.137809779 0.144867416 0.146339289 0.153918850 0.154958178 0.166064462 0.170740124 0.173688786 0.180750471 0.191258574 0.195555014 0.203645877 0.209300025 0.215042136 0.220504976 0.239236680 0.255554177 0.266475717 0.313874426 0.323845420 0.351845611 0.362795820 0.415152314 0.450842176 0.502921089 0.542181552 0.562279668 0.599805906 0.621284105 0.634076570 0.684651261 0.739539452 0.745527556 0.746993342 0.752192962 0.759348060 0.770590328 0.771878961 0.785188612 0.786731857 0.792015573 0.797817971 0.807201162 0.811434175 0.819116789 0.825225016 0.834065213 0.853592316 0.866617342 0.869070791 0.878813229 0.892827721 0.899932966 0.905424044 0.912218040 0.921090880 0.923239054 0.978677045 1.296513354 1.492216395</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">57</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.7157359" y3="0.80410946" z3="3.91273178">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.96023558" y3="1.13721671" z3="2.88615955">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.36382592" y3="0.97476931" z3="4.07572697">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.26885816" y3="1.45406775" z3="4.61172795">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.07778293" y3="-0.66625928" z3="4.10907088">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82056076" y3="-0.9686437" z3="5.13905516">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.45736323" y3="-1.28739133" z3="3.43422909">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5545625" y3="-0.9818597" z3="3.84849434">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.71016463" y3="-2.07300355" z3="3.94555592">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.78658833" y3="-0.72526995" z3="2.79433757">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.56159159" y3="-0.27576464" z3="4.76991074">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.57639931" y3="-0.50895244" z3="4.40282125">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.43761752" y3="0.82153738" z3="4.73633008">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49582124" y3="-0.76912665" z3="6.22090194">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33863602" y3="-0.62014452" z3="8.45804996">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22170667" y3="-1.19936587" z3="8.7866916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.19860871" y3="0.20451321" z3="9.19165533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09837957" y3="-1.53001428" z3="8.53095573">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.86454055" y3="-1.77546413" z3="9.58936113">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22964774" y3="-0.9606127" z3="8.14491448">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.26082189" y3="-2.83268288" z3="7.74609973">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.59861687" y3="-2.59715807" z3="6.71938418">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.09117468" y3="-3.41050967" z3="8.19506506">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.00644904" y3="-3.70922396" z3="7.68247549">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27971356" y3="-4.68882191" z3="7.24521907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.35309382" y3="-3.92134537" z3="8.71007292">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.13664691" y3="-3.11065883" z3="6.86280672">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.51149298" y3="-2.17367533" z3="7.3094491">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="1.98749686" y3="-3.81123803" z3="6.789306">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.80197466" y3="-2.87234397" z3="5.83847986">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23635855" y3="-1.72088369" z3="6.55244387">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.6252537" y3="-0.07206432" z3="7.0897659">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84873515" y3="0.54977009" z3="6.63727805">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.47631802" y3="0.83949846" z3="7.65752609">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.39954586" y3="-0.02505976" z3="8.34357862">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25283577" y3="0.59969316" z3="6.90769723">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.83435043" y3="1.70565492" z3="8.24770116">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.13091127" y3="1.12496142" z3="6.99645855">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82291157" y3="0.23966326" z3="6.42172981">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21801681" y3="1.96173724" z3="6.28305681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03435452" y3="1.45510463" z3="8.00206386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.82868691" y3="0.58913662" z3="8.6559634">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38083069" y3="2.27977217" z3="8.66667136">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73401859" y3="1.94762538" z3="7.36926063">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71278529" y3="2.57380297" z3="6.31171621">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.92100984" y3="2.09536063" z3="8.12793711">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7157,.8041,3.9127;-.9602,1.1372,2.8862;.3638,.9748,4.0757;-1.2689,1.4541,4.6117;-1.0778,-.6663,4.1091;-.8206,-.9686,5.1391;-.4574,-1.2874,3.4342;-2.5546,-.9819,3.8485;-2.7102,-2.073,3.9456;-2.7866,-.7253,2.7943;-3.5616,-.2758,4.7699;-4.5764,-.509,4.4028;-3.4376,.8215,4.7363;-3.4958,-.7691,6.2209;-2.3386,-.6201,8.458;-3.2217,-1.1994,8.7867;-2.1986,.2045,9.1917;-1.0984,-1.53,8.531;-.8645,-1.7755,9.5894;-.2296,-.9606,8.1449;-1.2608,-2.8327,7.7461;-1.5986,-2.5972,6.7194;-2.0912,-3.4105,8.1951;-.0064,-3.7092,7.6825;-.2797,-4.6888,7.2452;.3531,-3.9213,8.7101;1.1366,-3.1107,6.8628;1.5115,-2.1737,7.3094;1.9875,-3.8112,6.7893;.802,-2.8723,5.8385;-4.2364,-1.7209,6.5524;-2.6253,-.0721,7.0898;-1.8487,.5498,6.6373;-7.4763,.8395,7.6575;-7.3995,-.0251,8.3436;-8.2528,.5997,6.9077;-7.8344,1.7057,8.2477;-6.1309,1.125,6.9965;-5.8229,.2397,6.4217;-6.218,1.9617,6.2831;-5.0344,1.4551,8.0021;-4.8287,.5891,8.656;-5.3808,2.2798,8.6667;-3.734,1.9476,7.3693;-3.7128,2.5738,6.3117;-2.921,2.0954,8.1279;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724048306558</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003369158578 0.000798162642 0.039872156290 0.008508347136</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.007999961 -0.000900334 0.000171932 0.000338711 0.000556796 0.000911902 0.001066438 0.001442037 0.002055210 0.002110582 0.002749933 0.003231816 0.003706577 0.004069771 0.005288951 0.005770695 0.005932304 0.006774418 0.007777982 0.008705858 0.010206278 0.010966463 0.011573394 0.013687390 0.018517338 0.020098259 0.022849097 0.023974473 0.029544316 0.032908537 0.033969264 0.035393109 0.036160792 0.042008192 0.043324200 0.044444376 0.045723588 0.049274058 0.049852885 0.049946886 0.051218059 0.051877100 0.052253633 0.052951718 0.054418344 0.055875184 0.057332653 0.058635584 0.061627581 0.062076499 0.066467608 0.069470009 0.072533224 0.076231054 0.077594051 0.078605988 0.078970213 0.082637800 0.084560014 0.092060360 0.096272347 0.098799611 0.104372897 0.105262955 0.108039418 0.111391947 0.113753043 0.114031477 0.116984243 0.119748964 0.130906492 0.135166679 0.137822836 0.144868384 0.146339218 0.153931965 0.154971907 0.166092411 0.170862456 0.173698677 0.180774650 0.191255164 0.195709817 0.203836847 0.209467054 0.215176723 0.220552689 0.239257159 0.255609962 0.266515871 0.313934401 0.323846355 0.351857033 0.362797152 0.415579402 0.450921079 0.502946062 0.542754667 0.562330925 0.599811338 0.622005099 0.634052727 0.684760484 0.739562003 0.745560387 0.747013535 0.752237533 0.759357319 0.770603747 0.771893834 0.785189980 0.786793587 0.792016222 0.797837968 0.807300227 0.811571951 0.819110320 0.825245438 0.834203659 0.853687070 0.866629753 0.869486278 0.878853152 0.892875075 0.899943895 0.905699862 0.912236081 0.921095714 0.923323123 0.979374188 1.297058727 1.492242946</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">58</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.70476732" y3="0.79838465" z3="3.91843504">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.94201336" y3="1.13238484" z3="2.88995445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.3761537" y3="0.96245447" z3="4.0859811">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.25832638" y3="1.45283874" z3="4.61447673">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.07547027" y3="-0.67124858" z3="4.1165414">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82563561" y3="-0.97307255" z3="5.14933028">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.45362667" y3="-1.29769713" z3="3.44599125">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5522196" y3="-0.98168812" z3="3.85087357">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.71096347" y3="-2.0723663" z3="3.9472085">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.78022771" y3="-0.72416272" z3="2.79616352">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.559055" y3="-0.27399294" z3="4.77037356">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.57381903" y3="-0.50390214" z3="4.40106491">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.43171165" y3="0.82304672" z3="4.73863659">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49616516" y3="-0.76983739" z3="6.22051927">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.34132595" y3="-0.62531817" z3="8.46025697">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22474737" y3="-1.20561435" z3="8.78609709">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.20423999" y3="0.1992915" z3="9.19453928">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10020697" y3="-1.53358527" z3="8.53649737">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.86568921" y3="-1.77489488" z3="9.59537937">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23288167" y3="-0.96391488" z3="8.1487252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.25843476" y3="-2.83810269" z3="7.75499802">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.59472349" y3="-2.60261438" z3="6.7332536">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.0833711" y3="-3.41751351" z3="8.2006092">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.00091513" y3="-3.70755473" z3="7.68571662">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27084944" y3="-4.69301507" z3="7.26085812">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.37687944" y3="-3.90790659" z3="8.71078167">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.12769484" y3="-3.105044" z3="6.83906861">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.50263285" y3="-2.15996619" z3="7.26957695">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="1.98843681" y3="-3.7958784" z3="6.75560325">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.76757467" y3="-2.88029857" z3="5.81538345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23930959" y3="-1.72065459" z3="6.54994451">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62587359" y3="-0.07665179" z3="7.09197595">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85093991" y3="0.55655775" z3="6.64226458">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.48016097" y3="0.84137516" z3="7.65582823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40449289" y3="-0.02066063" z3="8.34376641">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25494361" y3="0.59938033" z3="6.90619284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.84044482" y3="1.70799495" z3="8.24408977">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.13369291" y3="1.12582741" z3="6.99622295">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8224346" y3="0.23970768" z3="6.42349072">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21995351" y3="1.95990164" z3="6.28065124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03909929" y3="1.45991668" z3="8.00116204">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.83358924" y3="0.59896159" z3="8.65860167">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38606189" y3="2.28637378" z3="8.65993876">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73912215" y3="1.9498435" z3="7.37075785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71629121" y3="2.57544094" z3="6.31226971">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.92737491" y3="2.09793044" z3="8.12783606">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7048,.7984,3.9184;-.942,1.1324,2.89;.3762,.9625,4.086;-1.2583,1.4528,4.6145;-1.0755,-.6712,4.1165;-.8256,-.9731,5.1493;-.4536,-1.2977,3.446;-2.5522,-.9817,3.8509;-2.711,-2.0724,3.9472;-2.7802,-.7242,2.7962;-3.5591,-.274,4.7704;-4.5738,-.5039,4.4011;-3.4317,.823,4.7386;-3.4962,-.7698,6.2205;-2.3413,-.6253,8.4603;-3.2247,-1.2056,8.7861;-2.2042,.1993,9.1945;-1.1002,-1.5336,8.5365;-.8657,-1.7749,9.5954;-.2329,-.9639,8.1487;-1.2584,-2.8381,7.755;-1.5947,-2.6026,6.7333;-2.0834,-3.4175,8.2006;.0009,-3.7076,7.6857;-.2708,-4.693,7.2609;.3769,-3.9079,8.7108;1.1277,-3.105,6.8391;1.5026,-2.16,7.2696;1.9884,-3.7959,6.7556;.7676,-2.8803,5.8154;-4.2393,-1.7207,6.5499;-2.6259,-.0767,7.092;-1.8509,.5566,6.6423;-7.4802,.8414,7.6558;-7.4045,-.0207,8.3438;-8.2549,.5994,6.9062;-7.8404,1.708,8.2441;-6.1337,1.1258,6.9962;-5.8224,.2397,6.4235;-6.22,1.9599,6.2807;-5.0391,1.4599,8.0012;-4.8336,.599,8.6586;-5.3861,2.2864,8.6599;-3.7391,1.9498,7.3708;-3.7163,2.5754,6.3123;-2.9274,2.0979,8.1278;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724023201493</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003935048442 0.000895802381 0.035286962080 0.008513670142</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.008358969 -0.002106063 0.000158271 0.000311591 0.000569560 0.000909373 0.001067070 0.001448516 0.002051582 0.002137310 0.002751991 0.003229035 0.003803112 0.004082828 0.005328233 0.005802784 0.005984322 0.006958365 0.007778181 0.008835714 0.010204783 0.010965842 0.011626931 0.014324130 0.018515048 0.020695335 0.023031356 0.024193031 0.029549698 0.033015062 0.033982686 0.035372402 0.036529663 0.041981053 0.043332142 0.044458456 0.045708129 0.049300775 0.049859623 0.049945625 0.051200601 0.051878765 0.052286156 0.052954553 0.054437399 0.055936217 0.057589263 0.058628101 0.061633718 0.062186813 0.066495600 0.069473330 0.072608774 0.076233460 0.077635065 0.078605349 0.078975065 0.082695846 0.084569611 0.092063062 0.096274073 0.098825612 0.104384917 0.105275569 0.108161383 0.111390604 0.113766408 0.114031477 0.116994475 0.119779822 0.130909063 0.135202471 0.138047913 0.144868005 0.146339771 0.153937631 0.154975966 0.166126882 0.170903322 0.173697409 0.180846492 0.191282663 0.196197150 0.203844950 0.209438705 0.215192121 0.221032787 0.239304814 0.255627807 0.266780860 0.314312049 0.323863179 0.351898737 0.362798611 0.416928570 0.451229642 0.503033915 0.542741077 0.562365344 0.600150163 0.622111262 0.634494649 0.684924531 0.739668504 0.745573176 0.747019741 0.752254343 0.759373547 0.770625580 0.771916340 0.785213592 0.786968260 0.792016960 0.797841921 0.807605728 0.811635252 0.819287434 0.825258392 0.834214022 0.853954242 0.866628698 0.870169593 0.878871758 0.892903150 0.899977573 0.905749659 0.912315741 0.921140924 0.923328474 0.979653364 1.297177097 1.492270376</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">59</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.69668596" y3="0.78790964" z3="3.9291966">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.92792922" y3="1.12034246" z3="2.89924708">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.3820572" y3="0.95171114" z3="4.10206245">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.25254923" y3="1.44339423" z3="4.62119494">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.07161328" y3="-0.68009904" z3="4.12665305">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82597272" y3="-0.9816136" z3="5.15979351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.44949641" y3="-1.30772804" z3="3.45883765">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.54942801" y3="-0.98524627" z3="3.85521015">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.7136892" y3="-2.07625085" z3="3.94919162">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.77343221" y3="-0.72480498" z3="2.800336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.55765014" y3="-0.27482795" z3="4.77212122">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.57193389" y3="-0.50384846" z3="4.40056358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.4291422" y3="0.82194786" z3="4.74076892">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49804225" y3="-0.77033426" z3="6.22235346">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.3471843" y3="-0.62639164" z3="8.46310842">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22908254" y3="-1.21033449" z3="8.78644438">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.21306349" y3="0.19586787" z3="9.20042679">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10261671" y3="-1.53101112" z3="8.5369721">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.86642347" y3="-1.77187177" z3="9.59516675">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23771912" y3="-0.95904971" z3="8.14910421">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.25819622" y3="-2.83744818" z3="7.75796975">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.6207436" y3="-2.61022062" z3="6.7360545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.07118441" y3="-3.42806686" z3="8.22651447">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.00904375" y3="-3.69584753" z3="7.67410494">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.25873114" y3="-4.68505445" z3="7.25794618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.39469505" y3="-3.8900733" z3="8.69373779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.12095027" y3="-3.09351164" z3="6.81758335">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.48822045" y3="-2.13905713" z3="7.23428999">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="1.98386253" y3="-3.77883425" z3="6.73755008">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.76003149" y3="-2.88212492" z3="5.79742085">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23740402" y3="-1.72401191" z3="6.54948149">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63218078" y3="-0.07303976" z3="7.09621163">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85254758" y3="0.54879521" z3="6.64637565">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4833994" y3="0.84645567" z3="7.6529988">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.41368712" y3="-0.01419651" z3="8.34148578">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25771896" y3="0.60854503" z3="6.90046236">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.83965545" y3="1.71482378" z3="8.2382155">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.13460288" y3="1.12821414" z3="6.99520007">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82250209" y3="0.24285508" z3="6.41630413">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21982168" y3="1.96877308" z3="6.28268079">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03953516" y3="1.45866186" z3="8.00176627">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.83696324" y3="0.5938981" z3="8.65890099">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38648269" y3="2.28663876" z3="8.66264632">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73581671" y3="1.94339465" z3="7.370313">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71157694" y3="2.56879933" z3="6.31168984">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.92642512" y3="2.09432758" z3="8.13123084">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.6967,.7879,3.9292;-.9279,1.1203,2.8992;.3821,.9517,4.1021;-1.2525,1.4434,4.6212;-1.0716,-.6801,4.1267;-.826,-.9816,5.1598;-.4495,-1.3077,3.4588;-2.5494,-.9852,3.8552;-2.7137,-2.0763,3.9492;-2.7734,-.7248,2.8003;-3.5577,-.2748,4.7721;-4.5719,-.5038,4.4006;-3.4291,.8219,4.7408;-3.498,-.7703,6.2224;-2.3472,-.6264,8.4631;-3.2291,-1.2103,8.7864;-2.2131,.1959,9.2004;-1.1026,-1.531,8.537;-.8664,-1.7719,9.5952;-.2377,-.959,8.1491;-1.2582,-2.8374,7.758;-1.6207,-2.6102,6.7361;-2.0712,-3.4281,8.2265;.009,-3.6958,7.6741;-.2587,-4.6851,7.2579;.3947,-3.8901,8.6937;1.121,-3.0935,6.8176;1.4882,-2.1391,7.2343;1.9839,-3.7788,6.7376;.76,-2.8821,5.7974;-4.2374,-1.724,6.5495;-2.6322,-.073,7.0962;-1.8525,.5488,6.6464;-7.4834,.8465,7.653;-7.4137,-.0142,8.3415;-8.2577,.6085,6.9005;-7.8397,1.7148,8.2382;-6.1346,1.1282,6.9952;-5.8225,.2429,6.4163;-6.2198,1.9688,6.2827;-5.0395,1.4587,8.0018;-4.837,.5939,8.6589;-5.3865,2.2866,8.6626;-3.7358,1.9434,7.3703;-3.7116,2.5688,6.3117;-2.9264,2.0943,8.1312;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724014176883</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003979847533 0.001022019898 0.034956225670 0.008513699893</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.008774900 -0.002493884 0.000139450 0.000312690 0.000602826 0.000909953 0.001073475 0.001453818 0.002074640 0.002161375 0.002751847 0.003272993 0.003804262 0.004075544 0.005324571 0.005812851 0.006019940 0.007035235 0.007783837 0.009029524 0.010205167 0.010975159 0.011737502 0.014721821 0.018515515 0.021066532 0.023192794 0.024560951 0.029549298 0.033218615 0.034034989 0.035412323 0.036937134 0.042243300 0.043344579 0.044456805 0.045761855 0.049310503 0.049870046 0.049946442 0.051280800 0.051903128 0.052368226 0.052964214 0.054435491 0.056028351 0.057659770 0.058653131 0.061647160 0.062274408 0.066493132 0.069484696 0.072632550 0.076292572 0.077750169 0.078604830 0.078987978 0.082863684 0.084568132 0.092062109 0.096274256 0.098853329 0.104388725 0.105292823 0.108351784 0.111395571 0.113791909 0.114032783 0.117005405 0.119830288 0.130919045 0.135238162 0.138303177 0.144875238 0.146436583 0.153993565 0.155014288 0.166151820 0.170940169 0.173729185 0.180987400 0.191303405 0.196751172 0.203845520 0.209433085 0.215187171 0.221172900 0.239350535 0.255630093 0.266918508 0.314613507 0.323876464 0.351973674 0.362815023 0.418260050 0.451544392 0.503229998 0.543024695 0.562414452 0.601270780 0.622138791 0.635784332 0.685392172 0.739923754 0.745585907 0.747021410 0.752446563 0.759375423 0.770638842 0.772058852 0.785216541 0.787250665 0.792020653 0.797856593 0.808050206 0.811852594 0.819867793 0.825259704 0.834380185 0.854344458 0.866650410 0.871255545 0.878956653 0.892977941 0.900020799 0.905875222 0.912398848 0.921196292 0.923337288 0.979887433 1.297372916 1.492292141</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">60</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.68852602" y3="0.77723969" z3="3.93423087">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.91761929" y3="1.11284388" z3="2.90555843">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.39245972" y3="0.93316472" z3="4.10865362">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.24034152" y3="1.43532795" z3="4.62708256">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.07213139" y3="-0.68899332" z3="4.12766678">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.8281309" y3="-0.99381344" z3="5.15973206">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.45341125" y3="-1.31884312" z3="3.45903703">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55070634" y3="-0.98632794" z3="3.85501779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.71907151" y3="-2.07588403" z3="3.94765615">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.772556" y3="-0.72373221" z3="2.80039119">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.55449521" y3="-0.2706788" z3="4.77283317">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.57129171" y3="-0.49094132" z3="4.40060447">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.41776312" y3="0.82607046" z3="4.74355304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49857913" y3="-0.77038856" z3="6.22185969">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.35180917" y3="-0.63355178" z3="8.46587825">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.23371469" y3="-1.22047852" z3="8.7837179">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.22319789" y3="0.1877245" z3="9.2053862">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10555989" y3="-1.53454139" z3="8.5425546">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.86698172" y3="-1.7715655" z3="9.60178693">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.24194773" y3="-0.96071462" z3="8.15122895">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.25697664" y3="-2.84339565" z3="7.76539469">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.6172355" y3="-2.61699715" z3="6.74920959">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.06309454" y3="-3.43604402" z3="8.22848533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.01618739" y3="-3.69069535" z3="7.67598049">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.24616264" y3="-4.68645476" z3="7.27003492">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.42096689" y3="-3.87054004" z3="8.694775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.11287824" y3="-3.08016178" z3="6.79933209">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.46750271" y3="-2.11380853" z3="7.19933376">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="1.98693842" y3="-3.75269321" z3="6.7252303">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.73475891" y3="-2.89228355" z3="5.77545598">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24228475" y3="-1.72269098" z3="6.54493193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63181884" y3="-0.07945355" z3="7.09885603">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85288139" y3="0.55003193" z3="6.65262357">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.48457794" y3="0.85185445" z3="7.64769442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.41216948" y3="-0.01231316" z3="8.33622889">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25771882" y3="0.61005174" z3="6.89552887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.84578622" y3="1.72020363" z3="8.23505568">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.13482949" y3="1.13250373" z3="6.99227838">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8278429" y3="0.24574958" z3="6.42083377">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21509448" y3="1.96764598" z3="6.2777042">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.0421655" y3="1.45981918" z3="8.00289534">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.84192642" y3="0.59509761" z3="8.65852156">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38839513" y3="2.28601901" z3="8.66432043">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73775856" y3="1.94790388" z3="7.37643531">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71017073" y3="2.57566568" z3="6.31895479">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.92893659" y3="2.09352494" z3="8.13736324">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.6885,.7772,3.9342;-.9176,1.1128,2.9056;.3925,.9332,4.1087;-1.2403,1.4353,4.6271;-1.0721,-.689,4.1277;-.8281,-.9938,5.1597;-.4534,-1.3188,3.459;-2.5507,-.9863,3.855;-2.7191,-2.0759,3.9477;-2.7726,-.7237,2.8004;-3.5545,-.2707,4.7728;-4.5713,-.4909,4.4006;-3.4178,.8261,4.7436;-3.4986,-.7704,6.2219;-2.3518,-.6336,8.4659;-3.2337,-1.2205,8.7837;-2.2232,.1877,9.2054;-1.1056,-1.5345,8.5426;-.867,-1.7716,9.6018;-.2419,-.9607,8.1512;-1.257,-2.8434,7.7654;-1.6172,-2.617,6.7492;-2.0631,-3.436,8.2285;.0162,-3.6907,7.676;-.2462,-4.6865,7.27;.421,-3.8705,8.6948;1.1129,-3.0802,6.7993;1.4675,-2.1138,7.1993;1.9869,-3.7527,6.7252;.7348,-2.8923,5.7755;-4.2423,-1.7227,6.5449;-2.6318,-.0795,7.0989;-1.8529,.55,6.6526;-7.4846,.8519,7.6477;-7.4122,-.0123,8.3362;-8.2577,.6101,6.8955;-7.8458,1.7202,8.2351;-6.1348,1.1325,6.9923;-5.8278,.2457,6.4208;-6.2151,1.9676,6.2777;-5.0422,1.4598,8.0029;-4.8419,.5951,8.6585;-5.3884,2.286,8.6643;-3.7378,1.9479,7.3764;-3.7102,2.5757,6.319;-2.9289,2.0935,8.1374;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724006655283</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003326453030 0.000970925158 0.027568335166 0.008510630515</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.008957169 -0.002014948 0.000131531 0.000320613 0.000602748 0.000911351 0.001102537 0.001459361 0.002153949 0.002173271 0.002753839 0.003386973 0.003809191 0.004101362 0.005327884 0.005830030 0.006033403 0.007032018 0.007796746 0.009015618 0.010206862 0.010981952 0.011814408 0.014706094 0.018516990 0.021074529 0.023207912 0.024745425 0.029556265 0.033359830 0.034116891 0.035472901 0.037279618 0.042704716 0.043354486 0.044483189 0.046280151 0.049317095 0.049873914 0.049979956 0.051430955 0.051952873 0.052473679 0.052960573 0.054447454 0.056060333 0.057656823 0.058677719 0.061649850 0.062312776 0.066533956 0.069500185 0.072669268 0.076390810 0.077770764 0.078624071 0.079009463 0.082868144 0.084580968 0.092065422 0.096296153 0.098895584 0.104389519 0.105326370 0.108456711 0.111395153 0.113806767 0.114054684 0.117031392 0.119896964 0.130938977 0.135260132 0.138388708 0.144877508 0.146644419 0.154010210 0.155065777 0.166149438 0.170936232 0.173806612 0.181016586 0.191302839 0.197289460 0.203848233 0.209436189 0.215187058 0.221383714 0.239351720 0.255664945 0.266962339 0.314859654 0.323883149 0.352165953 0.362866304 0.418814740 0.451682350 0.503421104 0.543865329 0.562420583 0.602145846 0.622333615 0.636862177 0.685879691 0.740253430 0.745629172 0.747025756 0.752606114 0.759379233 0.770743546 0.772058318 0.785221355 0.787619139 0.792026790 0.797858362 0.808141560 0.812388855 0.820218668 0.825259610 0.834826487 0.855023241 0.866652785 0.871671786 0.879173297 0.893196588 0.900019551 0.905919759 0.912996602 0.921245541 0.923365373 0.979955696 1.297537233 1.492304001</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">61</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.68085137" y3="0.76814218" z3="3.93799428">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.90108812" y3="1.10708415" z3="2.90683284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.39982486" y3="0.91798202" z3="4.11824391">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.23343802" y3="1.4285516" z3="4.62856198">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.07413913" y3="-0.69638512" z3="4.1304946">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.83836744" y3="-1.00339479" z3="5.16541409">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.45550164" y3="-1.33120188" z3="3.46460887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55393829" y3="-0.98460604" z3="3.85334379">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.72863867" y3="-2.07406782" z3="3.94203481">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.77361066" y3="-0.71710679" z3="2.79925278">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.55497456" y3="-0.27024348" z3="4.7732094">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.56993101" y3="-0.48956202" z3="4.40064808">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.41822492" y3="0.82472178" z3="4.74620738">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.5000698" y3="-0.77345385" z3="6.22127658">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.35849851" y3="-0.64099495" z3="8.46832068">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.23951122" y3="-1.23247461" z3="8.7804513">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.23705131" y3="0.1789526" z3="9.21065155">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10816481" y3="-1.53631701" z3="8.54815498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.87198341" y3="-1.77371298" z3="9.60702946">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.24658539" y3="-0.95894738" z3="8.16109208">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.25265584" y3="-2.84525279" z3="7.77119689">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.6294794" y3="-2.62437628" z3="6.75525828">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.04942348" y3="-3.44798529" z3="8.24863659">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.02725972" y3="-3.68137322" z3="7.67383922">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.22954072" y3="-4.68295495" z3="7.27755382">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.43677324" y3="-3.85121666" z3="8.68809246">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.10769275" y3="-3.066065" z3="6.78248208">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.45341401" y3="-2.09506099" z3="7.17414505">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="1.99342939" y3="-3.72512488" z3="6.69791213">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.71930392" y3="-2.8856441" z3="5.76489722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24446747" y3="-1.72664145" z3="6.54048393">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63438623" y3="-0.08490945" z3="7.10112083">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8536104" y3="0.54223927" z3="6.65804726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.48648072" y3="0.8588019" z3="7.64330431">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.42476797" y3="0.00529907" z3="8.33932916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25664314" y3="0.61787231" z3="6.88753413">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.84276364" y3="1.73308422" z3="8.21824713">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.13250251" y3="1.13078596" z3="6.99351644">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82078534" y3="0.24205048" z3="6.41898863">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20849677" y3="1.96867646" z3="6.2777344">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.04162852" y3="1.45900287" z3="8.00497639">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.84241823" y3="0.59456683" z3="8.66164825">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38916082" y3="2.28620443" z3="8.66437556">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73595688" y3="1.9453223" z3="7.38117584">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70523555" y3="2.57434427" z3="6.32561618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.9266948" y3="2.08584531" z3="8.14395262">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.6809,.7681,3.938;-.9011,1.1071,2.9068;.3998,.918,4.1182;-1.2334,1.4286,4.6286;-1.0741,-.6964,4.1305;-.8384,-1.0034,5.1654;-.4555,-1.3312,3.4646;-2.5539,-.9846,3.8533;-2.7286,-2.0741,3.942;-2.7736,-.7171,2.7993;-3.555,-.2702,4.7732;-4.5699,-.4896,4.4006;-3.4182,.8247,4.7462;-3.5001,-.7735,6.2213;-2.3585,-.641,8.4683;-3.2395,-1.2325,8.7805;-2.2371,.179,9.2107;-1.1082,-1.5363,8.5482;-.872,-1.7737,9.607;-.2466,-.9589,8.1611;-1.2527,-2.8453,7.7712;-1.6295,-2.6244,6.7553;-2.0494,-3.448,8.2486;.0273,-3.6814,7.6738;-.2295,-4.683,7.2776;.4368,-3.8512,8.6881;1.1077,-3.0661,6.7825;1.4534,-2.0951,7.1741;1.9934,-3.7251,6.6979;.7193,-2.8856,5.7649;-4.2445,-1.7266,6.5405;-2.6344,-.0849,7.1011;-1.8536,.5422,6.658;-7.4865,.8588,7.6433;-7.4248,.0053,8.3393;-8.2566,.6179,6.8875;-7.8428,1.7331,8.2182;-6.1325,1.1308,6.9935;-5.8208,.2421,6.419;-6.2085,1.9687,6.2777;-5.0416,1.459,8.005;-4.8424,.5946,8.6616;-5.3892,2.2862,8.6644;-3.736,1.9453,7.3812;-3.7052,2.5743,6.3256;-2.9267,2.0858,8.144;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724003869953</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003678697825 0.000868801714 0.034534957711 0.008511901384</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.008956158 -0.002153094 0.000128558 0.000318842 0.000604363 0.000910971 0.001102311 0.001467124 0.002146498 0.002404926 0.002762583 0.003566762 0.003848570 0.004168696 0.005331448 0.005832810 0.006043807 0.007105322 0.007807532 0.009072190 0.010211375 0.010984355 0.011925590 0.014735383 0.018528907 0.021085250 0.023208090 0.024797345 0.029566354 0.033450688 0.034225270 0.035478395 0.037567000 0.042869569 0.043352554 0.044503993 0.047145658 0.049346060 0.049874775 0.050060283 0.051621479 0.052052055 0.052568415 0.052973965 0.054574444 0.056062431 0.057693279 0.058701027 0.061712823 0.062308593 0.066563695 0.069524270 0.072681090 0.076498006 0.077773908 0.078619734 0.079042027 0.082874513 0.084593993 0.092063788 0.096305192 0.098889039 0.104389886 0.105402920 0.108458162 0.111395336 0.113807228 0.114115220 0.117045429 0.119953850 0.130954947 0.135272804 0.138382760 0.144898568 0.146912921 0.154007846 0.155094967 0.166161513 0.170957796 0.173877828 0.181030563 0.191302250 0.197471326 0.203858033 0.209467282 0.215208503 0.221362141 0.239354453 0.255735095 0.266964731 0.314850704 0.323889141 0.352370892 0.363034221 0.418851550 0.451691812 0.503627288 0.544810805 0.562422253 0.602519612 0.622711925 0.637509153 0.686449400 0.740424546 0.745675795 0.747056070 0.752659325 0.759400679 0.770914173 0.772070682 0.785251087 0.788763328 0.792052070 0.797908247 0.808142654 0.812923546 0.820358822 0.825260500 0.835356078 0.855472672 0.866706699 0.871734318 0.879178005 0.893316833 0.900022027 0.906098719 0.913619926 0.921270072 0.923538056 0.979964037 1.297651841 1.492302534</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">62</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.68058472" y3="0.75924425" z3="3.94302405">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.90249149" y3="1.09927788" z3="2.91443468">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.3992481" y3="0.90744961" z3="4.12213593">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.23011437" y3="1.41955034" z3="4.63576583">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.07654421" y3="-0.70393105" z3="4.13084217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.83925519" y3="-1.01259903" z3="5.16305462">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.46042367" y3="-1.33590109" z3="3.4625911">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.55647787" y3="-0.98787212" z3="3.85272286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.73521422" y3="-2.07671122" z3="3.93830056">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.77433956" y3="-0.71583134" z3="2.79939711">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.55537033" y3="-0.26984898" z3="4.77426604">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.57504665" y3="-0.47852074" z3="4.40040683">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.40868033" y3="0.82642756" z3="4.75083977">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50314218" y3="-0.77856471" z3="6.22057676">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.36602039" y3="-0.65050285" z3="8.47069041">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.24703147" y3="-1.24499945" z3="8.77703371">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.25132762" y3="0.1691253" z3="9.21464309">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11333622" y3="-1.54162073" z3="8.55644333">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88015552" y3="-1.77779239" z3="9.61657524">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.2520285" y3="-0.96065637" z3="8.17225258">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.25014269" y3="-2.85043789" z3="7.77738154">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.62974182" y3="-2.62765659" z3="6.76578725">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.03935528" y3="-3.4593693" z3="8.25168068">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.03864247" y3="-3.67413855" z3="7.67013417">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.208163" y3="-4.67529862" z3="7.27416275">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.46299115" y3="-3.83983716" z3="8.68179779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.10762626" y3="-3.05131843" z3="6.77182817">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.43705249" y3="-2.06052604" z3="7.14377338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="1.99849469" y3="-3.6997879" z3="6.70506562">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.71701019" y3="-2.89974827" z3="5.74746252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24939999" y3="-1.73148757" z3="6.53631428">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63654987" y3="-0.09463585" z3="7.10253862">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85514097" y3="0.53513843" z3="6.66174377">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.48740666" y3="0.87294649" z3="7.63712416">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.43226076" y3="0.01562642" z3="8.335247">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25551598" y3="0.63308272" z3="6.87907744">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.84368157" y3="1.75105205" z3="8.21186719">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12929066" y3="1.13387627" z3="6.99103519">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82405671" y3="0.24007031" z3="6.42766881">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19698818" y3="1.96600348" z3="6.27030464">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.04085995" y3="1.45975847" z3="8.00618284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.84359469" y3="0.59464703" z3="8.66256216">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38921965" y3="2.28670865" z3="8.666112">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73345006" y3="1.94490867" z3="7.38590101">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.69901015" y3="2.57597219" z3="6.3314656">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.92362101" y3="2.07918431" z3="8.147673">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.6806,.7592,3.943;-.9025,1.0993,2.9144;.3992,.9074,4.1221;-1.2301,1.4196,4.6358;-1.0765,-.7039,4.1308;-.8393,-1.0126,5.1631;-.4604,-1.3359,3.4626;-2.5565,-.9879,3.8527;-2.7352,-2.0767,3.9383;-2.7743,-.7158,2.7994;-3.5554,-.2698,4.7743;-4.575,-.4785,4.4004;-3.4087,.8264,4.7508;-3.5031,-.7786,6.2206;-2.366,-.6505,8.4707;-3.247,-1.245,8.777;-2.2513,.1691,9.2146;-1.1133,-1.5416,8.5564;-.8802,-1.7778,9.6166;-.252,-.9607,8.1723;-1.2501,-2.8504,7.7774;-1.6297,-2.6277,6.7658;-2.0394,-3.4594,8.2517;.0386,-3.6741,7.6701;-.2082,-4.6753,7.2742;.463,-3.8398,8.6818;1.1076,-3.0513,6.7718;1.4371,-2.0605,7.1438;1.9985,-3.6998,6.7051;.717,-2.8997,5.7475;-4.2494,-1.7315,6.5363;-2.6365,-.0946,7.1025;-1.8551,.5351,6.6617;-7.4874,.8729,7.6371;-7.4323,.0156,8.3352;-8.2555,.6331,6.8791;-7.8437,1.7511,8.2119;-6.1293,1.1339,6.991;-5.8241,.2401,6.4277;-6.197,1.966,6.2703;-5.0409,1.4598,8.0062;-4.8436,.5946,8.6626;-5.3892,2.2867,8.6661;-3.7335,1.9449,7.3859;-3.699,2.576,6.3315;-2.9236,2.0792,8.1477;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723987932158</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.005008951611 0.001038548901 0.030216624210 0.008513128791</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.008969281 -0.002558855 0.000132922 0.000316536 0.000608106 0.000910792 0.001101554 0.001490425 0.002150502 0.002633807 0.002795109 0.003592122 0.003900231 0.004293331 0.005330139 0.005838380 0.006048456 0.007426939 0.007805635 0.009397964 0.010273149 0.010984188 0.012029050 0.014828062 0.018532472 0.021145005 0.023221566 0.024818619 0.029570598 0.033599879 0.034495609 0.035619250 0.038034970 0.042856558 0.043361546 0.044506766 0.047676785 0.049410370 0.049878708 0.050225045 0.051706481 0.052171880 0.052602697 0.053033240 0.054786462 0.056062923 0.057720385 0.058696587 0.061887928 0.062312226 0.066568972 0.069543639 0.072719566 0.076556078 0.077782780 0.078619109 0.079054560 0.082888931 0.084593905 0.092064341 0.096305310 0.098903956 0.104392660 0.105492658 0.108484378 0.111410856 0.113839903 0.114169375 0.117054112 0.119990709 0.130960963 0.135283629 0.138533155 0.144908944 0.147135844 0.154018199 0.155109812 0.166219105 0.170959122 0.173928952 0.181031944 0.191308027 0.197672907 0.203872960 0.209483741 0.215269211 0.221421602 0.239356023 0.255841126 0.266955830 0.314846605 0.323889309 0.352743440 0.363167063 0.418921777 0.451759979 0.504064322 0.545357395 0.562438961 0.602598933 0.623125987 0.637504495 0.686693525 0.740495212 0.745821673 0.747302531 0.752729411 0.759414526 0.771181556 0.772485265 0.785251066 0.790822469 0.792172167 0.798174539 0.808217067 0.813262522 0.820362522 0.825267405 0.835635180 0.856000346 0.867137018 0.871788802 0.879187387 0.893520052 0.900050199 0.906342222 0.914336850 0.921318027 0.923815269 0.979978553 1.297725085 1.492300718</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">63</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.68125716" y3="0.75380263" z3="3.94723952">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.90208807" y3="1.09956948" z3="2.91956221">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.40087595" y3="0.89592175" z3="4.12785708">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.22918644" y3="1.41214912" z3="4.64278076">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.08129468" y3="-0.70946554" z3="4.129368">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.84510049" y3="-1.02339888" z3="5.16095064">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.46685225" y3="-1.34237727" z3="3.45881272">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56192386" y3="-0.98888056" z3="3.85123518">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.74217342" y3="-2.07719105" z3="3.93527895">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.77963919" y3="-0.71577055" z3="2.79850865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.55800616" y3="-0.27180784" z3="4.775085">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.57472979" y3="-0.48157371" z3="4.40222911">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.41316333" y3="0.82227111" z3="4.75301006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50639852" y3="-0.78331604" z3="6.2206084">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37230707" y3="-0.66241496" z3="8.47211674">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25264215" y3="-1.26123944" z3="8.77201468">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.26498882" y3="0.15555573" z3="9.21923979">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11597864" y3="-1.54795028" z3="8.56173124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88797367" y3="-1.78654084" z3="9.62228844">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.25499037" y3="-0.96226899" z3="8.18483799">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.24202843" y3="-2.85532606" z3="7.7781441">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.62601595" y3="-2.63396004" z3="6.76715189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.02473784" y3="-3.47380767" z3="8.25428782">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.05255304" y3="-3.66670602" z3="7.66943913">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.19069457" y3="-4.6804621" z3="7.2869751">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.48363622" y3="-3.81707956" z3="8.68197907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.10986063" y3="-3.03463676" z3="6.75964981">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.42626129" y3="-2.05418493" z3="7.13852146">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.01395238" y3="-3.66957128" z3="6.68345033">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.71312833" y3="-2.88166934" z3="5.74267779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.25579819" y3="-1.73518062" z3="6.53338631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63813587" y3="-0.104452" z3="7.10409401">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85598983" y3="0.52516808" z3="6.66593533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.49019062" y3="0.88910275" z3="7.63115064">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.44472531" y3="0.04007245" z3="8.33643528">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25715138" y3="0.6504238" z3="6.87218636">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.84068609" y3="1.77403055" z3="8.19502791">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12740388" y3="1.13709372" z3="6.98910049">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8241081" y3="0.23875653" z3="6.42694939">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.18591935" y3="1.96920259" z3="6.26517103">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.04081795" y3="1.45942118" z3="8.00765897">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.84697904" y3="0.59266058" z3="8.66329765">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38815477" y3="2.28645435" z3="8.66805305">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73114789" y3="1.94372565" z3="7.39079682">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.69230702" y3="2.57574559" z3="6.33786311">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.92055049" y3="2.07056089" z3="8.15375022">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.6813,.7538,3.9472;-.9021,1.0996,2.9196;.4009,.8959,4.1279;-1.2292,1.4121,4.6428;-1.0813,-.7095,4.1294;-.8451,-1.0234,5.161;-.4669,-1.3424,3.4588;-2.5619,-.9889,3.8512;-2.7422,-2.0772,3.9353;-2.7796,-.7158,2.7985;-3.558,-.2718,4.7751;-4.5747,-.4816,4.4022;-3.4132,.8223,4.753;-3.5064,-.7833,6.2206;-2.3723,-.6624,8.4721;-3.2526,-1.2612,8.772;-2.265,.1556,9.2192;-1.116,-1.548,8.5617;-.888,-1.7865,9.6223;-.255,-.9623,8.1848;-1.242,-2.8553,7.7781;-1.626,-2.634,6.7672;-2.0247,-3.4738,8.2543;.0526,-3.6667,7.6694;-.1907,-4.6805,7.287;.4836,-3.8171,8.682;1.1099,-3.0346,6.7596;1.4263,-2.0542,7.1385;2.014,-3.6696,6.6835;.7131,-2.8817,5.7427;-4.2558,-1.7352,6.5334;-2.6381,-.1045,7.1041;-1.856,.5252,6.6659;-7.4902,.8891,7.6312;-7.4447,.0401,8.3364;-8.2572,.6504,6.8722;-7.8407,1.774,8.195;-6.1274,1.1371,6.9891;-5.8241,.2388,6.4269;-6.1859,1.9692,6.2652;-5.0408,1.4594,8.0077;-4.847,.5927,8.6633;-5.3882,2.2865,8.6681;-3.7311,1.9437,7.3908;-3.6923,2.5757,6.3379;-2.9206,2.0706,8.1538;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723963837275</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.005813740000 0.001279503417 0.036016044924 0.008511948848</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.009039528 -0.004414542 0.000123324 0.000317641 0.000606190 0.000956453 0.001109478 0.001492935 0.002167462 0.002683296 0.002856331 0.003619374 0.003919404 0.004413544 0.005330491 0.005841648 0.006093944 0.007766971 0.007877709 0.009621122 0.010418707 0.010986806 0.012033062 0.014810348 0.018533340 0.021146469 0.023223359 0.024843365 0.029586076 0.033815795 0.034829860 0.036955791 0.040429493 0.042922645 0.043375506 0.044508859 0.047720272 0.049434434 0.049888086 0.050331310 0.051717451 0.052205418 0.052600014 0.053070150 0.055019494 0.056063908 0.057733288 0.058731282 0.062008575 0.062321512 0.066569427 0.069544233 0.072750996 0.076553661 0.077782457 0.078619419 0.079057267 0.082954221 0.084595235 0.092064116 0.096325239 0.098961177 0.104392245 0.105562235 0.108673592 0.111443153 0.113950001 0.114220559 0.117054571 0.120015007 0.130960953 0.135285271 0.138932477 0.144909931 0.147277853 0.154026337 0.155114244 0.166256962 0.171061783 0.173967630 0.181034913 0.191322515 0.197677276 0.203873286 0.209486030 0.215259617 0.221455458 0.239374668 0.255837578 0.266955752 0.314861417 0.323890354 0.352790189 0.363273494 0.418959144 0.451937197 0.504771365 0.545781337 0.562924522 0.604460608 0.623555167 0.637752952 0.686704155 0.740510671 0.745895134 0.747941384 0.753437326 0.759418519 0.771246362 0.772772364 0.785254044 0.791938817 0.793708650 0.798587828 0.808245284 0.813430359 0.820491014 0.825311720 0.835709249 0.856518105 0.867962703 0.872558020 0.879189344 0.893651536 0.900136354 0.906733466 0.914621853 0.921427505 0.924050685 0.979977970 1.297730136 1.492299775</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">64</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.68128215" y3="0.74834697" z3="3.94819217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.89919679" y3="1.09938808" z3="2.92068565">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.4001272" y3="0.88806872" z3="4.12971663">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.22821024" y3="1.4067708" z3="4.64533185">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.08638133" y3="-0.71478001" z3="4.1270328">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.85345633" y3="-1.0321494" z3="5.15908992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47264855" y3="-1.34782716" z3="3.45550766">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56840931" y3="-0.98926639" z3="3.84833529">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.75192776" y3="-2.07780862" z3="3.92878999">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.78702982" y3="-0.7112831" z3="2.79668516">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.56169832" y3="-0.2739308" z3="4.77609122">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.58053658" y3="-0.47982136" z3="4.40375239">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.41399713" y3="0.82061949" z3="4.75565929">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50984255" y3="-0.78934826" z3="6.22065595">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37560199" y3="-0.67619735" z3="8.47274347">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25509203" y3="-1.27920817" z3="8.76662284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.27550264" y3="0.14077264" z3="9.22213711">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11585575" y3="-1.55602816" z3="8.56767251">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89151162" y3="-1.79590914" z3="9.6290226">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.25548171" y3="-0.96541537" z3="8.1957982">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.2329409" y3="-2.86279409" z3="7.7814788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.62151101" y3="-2.64321325" z3="6.76996213">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.01023942" y3="-3.48904961" z3="8.25860209">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.06834186" y3="-3.66437326" z3="7.67162705">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.15905214" y3="-4.66806102" z3="7.27743052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.4898057" y3="-3.82149091" z3="8.67696312">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.11714446" y3="-3.02370721" z3="6.76473516">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.4254837" y3="-2.01816889" z3="7.12354825">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.02823893" y3="-3.64598038" z3="6.68904546">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.70860042" y3="-2.88903124" z3="5.7415159">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.26477247" y3="-1.73816331" z3="6.53162877">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63648034" y3="-0.11897329" z3="7.10384574">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85685624" y3="0.51560149" z3="6.66949319">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.49367216" y3="0.90742071" z3="7.62510993">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.45713086" y3="0.06027092" z3="8.33554027">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25851165" y3="0.66816734" z3="6.86351036">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.84241587" y3="1.79814614" z3="8.18471201">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12663531" y3="1.14082327" z3="6.98774097">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82848111" y3="0.23611203" z3="6.43684531">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.17608681" y3="1.96527276" z3="6.25691962">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.04228668" y3="1.46294965" z3="8.00833078">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.84796383" y3="0.59641219" z3="8.66321518">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.39088395" y3="2.28889431" z3="8.66865275">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73300155" y3="1.95050854" z3="7.39607268">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.68973269" y3="2.58225082" z3="6.34465196">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.91939347" y3="2.06563911" z3="8.15718753">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.6813,.7483,3.9482;-.8992,1.0994,2.9207;.4001,.8881,4.1297;-1.2282,1.4068,4.6453;-1.0864,-.7148,4.127;-.8535,-1.0321,5.1591;-.4726,-1.3478,3.4555;-2.5684,-.9893,3.8483;-2.7519,-2.0778,3.9288;-2.787,-.7113,2.7967;-3.5617,-.2739,4.7761;-4.5805,-.4798,4.4038;-3.414,.8206,4.7557;-3.5098,-.7893,6.2207;-2.3756,-.6762,8.4727;-3.2551,-1.2792,8.7666;-2.2755,.1408,9.2221;-1.1159,-1.556,8.5677;-.8915,-1.7959,9.629;-.2555,-.9654,8.1958;-1.2329,-2.8628,7.7815;-1.6215,-2.6432,6.77;-2.0102,-3.489,8.2586;.0683,-3.6644,7.6716;-.1591,-4.6681,7.2774;.4898,-3.8215,8.677;1.1171,-3.0237,6.7647;1.4255,-2.0182,7.1235;2.0282,-3.646,6.689;.7086,-2.889,5.7415;-4.2648,-1.7382,6.5316;-2.6365,-.119,7.1038;-1.8569,.5156,6.6695;-7.4937,.9074,7.6251;-7.4571,.0603,8.3355;-8.2585,.6682,6.8635;-7.8424,1.7981,8.1847;-6.1266,1.1408,6.9877;-5.8285,.2361,6.4368;-6.1761,1.9653,6.2569;-5.0423,1.4629,8.0083;-4.848,.5964,8.6632;-5.3909,2.2889,8.6687;-3.733,1.9505,7.3961;-3.6897,2.5823,6.3447;-2.9194,2.0656,8.1572;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723901344654</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.009102478602 0.001773797739 0.028855295191 0.008512626090</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.011174397 -0.005722069 0.000141409 0.000320095 0.000652631 0.000949088 0.001107915 0.001496461 0.002174170 0.002685583 0.002851606 0.003675203 0.003928137 0.004438364 0.005330197 0.005848388 0.006119124 0.007773276 0.008018290 0.009654419 0.010447743 0.010987326 0.012090741 0.014889852 0.018532949 0.021177947 0.023226800 0.024864744 0.029630831 0.033917144 0.034928917 0.037674231 0.042874372 0.043358930 0.044479978 0.047080940 0.049402424 0.049806359 0.050312411 0.050701635 0.051740186 0.052200624 0.052777328 0.053067039 0.055008949 0.056063853 0.057730036 0.058893155 0.061993552 0.062321559 0.066571587 0.069549007 0.072758370 0.076565540 0.077781934 0.078619878 0.079068762 0.083096926 0.084596393 0.092071029 0.096343688 0.098996236 0.104409664 0.105563106 0.109002135 0.111461066 0.113978723 0.114237321 0.117056229 0.120054897 0.130962748 0.135566888 0.139414574 0.144909494 0.147280025 0.154023785 0.155118230 0.166258373 0.172053747 0.174330727 0.181049750 0.191350061 0.197677236 0.203879738 0.209570431 0.215251502 0.221521441 0.239377064 0.255847186 0.266956385 0.314880485 0.323896950 0.352832775 0.363304082 0.419110187 0.452402490 0.505571830 0.546263751 0.564669433 0.610586361 0.624577683 0.639399180 0.686849613 0.740569813 0.745894286 0.748782716 0.756900953 0.759418572 0.771251806 0.772829950 0.785255594 0.792005515 0.795305795 0.798775687 0.808511988 0.813534528 0.820599689 0.825452731 0.835786486 0.857316488 0.868457669 0.874093553 0.879194604 0.893759319 0.900238184 0.907218030 0.914615957 0.921450106 0.924093171 0.979981426 1.297737956 1.492302871</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">65</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.69075929" y3="0.74964507" z3="3.9566221">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.90834787" y3="1.09983678" z3="2.92958844">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.38927436" y3="0.89382208" z3="4.14026566">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.24170412" y3="1.4048328" z3="4.65364653">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.08912297" y3="-0.71481241" z3="4.13184129">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.85374545" y3="-1.03295876" z3="5.16224283">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47272786" y3="-1.34263404" z3="3.45896714">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56904202" y3="-0.99520416" z3="3.85101241">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.74837892" y3="-2.08415084" z3="3.92812129">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.78695338" y3="-0.71510158" z3="2.7997298">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.56699964" y3="-0.28361322" z3="4.77742642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.58623564" y3="-0.49067788" z3="4.40313389">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.42013503" y3="0.81221757" z3="4.75907355">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.5159002" y3="-0.79804196" z3="6.22181378">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.38163806" y3="-0.68094219" z3="8.47418564">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25872738" y3="-1.28690091" z3="8.76832696">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.28324644" y3="0.13552025" z3="9.22407321">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11931512" y3="-1.55702509" z3="8.56636564">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89247341" y3="-1.79658684" z3="9.62740797">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.26136638" y3="-0.96279433" z3="8.1937818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23251869" y3="-2.86292867" z3="7.77786554">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.61130911" y3="-2.63949614" z3="6.76877177">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.00961971" y3="-3.48899173" z3="8.24446202">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.07259783" y3="-3.65793973" z3="7.66483211">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.15363767" y3="-4.66994486" z3="7.27616037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.5141306" y3="-3.80625458" z3="8.67793244">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.12075076" y3="-3.01084082" z3="6.75606">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.4186824" y3="-2.01627692" z3="7.12495876">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.03182419" y3="-3.63183976" z3="6.69136515">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.72711659" y3="-2.87603967" z3="5.73620026">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.26792074" y3="-1.74721026" z3="6.53478524">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.64605811" y3="-0.12118632" z3="7.10657304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85948617" y3="0.50498107" z3="6.66836112">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.49629039" y3="0.92592192" z3="7.62161324">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.47519076" y3="0.08407117" z3="8.33557378">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.26252726" y3="0.69702263" z3="6.85824888">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.8305526" y3="1.82352725" z3="8.17299703">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12399825" y3="1.1414036" z3="6.98705613">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83147388" y3="0.23244844" z3="6.43320296">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.16388116" y3="1.96965399" z3="6.25548453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.0371137" y3="1.45528546" z3="8.00768401">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.8531317" y3="0.58941749" z3="8.66649371">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37894491" y3="2.28724926" z3="8.66324889">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72076097" y3="1.92524936" z3="7.39531066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.67414781" y3="2.56164762" z3="6.34402036">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.91296276" y3="2.04709604" z3="8.16099986">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.6908,.7496,3.9566;-.9083,1.0998,2.9296;.3893,.8938,4.1403;-1.2417,1.4048,4.6536;-1.0891,-.7148,4.1318;-.8537,-1.033,5.1622;-.4727,-1.3426,3.459;-2.569,-.9952,3.851;-2.7484,-2.0842,3.9281;-2.787,-.7151,2.7997;-3.567,-.2836,4.7774;-4.5862,-.4907,4.4031;-3.4201,.8122,4.7591;-3.5159,-.798,6.2218;-2.3816,-.6809,8.4742;-3.2587,-1.2869,8.7683;-2.2832,.1355,9.2241;-1.1193,-1.557,8.5664;-.8925,-1.7966,9.6274;-.2614,-.9628,8.1938;-1.2325,-2.8629,7.7779;-1.6113,-2.6395,6.7688;-2.0096,-3.489,8.2445;.0726,-3.6579,7.6648;-.1536,-4.6699,7.2762;.5141,-3.8063,8.6779;1.1208,-3.0108,6.7561;1.4187,-2.0163,7.125;2.0318,-3.6318,6.6914;.7271,-2.876,5.7362;-4.2679,-1.7472,6.5348;-2.6461,-.1212,7.1066;-1.8595,.505,6.6684;-7.4963,.9259,7.6216;-7.4752,.0841,8.3356;-8.2625,.697,6.8582;-7.8306,1.8235,8.173;-6.124,1.1414,6.9871;-5.8315,.2324,6.4332;-6.1639,1.9697,6.2555;-5.0371,1.4553,8.0077;-4.8531,.5894,8.6665;-5.3789,2.2872,8.6632;-3.7208,1.9252,7.3953;-3.6741,2.5616,6.344;-2.913,2.0471,8.161;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723934425186</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.006899575971 0.001476971263 0.028292483558 0.008512048077</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015991972 -0.002042608 0.000128583 0.000319945 0.000641029 0.000958987 0.001119217 0.001498276 0.002166430 0.002685639 0.002854514 0.003673006 0.003932875 0.004438847 0.005338883 0.005857876 0.006133093 0.007774836 0.008011074 0.009654789 0.010447631 0.010987654 0.012173582 0.014871252 0.018549179 0.021169364 0.023224237 0.024870441 0.029818156 0.033954535 0.035042863 0.038174185 0.043089500 0.043374827 0.044485957 0.046987810 0.049390535 0.049899012 0.050296012 0.051691571 0.052196193 0.052488320 0.053068191 0.054991947 0.055973161 0.057054964 0.057883897 0.059209436 0.062124037 0.062393870 0.066574817 0.069550810 0.072773646 0.076594870 0.077795690 0.078650606 0.079127700 0.083270446 0.084625548 0.092072867 0.096347739 0.098994814 0.104474943 0.105563408 0.109188304 0.111467388 0.114039686 0.114250002 0.117065528 0.120104682 0.130975534 0.136249375 0.139630787 0.144957326 0.147322855 0.154025027 0.155128161 0.166346829 0.172620872 0.175113927 0.181067328 0.191347057 0.197684321 0.203943041 0.209791929 0.215276713 0.221596785 0.239385545 0.255853293 0.266971512 0.314933852 0.323898454 0.353003186 0.363307760 0.419147262 0.452388601 0.505555883 0.547253817 0.565361844 0.612910554 0.628469313 0.642018224 0.687459383 0.740642367 0.745991601 0.748806452 0.759416628 0.760787869 0.771259037 0.772981354 0.785291261 0.792010879 0.795339296 0.799007823 0.809592699 0.813759571 0.820618334 0.825509433 0.835997139 0.857566697 0.868450990 0.875197472 0.879207270 0.893757805 0.900242604 0.907255831 0.914935610 0.921501240 0.924155916 0.980110112 1.298047120 1.492327718</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">66</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.69866036" y3="0.75030844" z3="3.95469642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.92401502" y3="1.10286195" z3="2.93144475">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.3823861" y3="0.89453848" z3="4.13241259">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.24556209" y3="1.40201231" z3="4.65732259">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.09451582" y3="-0.7150622" z3="4.12568223">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.85496737" y3="-1.0363205" z3="5.15366932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48039572" y3="-1.34041184" z3="3.44827649">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5753923" y3="-0.99501595" z3="3.84895202">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.75520582" y3="-2.084563" z3="3.92587826">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.79530692" y3="-0.71452285" z3="2.79852968">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.5710769" y3="-0.28345906" z3="4.77862295">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.58951559" y3="-0.48976654" z3="4.40545978">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.42443976" y3="0.8113651" z3="4.76253614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.51928965" y3="-0.80296123" z3="6.22164136">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.38590144" y3="-0.69508752" z3="8.47431626">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.2632365" y3="-1.3039159" z3="8.76249973">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.29318105" y3="0.11942886" z3="9.2274534">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12075807" y3="-1.56723998" z3="8.57165865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.9035905" y3="-1.81289708" z3="9.63231077">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.26212919" y3="-0.9685491" z3="8.21184336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22039076" y3="-2.86958984" z3="7.77682542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.61108606" y3="-2.64711937" z3="6.76435325">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-1.99218437" y3="-3.50922177" z3="8.25135612">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.09094881" y3="-3.65579349" z3="7.66670408">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.1308849" y3="-4.67069391" z3="7.27787059">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.51637494" y3="-3.80494412" z3="8.67724425">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.13659299" y3="-3.00252305" z3="6.76176416">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.42702263" y3="-2.00605519" z3="7.13161868">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.0546048" y3="-3.61546733" z3="6.69447058">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.73882052" y3="-2.87019873" z3="5.73958461">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.27377446" y3="-1.75193016" z3="6.53131769">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.64582201" y3="-0.13288547" z3="7.10685526">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.86044651" y3="0.49358556" z3="6.67114305">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.49828422" y3="0.94794919" z3="7.61524719">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.48370097" y3="0.107214" z3="8.33518745">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.26327167" y3="0.71568199" z3="6.85234241">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.83320107" y3="1.85181973" z3="8.16319483">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12263444" y3="1.1460173" z3="6.98373288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.84007622" y3="0.22868861" z3="6.44734867">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.15109979" y3="1.96144144" z3="6.24245864">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03812578" y3="1.45979371" z3="8.00710682">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.85472453" y3="0.59228523" z3="8.66531956">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38158047" y3="2.29154418" z3="8.6648139">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72107175" y3="1.93112905" z3="7.39670771">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.67045622" y3="2.56486061" z3="6.34595527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.91076334" y3="2.04412565" z3="8.16215844">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.6987,.7503,3.9547;-.924,1.1029,2.9314;.3824,.8945,4.1324;-1.2456,1.402,4.6573;-1.0945,-.7151,4.1257;-.855,-1.0363,5.1537;-.4804,-1.3404,3.4483;-2.5754,-.995,3.849;-2.7552,-2.0846,3.9259;-2.7953,-.7145,2.7985;-3.5711,-.2835,4.7786;-4.5895,-.4898,4.4055;-3.4244,.8114,4.7625;-3.5193,-.803,6.2216;-2.3859,-.6951,8.4743;-3.2632,-1.3039,8.7625;-2.2932,.1194,9.2275;-1.1208,-1.5672,8.5717;-.9036,-1.8129,9.6323;-.2621,-.9685,8.2118;-1.2204,-2.8696,7.7768;-1.6111,-2.6471,6.7644;-1.9922,-3.5092,8.2514;.0909,-3.6558,7.6667;-.1309,-4.6707,7.2779;.5164,-3.8049,8.6772;1.1366,-3.0025,6.7618;1.427,-2.0061,7.1316;2.0546,-3.6155,6.6945;.7388,-2.8702,5.7396;-4.2738,-1.7519,6.5313;-2.6458,-.1329,7.1069;-1.8604,.4936,6.6711;-7.4983,.9479,7.6152;-7.4837,.1072,8.3352;-8.2633,.7157,6.8523;-7.8332,1.8518,8.1632;-6.1226,1.146,6.9837;-5.8401,.2287,6.4473;-6.1511,1.9614,6.2425;-5.0381,1.4598,8.0071;-4.8547,.5923,8.6653;-5.3816,2.2915,8.6648;-3.7211,1.9311,7.3967;-3.6705,2.5649,6.346;-2.9108,2.0441,8.1622;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723962893547</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.004615980205 0.001093443855 0.030271119476 0.008514561179</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016579656 -0.002564125 0.000079885 0.000317046 0.000628620 0.000990138 0.001118161 0.001530015 0.002166282 0.002689162 0.002877796 0.003694639 0.003925144 0.004440352 0.005392135 0.005857230 0.006244054 0.007775477 0.008051762 0.009655620 0.010447326 0.010990268 0.012170786 0.014990886 0.018566008 0.021287771 0.023304332 0.025010167 0.030107964 0.033960016 0.035161854 0.038631382 0.043354669 0.043595423 0.044490691 0.047369524 0.049415196 0.049919227 0.050403543 0.051691337 0.052199628 0.052491549 0.053068855 0.054992838 0.055962256 0.057532202 0.058041319 0.059305069 0.062127685 0.062546739 0.066577945 0.069589504 0.072805443 0.076594593 0.077872299 0.078664507 0.079161077 0.083413077 0.084651598 0.092092222 0.096403160 0.098998714 0.104530414 0.105570156 0.109181462 0.111467993 0.114159337 0.114589083 0.117081579 0.120142564 0.130985078 0.136548829 0.139682637 0.144988117 0.147426642 0.154089642 0.155151941 0.166358635 0.172622551 0.175214418 0.181152852 0.191347945 0.197683431 0.203962666 0.209860698 0.215420600 0.221770704 0.239415925 0.255897922 0.266980379 0.314959205 0.323917905 0.352993594 0.363344644 0.419718336 0.452744418 0.506368319 0.547862047 0.565382309 0.612895266 0.629878596 0.642887760 0.687662225 0.740645938 0.746019643 0.748961184 0.759417982 0.761265237 0.771266073 0.773187833 0.785337645 0.792027060 0.796900511 0.800058168 0.810319432 0.814055112 0.820646217 0.825508835 0.836189327 0.857598013 0.868527510 0.875346001 0.879211605 0.893849502 0.900322857 0.907293644 0.915145948 0.921736692 0.924379178 0.980143939 1.298235676 1.492327706</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">67</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.70786856" y3="0.75424297" z3="3.95209074">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.9334337" y3="1.11194181" z3="2.92835172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.37491366" y3="0.89783266" z3="4.12890097">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.2552265" y3="1.40338177" z3="4.65735885">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10195288" y3="-0.71316713" z3="4.12054166">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.85995135" y3="-1.0378857" z3="5.14785991">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48812774" y3="-1.33626168" z3="3.43985811">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58304747" y3="-0.99591558" z3="3.84744038">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.75823356" y3="-2.08550093" z3="3.92326314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.80727371" y3="-0.71503817" z3="2.79804338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.57743852" y3="-0.29038895" z3="4.78119807">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.5950719" y3="-0.50026093" z3="4.41003306">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.43538464" y3="0.80446072" z3="4.76593948">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.52283121" y3="-0.81091375" z3="6.22364197">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.38954235" y3="-0.70728898" z3="8.47630099">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.2656314" y3="-1.31976383" z3="8.76024628">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.30198382" y3="0.10574456" z3="9.23169533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.1217018" y3="-1.57521794" z3="8.57584978">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90647362" y3="-1.8222837" z3="9.63772001">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.26346988" y3="-0.97144755" z3="8.2192633">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.21401757" y3="-2.8750703" z3="7.77425951">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.58507552" y3="-2.64633639" z3="6.76311374">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-1.98971837" y3="-3.51217333" z3="8.22775239">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.09845549" y3="-3.6587294" z3="7.6675862">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.11347899" y3="-4.66433213" z3="7.2654664">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.52363861" y3="-3.81379585" z3="8.67998342">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.14796794" y3="-2.99699416" z3="6.77341704">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.43252094" y3="-1.99402072" z3="7.14342643">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.0701291" y3="-3.6044383" z3="6.71051701">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.75882954" y3="-2.86293123" z3="5.74911624">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.27948159" y3="-1.75823674" z3="6.5333568">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.64759615" y3="-0.14372749" z3="7.10903328">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.86095357" y3="0.48209426" z3="6.67437681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.50135697" y3="0.96590342" z3="7.61175762">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.49718908" y3="0.13748512" z3="8.3419286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.26550072" y3="0.73286078" z3="6.84784538">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82746245" y3="1.87883417" z3="8.14414336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.1213597" y3="1.14689519" z3="6.98347439">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.84100613" y3="0.22343621" z3="6.4494025">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.14090023" y3="1.96109671" z3="6.23708318">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03712904" y3="1.46065237" z3="8.00731389">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.85719915" y3="0.59638145" z3="8.66891315">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37770345" y3="2.29577078" z3="8.65952665">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71765248" y3="1.92703624" z3="7.39842667">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.66347304" y3="2.56017516" z3="6.34727196">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90752529" y3="2.03635077" z3="8.16379849">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7079,.7542,3.9521;-.9334,1.1119,2.9284;.3749,.8978,4.1289;-1.2552,1.4034,4.6574;-1.102,-.7132,4.1205;-.86,-1.0379,5.1479;-.4881,-1.3363,3.4399;-2.583,-.9959,3.8474;-2.7582,-2.0855,3.9233;-2.8073,-.715,2.798;-3.5774,-.2904,4.7812;-4.5951,-.5003,4.41;-3.4354,.8045,4.7659;-3.5228,-.8109,6.2236;-2.3895,-.7073,8.4763;-3.2656,-1.3198,8.7602;-2.302,.1057,9.2317;-1.1217,-1.5752,8.5758;-.9065,-1.8223,9.6377;-.2635,-.9714,8.2193;-1.214,-2.8751,7.7743;-1.5851,-2.6463,6.7631;-1.9897,-3.5122,8.2278;.0985,-3.6587,7.6676;-.1135,-4.6643,7.2655;.5236,-3.8138,8.68;1.148,-2.997,6.7734;1.4325,-1.994,7.1434;2.0701,-3.6044,6.7105;.7588,-2.8629,5.7491;-4.2795,-1.7582,6.5334;-2.6476,-.1437,7.109;-1.861,.4821,6.6744;-7.5014,.9659,7.6118;-7.4972,.1375,8.3419;-8.2655,.7329,6.8478;-7.8275,1.8788,8.1441;-6.1214,1.1469,6.9835;-5.841,.2234,6.4494;-6.1409,1.9611,6.2371;-5.0371,1.4607,8.0073;-4.8572,.5964,8.6689;-5.3777,2.2958,8.6595;-3.7177,1.927,7.3984;-3.6635,2.5602,6.3473;-2.9075,2.0364,8.1638;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723963571260</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.004818451117 0.001048891946 0.029632397820 0.008512552880</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016635641 -0.002564895 0.000071825 0.000318190 0.000630890 0.000986951 0.001120717 0.001547287 0.002250326 0.002711441 0.002901080 0.003707049 0.003920343 0.004439880 0.005423417 0.005862890 0.006340907 0.007777336 0.008141767 0.009655368 0.010443897 0.011004715 0.012251406 0.015092396 0.018565938 0.021412802 0.023477473 0.025172134 0.030324746 0.033959822 0.035190596 0.038799583 0.043365426 0.043732100 0.044530581 0.048030658 0.049450561 0.049920829 0.050598634 0.051703732 0.052204151 0.052492041 0.053072144 0.054992026 0.055963751 0.057594911 0.058025271 0.059313382 0.062157642 0.062586036 0.066579594 0.069710196 0.072808863 0.076614101 0.077895404 0.078663689 0.079158277 0.083578421 0.084683274 0.092172299 0.096448782 0.099003119 0.104538227 0.105603846 0.109210269 0.111468299 0.114161018 0.115310388 0.117116356 0.120150124 0.130985422 0.136725041 0.139718816 0.145009549 0.147488468 0.154213054 0.155212399 0.166366443 0.172623814 0.175217014 0.181260239 0.191349632 0.197683471 0.203962340 0.209876173 0.215610821 0.222148580 0.239478859 0.256062597 0.266999889 0.314969219 0.323929744 0.353150856 0.363400535 0.420462040 0.453372965 0.507259936 0.548322749 0.565740669 0.613230403 0.630689463 0.643273536 0.687677574 0.740646223 0.746061107 0.749244225 0.759439418 0.761337842 0.771287761 0.773415567 0.785354571 0.792027784 0.797837831 0.802017674 0.811904436 0.814372855 0.820838812 0.825533379 0.836268989 0.857638639 0.868529607 0.875420662 0.879228447 0.893898034 0.900350794 0.907449221 0.915183431 0.921918107 0.924599850 0.980146343 1.298238046 1.492332693</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">68</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.72142902" y3="0.76028217" z3="3.94594685">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.95655797" y3="1.11707287" z3="2.92562008">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.3587289" y3="0.91225803" z3="4.11484494">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.26668686" y3="1.40616661" z3="4.65582377">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10742623" y3="-0.7083822" z3="4.11378098">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.86096054" y3="-1.03341561" z3="5.1398661">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49332498" y3="-1.32657685" z3="3.42989004">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58894348" y3="-0.99571379" z3="3.84445151">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.76302375" y3="-2.08688829" z3="3.91739009">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.81727951" y3="-0.71104194" z3="2.79637861">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58270864" y3="-0.29251306" z3="4.7821731">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60502132" y3="-0.49553725" z3="4.41092625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.43517762" y3="0.80417741" z3="4.77138508">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.52734558" y3="-0.81863083" z3="6.22293584">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.39172334" y3="-0.71898777" z3="8.47494757">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26656768" y3="-1.33404297" z3="8.7568381">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.30754129" y3="0.09333842" z3="9.2314931">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12147233" y3="-1.58295232" z3="8.57500052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91003634" y3="-1.8356356" z3="9.63587786">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.26399953" y3="-0.97506342" z3="8.22577478">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.20651453" y3="-2.87890856" z3="7.76756051">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.57953139" y3="-2.64785502" z3="6.75130245">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-1.98411672" y3="-3.52437026" z3="8.22226498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.10857735" y3="-3.65924824" z3="7.67107322">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.10204813" y3="-4.67205974" z3="7.26971431">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.52357595" y3="-3.81571012" z3="8.68784536">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.16574199" y3="-2.9925094" z3="6.78928973">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.44662481" y3="-1.99874318" z3="7.17305883">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.08455887" y3="-3.60257378" z3="6.73213295">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.78319453" y3="-2.85293978" z3="5.76117339">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.28582658" y3="-1.76493236" z3="6.53186243">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.64907212" y3="-0.15522351" z3="7.10800274">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.86314411" y3="0.47341457" z3="6.67398765">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.50081789" y3="0.98176769" z3="7.60813376">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.50501152" y3="0.15825561" z3="8.34658608">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.26326753" y3="0.74434672" z3="6.84347291">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82536687" y3="1.90213279" z3="8.13250519">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11800235" y3="1.14787309" z3="6.98292286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.84362477" y3="0.21803314" z3="6.46105852">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.13078618" y3="1.95341955" z3="6.22919448">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03461648" y3="1.46353858" z3="8.00696192">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.85526779" y3="0.60030728" z3="8.67133293">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37556581" y3="2.30113585" z3="8.65751288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71475668" y3="1.92587011" z3="7.398407">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.65756875" y3="2.55786091" z3="6.34685745">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90283902" y3="2.02966064" z3="8.16232854">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7214,.7603,3.9459;-.9566,1.1171,2.9256;.3587,.9123,4.1148;-1.2667,1.4062,4.6558;-1.1074,-.7084,4.1138;-.861,-1.0334,5.1399;-.4933,-1.3266,3.4299;-2.5889,-.9957,3.8445;-2.763,-2.0869,3.9174;-2.8173,-.711,2.7964;-3.5827,-.2925,4.7822;-4.605,-.4955,4.4109;-3.4352,.8042,4.7714;-3.5273,-.8186,6.2229;-2.3917,-.719,8.4749;-3.2666,-1.334,8.7568;-2.3075,.0933,9.2315;-1.1215,-1.583,8.575;-.91,-1.8356,9.6359;-.264,-.9751,8.2258;-1.2065,-2.8789,7.7676;-1.5795,-2.6479,6.7513;-1.9841,-3.5244,8.2223;.1086,-3.6592,7.6711;-.102,-4.6721,7.2697;.5236,-3.8157,8.6878;1.1657,-2.9925,6.7893;1.4466,-1.9987,7.1731;2.0846,-3.6026,6.7321;.7832,-2.8529,5.7612;-4.2858,-1.7649,6.5319;-2.6491,-.1552,7.108;-1.8631,.4734,6.674;-7.5008,.9818,7.6081;-7.505,.1583,8.3466;-8.2633,.7443,6.8435;-7.8254,1.9021,8.1325;-6.118,1.1479,6.9829;-5.8436,.218,6.4611;-6.1308,1.9534,6.2292;-5.0346,1.4635,8.007;-4.8553,.6003,8.6713;-5.3756,2.3011,8.6575;-3.7148,1.9259,7.3984;-3.6576,2.5579,6.3469;-2.9028,2.0297,8.1623;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723970171812</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003628189419 0.000956514820 0.032062582588 0.008510522559</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016618475 -0.002098265 0.000094344 0.000326106 0.000670504 0.000986226 0.001141018 0.001553809 0.002319509 0.002767412 0.002909040 0.003705778 0.003919264 0.004441425 0.005454207 0.005862518 0.006362344 0.007776828 0.008202877 0.009656149 0.010445325 0.011011533 0.012459731 0.015126616 0.018577670 0.021467302 0.023649624 0.025243570 0.030410601 0.033964212 0.035192185 0.038849408 0.043364381 0.043760771 0.044562327 0.048299882 0.049481471 0.049925578 0.050678332 0.051733329 0.052203260 0.052492363 0.053089064 0.054995399 0.055964295 0.057599380 0.058223494 0.059353427 0.062323673 0.062612105 0.066582651 0.069795540 0.072811004 0.076641062 0.077895230 0.078678808 0.079161828 0.083795767 0.084688290 0.092319577 0.096457410 0.099005399 0.104538336 0.105645440 0.109262208 0.111472280 0.114162498 0.115921523 0.117206286 0.120156747 0.130990162 0.136837400 0.139817371 0.145019433 0.147488321 0.154352023 0.155250097 0.166510711 0.172628007 0.175246371 0.181298819 0.191352833 0.197683929 0.203977817 0.209903296 0.215686824 0.222794143 0.239580324 0.256291488 0.267026299 0.314970893 0.323935659 0.353560780 0.363538812 0.421119901 0.453873927 0.507670948 0.548484354 0.566243064 0.613799905 0.630739895 0.643365941 0.687697899 0.740656233 0.746472363 0.749413154 0.759489932 0.761347290 0.771308992 0.773476520 0.785356861 0.792030100 0.798291752 0.803275199 0.813227588 0.815085999 0.821328300 0.825794620 0.836280442 0.857645023 0.868850082 0.875584851 0.879230562 0.893897659 0.900351099 0.907749225 0.915200711 0.921978544 0.924711832 0.980166499 1.298266265 1.492338716</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">69</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.73392873" y3="0.76847946" z3="3.93863271">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.9793258" y3="1.12704276" z3="2.92128948">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.35069045" y3="0.91956451" z3="4.09970138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.27545761" y3="1.40980255" z3="4.65502212">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11347676" y3="-0.70221221" z3="4.1044292">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.85787163" y3="-1.02841492" z3="5.12700106">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.50167714" y3="-1.316954" z3="3.41509048">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59420631" y3="-0.99517045" z3="3.84279091">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.76200677" y3="-2.08580092" z3="3.91894822">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.82682564" y3="-0.71498748" z3="2.79510724">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58732372" y3="-0.29529886" z3="4.78278268">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60415205" y3="-0.50740369" z3="4.41470603">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.44878492" y3="0.79907466" z3="4.7697995">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.52866546" y3="-0.82101501" z3="6.22356201">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.39242733" y3="-0.72526719" z3="8.47474253">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26829787" y3="-1.33998381" z3="8.75427336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.30942633" y3="0.08665954" z3="9.23196084">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12301285" y3="-1.59023842" z3="8.57859798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91752292" y3="-1.84687603" z3="9.63934236">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.26374094" y3="-0.98132336" z3="8.23592803">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.20391974" y3="-2.88240705" z3="7.76515914">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.56072598" y3="-2.64311758" z3="6.74893319">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-1.98823558" y3="-3.52357128" z3="8.20266353">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.10999137" y3="-3.66715883" z3="7.67316779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.09782151" y3="-4.66755393" z3="7.25470741">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.51301058" y3="-3.83699262" z3="8.69070541">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.17871298" y3="-2.99625059" z3="6.80875854">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.4643821" y3="-2.00574687" z3="7.20512141">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.09839717" y3="-3.60836683" z3="6.74816477">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.80941676" y3="-2.83623405" z3="5.78234516">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.28868158" y3="-1.76661572" z3="6.53229528">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.647291" y3="-0.16167103" z3="7.10718994">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8629815" y3="0.46771189" z3="6.67362252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.49961567" y3="0.98890821" z3="7.60733154">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.50558287" y3="0.1746769" z3="8.35457361">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.26090667" y3="0.74468718" z3="6.84454457">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82319203" y3="1.91509898" z3="8.11975088">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11538475" y3="1.14702724" z3="6.98314357">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.84149447" y3="0.21252436" z3="6.46859842">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.12474832" y3="1.94728525" z3="6.22331593">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03325567" y3="1.46834064" z3="8.0070546">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.85274926" y3="0.60780431" z3="8.67387484">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37541393" y3="2.3072982" z3="8.65506602">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71364147" y3="1.93243941" z3="7.39807056">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.65568832" y3="2.56128566" z3="6.34602341">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.89910913" y3="2.03137725" z3="8.15999809">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7339,.7685,3.9386;-.9793,1.127,2.9213;.3507,.9196,4.0997;-1.2755,1.4098,4.655;-1.1135,-.7022,4.1044;-.8579,-1.0284,5.127;-.5017,-1.317,3.4151;-2.5942,-.9952,3.8428;-2.762,-2.0858,3.9189;-2.8268,-.715,2.7951;-3.5873,-.2953,4.7828;-4.6042,-.5074,4.4147;-3.4488,.7991,4.7698;-3.5287,-.821,6.2236;-2.3924,-.7253,8.4747;-3.2683,-1.34,8.7543;-2.3094,.0867,9.232;-1.123,-1.5902,8.5786;-.9175,-1.8469,9.6393;-.2637,-.9813,8.2359;-1.2039,-2.8824,7.7652;-1.5607,-2.6431,6.7489;-1.9882,-3.5236,8.2027;.11,-3.6672,7.6732;-.0978,-4.6676,7.2547;.513,-3.837,8.6907;1.1787,-2.9963,6.8088;1.4644,-2.0057,7.2051;2.0984,-3.6084,6.7482;.8094,-2.8362,5.7823;-4.2887,-1.7666,6.5323;-2.6473,-.1617,7.1072;-1.863,.4677,6.6736;-7.4996,.9889,7.6073;-7.5056,.1747,8.3546;-8.2609,.7447,6.8445;-7.8232,1.9151,8.1198;-6.1154,1.147,6.9831;-5.8415,.2125,6.4686;-6.1247,1.9473,6.2233;-5.0333,1.4683,8.0071;-4.8527,.6078,8.6739;-5.3754,2.3073,8.6551;-3.7136,1.9324,7.3981;-3.6557,2.5613,6.346;-2.8991,2.0314,8.16;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.723984317199</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003124733854 0.000799233618 0.042729233191 0.008512125721</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016604096 -0.001672118 0.000109493 0.000332776 0.000666187 0.000996785 0.001144316 0.001561966 0.002364449 0.002843095 0.002908818 0.003722758 0.003922408 0.004444420 0.005451237 0.005862928 0.006378866 0.007778875 0.008231840 0.009653985 0.010449602 0.011011699 0.012676902 0.015123098 0.018622408 0.021464179 0.023774195 0.025240420 0.030415441 0.033964780 0.035193820 0.038852014 0.043367705 0.043757507 0.044568416 0.048344924 0.049497656 0.049951842 0.050679022 0.051741649 0.052210139 0.052492359 0.053102325 0.055007572 0.055965755 0.057602505 0.058484891 0.059506355 0.062454334 0.062679004 0.066587342 0.069893344 0.072814295 0.076653463 0.077958939 0.078719207 0.079179234 0.083993253 0.084690279 0.092477615 0.096457530 0.099014162 0.104542992 0.105671277 0.109309729 0.111474054 0.114169224 0.116301375 0.117382155 0.120156209 0.131016280 0.136937062 0.140035803 0.145021238 0.147523701 0.154390936 0.155261853 0.166678110 0.172696130 0.175256531 0.181297043 0.191356645 0.197698720 0.204088515 0.209982445 0.215715997 0.223356425 0.239751848 0.256524264 0.267063463 0.314996289 0.323983703 0.353911235 0.363626047 0.421306122 0.453986531 0.507686500 0.548520529 0.566455175 0.614160121 0.630744559 0.643385067 0.687776350 0.740664376 0.747065091 0.749447107 0.759546680 0.761361154 0.771354234 0.773492373 0.785377678 0.792033000 0.798421401 0.803717879 0.813896177 0.815909429 0.821627107 0.826560923 0.836292659 0.857705149 0.869530337 0.875888467 0.879253154 0.893933049 0.900386069 0.907980494 0.915253969 0.921986120 0.924717472 0.980174336 1.298382932 1.492342321</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">70</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.744723" y3="0.7786976" z3="3.92974906">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-0.99379827" y3="1.13896994" z3="2.91228231">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.33667745" y3="0.93892852" z3="4.08746977">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.28777051" y3="1.41702349" z3="4.64790502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11645838" y3="-0.69428636" z3="4.09721778">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.85949011" y3="-1.02034838" z3="5.12126156">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.50236864" y3="-1.30574092" z3="3.40685488">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59722187" y3="-0.99481084" z3="3.83879831">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.76067117" y3="-2.08678658" z3="3.91584089">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.83442296" y3="-0.71565454" z3="2.79140263">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59059933" y3="-0.29853691" z3="4.7812208">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61309105" y3="-0.50620282" z3="4.41353162">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.44867253" y3="0.79862762" z3="4.76928162">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.52940102" y3="-0.82485915" z3="6.22200018">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.38904711" y3="-0.72765016" z3="8.47088788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.2657189" y3="-1.34027275" z3="8.75240402">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.30427764" y3="0.08572966" z3="9.22641006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.12069309" y3="-1.59410608" z3="8.57527726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91800339" y3="-1.85412066" z3="9.63632443">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.25978995" y3="-0.98508568" z3="8.23631139">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.20153956" y3="-2.88305903" z3="7.75672061">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.54947209" y3="-2.63888054" z3="6.7365263">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-1.99415289" y3="-3.52299791" z3="8.1878525">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.10734172" y3="-3.67499387" z3="7.67731546">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.10273251" y3="-4.67642436" z3="7.25167124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.49770399" y3="-3.854121" z3="8.70039816">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.19180924" y3="-3.00246206" z3="6.83357304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.48282646" y3="-2.02187166" z3="7.24785064">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.10191302" y3="-3.62600402" z3="6.77564846">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.82803661" y3="-2.82887646" z3="5.80158123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.29208344" y3="-1.76795712" z3="6.53340025">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.64392993" y3="-0.16798666" z3="7.10221525">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8632113" y3="0.46662195" z3="6.66905793">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.49676234" y3="0.9875354" z3="7.61123152">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.50151314" y3="0.17728973" z3="8.36302889">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25772207" y3="0.73792544" z3="6.84905987">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82153986" y3="1.916032" z3="8.11901656">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11358245" y3="1.14484189" z3="6.98568148">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83722215" y3="0.2084498" z3="6.47514023">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.12547217" y3="1.9416615" z3="6.22222922">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03135023" y3="1.47347399" z3="8.00700524">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.84501434" y3="0.61559436" z3="8.67572437">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37536832" y3="2.3127859" z3="8.6528833">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71564205" y3="1.94128233" z3="7.39574384">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.6593477" y3="2.56768513" z3="6.34259278">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.89639986" y3="2.03539651" z3="8.15230839">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7447,.7787,3.9297;-.9938,1.139,2.9123;.3367,.9389,4.0875;-1.2878,1.417,4.6479;-1.1165,-.6943,4.0972;-.8595,-1.0203,5.1213;-.5024,-1.3057,3.4069;-2.5972,-.9948,3.8388;-2.7607,-2.0868,3.9158;-2.8344,-.7157,2.7914;-3.5906,-.2985,4.7812;-4.6131,-.5062,4.4135;-3.4487,.7986,4.7693;-3.5294,-.8249,6.222;-2.389,-.7277,8.4709;-3.2657,-1.3403,8.7524;-2.3043,.0857,9.2264;-1.1207,-1.5941,8.5753;-.918,-1.8541,9.6363;-.2598,-.9851,8.2363;-1.2015,-2.8831,7.7567;-1.5495,-2.6389,6.7365;-1.9942,-3.523,8.1879;.1073,-3.675,7.6773;-.1027,-4.6764,7.2517;.4977,-3.8541,8.7004;1.1918,-3.0025,6.8336;1.4828,-2.0219,7.2479;2.1019,-3.626,6.7756;.828,-2.8289,5.8016;-4.2921,-1.768,6.5334;-2.6439,-.168,7.1022;-1.8632,.4666,6.6691;-7.4968,.9875,7.6112;-7.5015,.1773,8.363;-8.2577,.7379,6.8491;-7.8215,1.916,8.119;-6.1136,1.1448,6.9857;-5.8372,.2084,6.4751;-6.1255,1.9417,6.2222;-5.0314,1.4735,8.007;-4.845,.6156,8.6757;-5.3754,2.3128,8.6529;-3.7156,1.9413,7.3957;-3.6593,2.5677,6.3426;-2.8964,2.0354,8.1523;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724002513190</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002985594477 0.000749186201 0.036464137816 0.008510570893</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016661687 -0.001273716 0.000139194 0.000331546 0.000695946 0.000992403 0.001144206 0.001568780 0.002370423 0.002883937 0.002994508 0.003742489 0.003923634 0.004448378 0.005450623 0.005865723 0.006388177 0.007778491 0.008246847 0.009653898 0.010455986 0.011015511 0.012781510 0.015134361 0.018679584 0.021473241 0.023832631 0.025246588 0.030416126 0.033964802 0.035206599 0.038852032 0.043372085 0.043765198 0.044568500 0.048346371 0.049503367 0.049981643 0.050689734 0.051741083 0.052215957 0.052493106 0.053114725 0.055010285 0.055977510 0.057605547 0.058548281 0.059626655 0.062496646 0.062746854 0.066592261 0.069997147 0.072823083 0.076655918 0.078049868 0.078754152 0.079204124 0.084174382 0.084695126 0.092574378 0.096458331 0.099035616 0.104558689 0.105674388 0.109349693 0.111475727 0.114175628 0.116434426 0.117524643 0.120158041 0.131061679 0.136975604 0.140259186 0.145026360 0.147563373 0.154391667 0.155261577 0.166757416 0.172823353 0.175262009 0.181299627 0.191363335 0.197746606 0.204158340 0.210152083 0.215730056 0.223998402 0.239833914 0.256661867 0.267145751 0.315069744 0.324090317 0.354164350 0.363637635 0.421320830 0.454018522 0.507697324 0.548520197 0.566560538 0.614334485 0.630836711 0.643410086 0.687825362 0.740663803 0.747556536 0.749465804 0.759596517 0.761367813 0.771378735 0.773493805 0.785430355 0.792033973 0.798424597 0.803778322 0.814078031 0.816408314 0.821742118 0.827359129 0.836311465 0.858027033 0.870210176 0.876292956 0.879262173 0.894104290 0.900492612 0.908377436 0.915435237 0.921997360 0.924765692 0.980171763 1.298428432 1.492343402</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">71</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.75149116" y3="0.78564458" z3="3.92599325">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.01083848" y3="1.1414559" z3="2.91189008">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.33137384" y3="0.9499955" z3="4.07638513">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.29289642" y3="1.4216611" z3="4.64759957">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11467658" y3="-0.68874494" z3="4.09410269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.85081215" y3="-1.01264837" z3="5.11540966">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.50042561" y3="-1.29663883" z3="3.40136194">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59451003" y3="-0.99537501" z3="3.83882815">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.75448368" y3="-2.08782348" z3="3.91891354">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.83304437" y3="-0.71989368" z3="2.7907786">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.5905428" y3="-0.29904288" z3="4.77896299">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60807249" y3="-0.51545315" z3="4.41226189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.45559853" y3="0.79673058" z3="4.76312321">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.52806985" y3="-0.82207096" z3="6.22104243">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.38410919" y3="-0.72198603" z3="8.46790645">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.26180031" y3="-1.33137262" z3="8.75348816">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.29458036" y3="0.09318002" z3="9.22099459">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11856273" y3="-1.59259197" z3="8.57105706">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.9150555" y3="-1.85325498" z3="9.63149951">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.25633459" y3="-0.98654237" z3="8.2301002">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.20549144" y3="-2.88089106" z3="7.75272328">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.54455014" y3="-2.63254886" z3="6.73133691">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.00570929" y3="-3.51390178" z3="8.17633271">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.09761597" y3="-3.68415038" z3="7.67790477">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.11731222" y3="-4.67462562" z3="7.23724284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.47339637" y3="-3.87964608" z3="8.70074959">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.19649022" y3="-3.01456159" z3="6.85104176">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.50212999" y3="-2.04614861" z3="7.28431478">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.09978966" y3="-3.64969409" z3="6.78515056">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.84686695" y3="-2.81238275" z3="5.82429654">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.29066119" y3="-1.76504127" z3="6.53456991">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.64090581" y3="-0.16531862" z3="7.09848285">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.86340736" y3="0.47287655" z3="6.66382208">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.49487621" y3="0.97943682" z3="7.61696524">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.49263649" y3="0.17057409" z3="8.37000122">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25644854" y3="0.72323985" z3="6.85842293">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82466787" y3="1.90679772" z3="8.12370683">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11389629" y3="1.14321095" z3="6.98761419">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83513268" y3="0.20730768" z3="6.47946451">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.13187099" y3="1.93812305" z3="6.22288871">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03090868" y3="1.47780108" z3="8.00627831">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.83980236" y3="0.62110831" z3="8.6753763">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37721571" y3="2.31626318" z3="8.65326921">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71848049" y3="1.95007272" z3="7.3918768">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.66553662" y3="2.57298705" z3="6.33726822">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.89621662" y3="2.04433944" z3="8.14508811">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7515,.7856,3.926;-1.0108,1.1415,2.9119;.3314,.95,4.0764;-1.2929,1.4217,4.6476;-1.1147,-.6887,4.0941;-.8508,-1.0126,5.1154;-.5004,-1.2966,3.4014;-2.5945,-.9954,3.8388;-2.7545,-2.0878,3.9189;-2.833,-.7199,2.7908;-3.5905,-.299,4.779;-4.6081,-.5155,4.4123;-3.4556,.7967,4.7631;-3.5281,-.8221,6.221;-2.3841,-.722,8.4679;-3.2618,-1.3314,8.7535;-2.2946,.0932,9.221;-1.1186,-1.5926,8.5711;-.9151,-1.8533,9.6315;-.2563,-.9865,8.2301;-1.2055,-2.8809,7.7527;-1.5446,-2.6325,6.7313;-2.0057,-3.5139,8.1763;.0976,-3.6842,7.6779;-.1173,-4.6746,7.2372;.4734,-3.8796,8.7007;1.1965,-3.0146,6.851;1.5021,-2.0461,7.2843;2.0998,-3.6497,6.7852;.8469,-2.8124,5.8243;-4.2907,-1.765,6.5346;-2.6409,-.1653,7.0985;-1.8634,.4729,6.6638;-7.4949,.9794,7.617;-7.4926,.1706,8.37;-8.2564,.7232,6.8584;-7.8247,1.9068,8.1237;-6.1139,1.1432,6.9876;-5.8351,.2073,6.4795;-6.1319,1.9381,6.2229;-5.0309,1.4778,8.0063;-4.8398,.6211,8.6754;-5.3772,2.3163,8.6533;-3.7185,1.9501,7.3919;-3.6655,2.573,6.3373;-2.8962,2.0443,8.1451;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724032504269</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001648145719 0.000530826701 0.031257785212 0.008514730052</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016654371 -0.000777228 0.000111104 0.000324573 0.000689697 0.000989663 0.001149820 0.001597715 0.002376248 0.002886528 0.003085025 0.003784138 0.003934564 0.004449211 0.005453224 0.005879027 0.006395883 0.007778405 0.008244570 0.009655236 0.010457262 0.011041072 0.012777770 0.015154090 0.018767434 0.021492003 0.023869689 0.025257829 0.030421468 0.033966555 0.035225427 0.038856606 0.043372936 0.043773198 0.044575276 0.048347225 0.049511771 0.050005770 0.050701037 0.051749647 0.052217358 0.052494797 0.053114593 0.055010804 0.055982457 0.057608138 0.058610575 0.059643329 0.062496825 0.062776757 0.066596852 0.070104182 0.072825592 0.076657473 0.078166954 0.078802831 0.079246720 0.084224482 0.084701433 0.092601319 0.096458866 0.099061080 0.104565584 0.105674263 0.109367709 0.111475988 0.114178084 0.116476378 0.117603853 0.120163275 0.131095519 0.136978035 0.140444848 0.145026221 0.147606962 0.154396318 0.155263319 0.166762416 0.172903547 0.175271736 0.181322153 0.191383193 0.197790366 0.204299359 0.210325297 0.215745105 0.224103821 0.239948937 0.256733893 0.267164961 0.315168951 0.324164011 0.354182044 0.363641818 0.421322805 0.454048278 0.507706018 0.548521401 0.566604962 0.614608510 0.631054285 0.643410713 0.687883487 0.740663915 0.747786109 0.749480494 0.759600492 0.761489345 0.771425481 0.773496124 0.785468067 0.792039283 0.798450592 0.803856030 0.814282807 0.816564547 0.821744500 0.827686858 0.836327451 0.858339308 0.870441656 0.876508146 0.879285812 0.894200195 0.900570578 0.908658646 0.915551041 0.922018199 0.924860460 0.980212400 1.298432506 1.492344863</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">72</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.75607785" y3="0.79669032" z3="3.92047964">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.010158" y3="1.1537981" z3="2.9028194">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.32626264" y3="0.96427335" z3="4.07641073">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.30323665" y3="1.43052444" z3="4.63906288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11386423" y3="-0.67963551" z3="4.09134787">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.85030943" y3="-1.00060297" z3="5.11487639">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49584523" y3="-1.28695882" z3="3.40033743">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59123624" y3="-0.99619779" z3="3.83814469">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.74171005" y3="-2.08816509" z3="3.92309747">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.83215634" y3="-0.72795668" z3="2.78915205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59042383" y3="-0.30362749" z3="4.77693186">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60919481" y3="-0.52390121" z3="4.4108555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.45937184" y3="0.79349665" z3="4.75721544">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.52525165" y3="-0.82073619" z3="6.22104726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.37643145" y3="-0.71399936" z3="8.46448418">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.25605875" y3="-1.31801656" z3="8.75565823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.28014511" y3="0.10357309" z3="9.21415814">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.11462132" y3="-1.59080064" z3="8.56662951">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91220145" y3="-1.85260487" z3="9.62688364">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.24983281" y3="-0.98907269" z3="8.22548252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.2085934" y3="-2.87822112" z3="7.7477296">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.54244715" y3="-2.62696096" z3="6.72477753">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.01648489" y3="-3.50424412" z3="8.16970895">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.08698959" y3="-3.69349545" z3="7.67777478">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.13549898" y3="-4.68099647" z3="7.22881179">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.45523715" y3="-3.89967017" z3="8.70407823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.20077934" y3="-3.02832498" z3="6.86701814">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.51763383" y3="-2.07022215" z3="7.31557256">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.09281525" y3="-3.67754921" z3="6.79873838">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.85449048" y3="-2.81082791" z3="5.83777536">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.28820581" y3="-1.76193981" z3="6.53959549">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63566656" y3="-0.16207325" z3="7.09363216">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.86205574" y3="0.47786201" z3="6.65724718">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.49335119" y3="0.9676118" z3="7.62469162">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.48381416" y3="0.15501026" z3="8.37439959">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25645822" y3="0.71141917" z3="6.86694874">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82467837" y3="1.8912733" z3="8.13694651">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.1163122" y3="1.14158881" z3="6.9898675">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83225971" y3="0.20830463" z3="6.47747772">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.14236998" y3="1.93888616" z3="6.22686446">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03169362" y3="1.48150489" z3="8.00512475">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.83360616" y3="0.62589064" z3="8.67344069">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37924456" y3="2.31833831" z3="8.65258716">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72379413" y3="1.96090445" z3="7.3864735">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.67587716" y3="2.58031432" z3="6.330287">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.89763808" y3="2.05599301" z3="8.13524401">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7561,.7967,3.9205;-1.0102,1.1538,2.9028;.3263,.9643,4.0764;-1.3032,1.4305,4.6391;-1.1139,-.6796,4.0913;-.8503,-1.0006,5.1149;-.4958,-1.287,3.4003;-2.5912,-.9962,3.8381;-2.7417,-2.0882,3.9231;-2.8322,-.728,2.7892;-3.5904,-.3036,4.7769;-4.6092,-.5239,4.4109;-3.4594,.7935,4.7572;-3.5253,-.8207,6.221;-2.3764,-.714,8.4645;-3.2561,-1.318,8.7557;-2.2801,.1036,9.2142;-1.1146,-1.5908,8.5666;-.9122,-1.8526,9.6269;-.2498,-.9891,8.2255;-1.2086,-2.8782,7.7477;-1.5424,-2.627,6.7248;-2.0165,-3.5042,8.1697;.087,-3.6935,7.6778;-.1355,-4.681,7.2288;.4552,-3.8997,8.7041;1.2008,-3.0283,6.867;1.5176,-2.0702,7.3156;2.0928,-3.6775,6.7987;.8545,-2.8108,5.8378;-4.2882,-1.7619,6.5396;-2.6357,-.1621,7.0936;-1.8621,.4779,6.6572;-7.4934,.9676,7.6247;-7.4838,.155,8.3744;-8.2565,.7114,6.8669;-7.8247,1.8913,8.1369;-6.1163,1.1416,6.9899;-5.8323,.2083,6.4775;-6.1424,1.9389,6.2269;-5.0317,1.4815,8.0051;-4.8336,.6259,8.6734;-5.3792,2.3183,8.6526;-3.7238,1.9609,7.3865;-3.6759,2.5803,6.3303;-2.8976,2.056,8.1352;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724052306241</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002436093054 0.000566217811 0.026792669997 0.008511490576</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016675607 -0.000766306 0.000135010 0.000321962 0.000686092 0.000990137 0.001150225 0.001638249 0.002374386 0.002890804 0.003155440 0.003825741 0.003972956 0.004448824 0.005458867 0.005914878 0.006405068 0.007789126 0.008246512 0.009655895 0.010457563 0.011108613 0.012815289 0.015164392 0.018894655 0.021524442 0.023904691 0.025264790 0.030427112 0.033968797 0.035251277 0.038869278 0.043374196 0.043783451 0.044592991 0.048348059 0.049515798 0.050026862 0.050722057 0.051781873 0.052219245 0.052496046 0.053116124 0.055014234 0.055993311 0.057617938 0.058634185 0.059656116 0.062500300 0.062774752 0.066598652 0.070240784 0.072838850 0.076658021 0.078267012 0.078811628 0.079274540 0.084275868 0.084703082 0.092611248 0.096462746 0.099101439 0.104570632 0.105678159 0.109369583 0.111480773 0.114179022 0.116493466 0.117629864 0.120163979 0.131124320 0.136982093 0.140563827 0.145026458 0.147609693 0.154420395 0.155264619 0.166789709 0.172951145 0.175273902 0.181330977 0.191396596 0.197850806 0.204360273 0.210592839 0.215767026 0.224299484 0.240067837 0.256798329 0.267204753 0.315381627 0.324239461 0.354187345 0.363655620 0.421429535 0.454082556 0.507715179 0.548521539 0.566614637 0.614673627 0.631142714 0.643517007 0.687891097 0.740697263 0.747856187 0.749491398 0.759601480 0.761487906 0.771445211 0.773525537 0.785491026 0.792040066 0.798620649 0.803885174 0.814374737 0.816615186 0.821754249 0.827731215 0.836327458 0.858832257 0.870470924 0.876702491 0.879288233 0.894282660 0.900652587 0.908923185 0.915735431 0.922033557 0.925024792 0.980248789 1.298435598 1.492365123</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">73</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.75720724" y3="0.79970761" z3="3.92037552">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.01969646" y3="1.14838373" z3="2.9048421">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.32119746" y3="0.97843168" z3="4.07009723">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.30518092" y3="1.43367078" z3="4.6389393">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10590593" y3="-0.67710785" z3="4.09467379">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.8402378" y3="-0.99484807" z3="5.11791074">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48611687" y3="-1.28192085" z3="3.40432377">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58395059" y3="-0.99740344" z3="3.84028907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.73685293" y3="-2.09165786" z3="3.92779111">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.82399615" y3="-0.73066382" z3="2.79010923">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58706807" y3="-0.3026591" z3="4.77479134">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60399259" y3="-0.52801017" z3="4.4079167">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.4589985" y3="0.79483257" z3="4.75166275">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.52172638" y3="-0.81587564" z3="6.22050853">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.36866902" y3="-0.7028848" z3="8.46192961">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.24869383" y3="-1.30321294" z3="8.7597285">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.2655321" y3="0.11671442" z3="9.20845073">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10967074" y3="-1.58414347" z3="8.55937823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90187538" y3="-1.84389986" z3="9.61964144">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.24437578" y3="-0.98620438" z3="8.2110977">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.21382233" y3="-2.87270635" z3="7.74310151">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.54112205" y3="-2.62037335" z3="6.71961829">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.02844799" y3="-3.48978752" z3="8.16181472">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.07295518" y3="-3.70092885" z3="7.67721845">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.15668301" y3="-4.6814646" z3="7.21950556">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.42844448" y3="-3.91874229" z3="8.70236436">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.19787501" y3="-3.04278654" z3="6.87662954">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.52851221" y3="-2.09560263" z3="7.33794424">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.0823316" y3="-3.703103" z3="6.80074423">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.8610006" y3="-2.80494267" z3="5.85204237">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.28315878" y3="-1.7577409" z3="6.54192346">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.63252014" y3="-0.15410602" z3="7.09086086">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.86175683" y3="0.48995337" z3="6.65228387">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.49274185" y3="0.95398229" z3="7.63152933">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.47289069" y3="0.13967941" z3="8.37823319">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.258047" y3="0.69411538" z3="6.87797642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82977152" y3="1.87327503" z3="8.14853551">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11948475" y3="1.13999701" z3="6.99116036">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83202961" y3="0.2103326" z3="6.4753551">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.15453826" y3="1.93899454" z3="6.2308124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03300161" y3="1.48268047" z3="8.00331885">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.83051668" y3="0.62657957" z3="8.66993807">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38199836" y3="2.31735985" z3="8.65371242">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72859538" y3="1.96584269" z3="7.38245469">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.68388676" y3="2.5836664" z3="6.32485133">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90152447" y3="2.06503382" z3="8.12950174">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7572,.7997,3.9204;-1.0197,1.1484,2.9048;.3212,.9784,4.0701;-1.3052,1.4337,4.6389;-1.1059,-.6771,4.0947;-.8402,-.9948,5.1179;-.4861,-1.2819,3.4043;-2.584,-.9974,3.8403;-2.7369,-2.0917,3.9278;-2.824,-.7307,2.7901;-3.5871,-.3027,4.7748;-4.604,-.528,4.4079;-3.459,.7948,4.7517;-3.5217,-.8159,6.2205;-2.3687,-.7029,8.4619;-3.2487,-1.3032,8.7597;-2.2655,.1167,9.2085;-1.1097,-1.5841,8.5594;-.9019,-1.8439,9.6196;-.2444,-.9862,8.2111;-1.2138,-2.8727,7.7431;-1.5411,-2.6204,6.7196;-2.0284,-3.4898,8.1618;.073,-3.7009,7.6772;-.1567,-4.6815,7.2195;.4284,-3.9187,8.7024;1.1979,-3.0428,6.8766;1.5285,-2.0956,7.3379;2.0823,-3.7031,6.8007;.861,-2.8049,5.852;-4.2832,-1.7577,6.5419;-2.6325,-.1541,7.0909;-1.8618,.49,6.6523;-7.4927,.954,7.6315;-7.4729,.1397,8.3782;-8.258,.6941,6.878;-7.8298,1.8733,8.1485;-6.1195,1.14,6.9912;-5.832,.2103,6.4754;-6.1545,1.939,6.2308;-5.033,1.4827,8.0033;-4.8305,.6266,8.6699;-5.382,2.3174,8.6537;-3.7286,1.9658,7.3825;-3.6839,2.5837,6.3249;-2.9015,2.065,8.1295;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724067728562</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002093898946 0.000575678035 0.027591487678 0.008511177597</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016621207 -0.001020817 0.000134891 0.000321490 0.000694148 0.000989536 0.001151661 0.001666203 0.002377794 0.002892552 0.003235281 0.003859319 0.004021024 0.004456176 0.005469813 0.005962940 0.006413824 0.007820516 0.008269852 0.009656218 0.010457628 0.011220819 0.013009604 0.015167632 0.019078086 0.021553366 0.023957171 0.025264612 0.030427809 0.033968511 0.035272248 0.038899630 0.043388824 0.043790406 0.044613019 0.048352905 0.049518144 0.050045057 0.050731119 0.051828723 0.052230685 0.052496284 0.053129475 0.055013990 0.056001434 0.057631981 0.058683312 0.059807991 0.062520691 0.062786895 0.066598989 0.070393443 0.072865956 0.076658641 0.078420730 0.078811975 0.079302854 0.084281285 0.084702728 0.092610545 0.096464077 0.099125109 0.104570273 0.105683232 0.109373575 0.111503642 0.114178893 0.116506785 0.117630045 0.120164620 0.131152347 0.137015422 0.140613999 0.145026193 0.147613981 0.154458594 0.155265639 0.166924066 0.172947174 0.175305681 0.181332396 0.191413195 0.197847041 0.204392736 0.210815668 0.215774542 0.224313825 0.240139837 0.256801657 0.267216818 0.315543603 0.324304906 0.354480946 0.363671795 0.421549646 0.454338681 0.507721279 0.548523109 0.566630484 0.614868027 0.631212625 0.643562298 0.687901351 0.740721576 0.747860936 0.749543276 0.759627040 0.761566518 0.771458788 0.773528787 0.785495803 0.792040133 0.798969874 0.803934548 0.814462133 0.816617939 0.821785298 0.827796382 0.836337129 0.859246883 0.870547483 0.876743751 0.879287483 0.894311277 0.900670992 0.909183614 0.915894359 0.922047259 0.925190255 0.980330914 1.298522437 1.492388343</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">74</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.75837881" y3="0.81105221" z3="3.91640221">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.01338934" y3="1.16129417" z3="2.89687328">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.3254932" y3="0.9836557" z3="4.07338198">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.31126439" y3="1.44502734" z3="4.63110759">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10636904" y3="-0.6678502" z3="4.09343429">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.8389397" y3="-0.9825783" z3="5.11729069">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48375885" y3="-1.2736236" z3="3.40489342">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58090806" y3="-0.99711596" z3="3.84109989">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.7213857" y3="-2.08919863" z3="3.93232248">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.82260333" y3="-0.73750095" z3="2.79010065">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58688939" y3="-0.3060686" z3="4.77369432">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60187605" y3="-0.5393765" z3="4.40824185">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.46591919" y3="0.7914789" z3="4.74587395">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.5181894" y3="-0.81189308" z3="6.22149675">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.36060225" y3="-0.6903509" z3="8.45904792">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.24195396" y3="-1.2852642" z3="8.76369304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.24915481" y3="0.13119227" z3="9.20207499">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.1059156" y3="-1.57840863" z3="8.55282432">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89629998" y3="-1.83844525" z3="9.6121212">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23895391" y3="-0.9857963" z3="8.20114976">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22018329" y3="-2.86766896" z3="7.73945941">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.54659533" y3="-2.61518008" z3="6.71400327">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.04105403" y3="-3.4774361" z3="8.16049532">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.05958608" y3="-3.70789598" z3="7.67691215">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.17846264" y3="-4.68450203" z3="7.21338229">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.4106922" y3="-3.93367415" z3="8.70508657">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.19761981" y3="-3.05783792" z3="6.88802146">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.53840747" y3="-2.11878405" z3="7.35927759">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07120468" y3="-3.73069449" z3="6.81323088">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.86760113" y3="-2.80865394" z3="5.86215482">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.27678463" y3="-1.75390449" z3="6.54823968">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62895377" y3="-0.1444699" z3="7.0875061">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85987214" y3="0.49682838" z3="6.64535268">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.49094451" y3="0.94002905" z3="7.63882419">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.46311796" y3="0.11918925" z3="8.37945371">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25821934" y3="0.68154572" z3="6.88598018">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82942148" y3="1.85398149" z3="8.16441533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12214451" y3="1.13796859" z3="6.99271822">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8318069" y3="0.21277815" z3="6.46967488">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.16510944" y3="1.94164434" z3="6.2370425">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03312558" y3="1.4811873" z3="8.00203813">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.82663992" y3="0.6244957" z3="8.66668475">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38164198" y3="2.31412397" z3="8.65436546">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73154909" y3="1.96881259" z3="7.37647387">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.69265573" y3="2.58432011" z3="6.31780386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90353934" y3="2.0740242" z3="8.12216637">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7584,.8111,3.9164;-1.0134,1.1613,2.8969;.3255,.9837,4.0734;-1.3113,1.445,4.6311;-1.1064,-.6679,4.0934;-.8389,-.9826,5.1173;-.4838,-1.2736,3.4049;-2.5809,-.9971,3.8411;-2.7214,-2.0892,3.9323;-2.8226,-.7375,2.7901;-3.5869,-.3061,4.7737;-4.6019,-.5394,4.4082;-3.4659,.7915,4.7459;-3.5182,-.8119,6.2215;-2.3606,-.6904,8.459;-3.242,-1.2853,8.7637;-2.2492,.1312,9.2021;-1.1059,-1.5784,8.5528;-.8963,-1.8384,9.6121;-.239,-.9858,8.2011;-1.2202,-2.8677,7.7395;-1.5466,-2.6152,6.714;-2.0411,-3.4774,8.1605;.0596,-3.7079,7.6769;-.1785,-4.6845,7.2134;.4107,-3.9337,8.7051;1.1976,-3.0578,6.888;1.5384,-2.1188,7.3593;2.0712,-3.7307,6.8132;.8676,-2.8087,5.8622;-4.2768,-1.7539,6.5482;-2.629,-.1445,7.0875;-1.8599,.4968,6.6454;-7.4909,.94,7.6388;-7.4631,.1192,8.3795;-8.2582,.6815,6.886;-7.8294,1.854,8.1644;-6.1221,1.138,6.9927;-5.8318,.2128,6.4697;-6.1651,1.9416,6.237;-5.0331,1.4812,8.002;-4.8266,.6245,8.6667;-5.3816,2.3141,8.6544;-3.7315,1.9688,7.3765;-3.6927,2.5843,6.3178;-2.9035,2.074,8.1222;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724073724618</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002363362482 0.000668665806 0.024976691880 0.008512208487</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016580324 -0.001246557 0.000134709 0.000321700 0.000715287 0.001010545 0.001161942 0.001664296 0.002373842 0.002891514 0.003239945 0.003872569 0.004043347 0.004460302 0.005472842 0.005977227 0.006413098 0.007848600 0.008309519 0.009656090 0.010457553 0.011340978 0.013350669 0.015168000 0.019327688 0.021572474 0.024044696 0.025266534 0.030428875 0.033984613 0.035278376 0.038941661 0.043437514 0.043790263 0.044631251 0.048357086 0.049518288 0.050054007 0.050735376 0.051871699 0.052244521 0.052497108 0.053172588 0.055014602 0.056006887 0.057650305 0.058724344 0.060040388 0.062553289 0.062840921 0.066598430 0.070490178 0.072919916 0.076658605 0.078605005 0.078868891 0.079298196 0.084288658 0.084705179 0.092611947 0.096469168 0.099149727 0.104570788 0.105685424 0.109402947 0.111563156 0.114178804 0.116534837 0.117633702 0.120164662 0.131166460 0.137054909 0.140655446 0.145027147 0.147619503 0.154488659 0.155266046 0.167200484 0.173003825 0.175328971 0.181333137 0.191422979 0.197848404 0.204421353 0.211160446 0.215789835 0.224379006 0.240331904 0.256804935 0.267232457 0.315836138 0.324406669 0.355146199 0.363698209 0.421885341 0.454629527 0.507722225 0.548525199 0.566630785 0.614924205 0.631225159 0.643778214 0.687903420 0.740749561 0.747861897 0.749566737 0.759700920 0.761567049 0.771468707 0.773565140 0.785496007 0.792042051 0.799312605 0.803992779 0.814508431 0.816618198 0.821918887 0.828179676 0.836366712 0.859728118 0.870930486 0.876851273 0.879286579 0.894335867 0.900671805 0.909258111 0.916016402 0.922047447 0.925287273 0.980372232 1.298643252 1.492408959</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">75</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.76190827" y3="0.81648923" z3="3.91327358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.02316391" y3="1.15862563" z3="2.89452479">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.31195404" y3="1.00863239" z3="4.06682279">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.31876364" y3="1.4472087" z3="4.62657907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.09646358" y3="-0.66191879" z3="4.09413301">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82785546" y3="-0.97246366" z3="5.11914934">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47207303" y3="-1.26454647" z3="3.40603287">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57155768" y3="-0.99752773" z3="3.84298847">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.7137745" y3="-2.09252112" z3="3.9385531">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.81438675" y3="-0.74164219" z3="2.7910489">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58247365" y3="-0.30681227" z3="4.77234882">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.59706108" y3="-0.54561811" z3="4.40666042">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.46643362" y3="0.7916853" z3="4.74138263">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.51284537" y3="-0.8077907" z3="6.22194977">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.35227807" y3="-0.67850619" z3="8.45789338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.23529569" y3="-1.26761552" z3="8.76910176">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.23291683" y3="0.1453698" z3="9.19699543">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10207244" y3="-1.57335043" z3="8.54911326">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88984341" y3="-1.83156915" z3="9.60873164">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.23304994" y3="-0.9862027" z3="8.19241772">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22642206" y3="-2.86332121" z3="7.73793528">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.5454498" y3="-2.60928187" z3="6.71247694">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.05414413" y3="-3.46332872" z3="8.15593288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.04510201" y3="-3.71590637" z3="7.67820045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.20006932" y3="-4.68702093" z3="7.20818206">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.38571742" y3="-3.95105496" z3="8.70537727">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.19270854" y3="-3.07305274" z3="6.89626835">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.54504261" y3="-2.14373694" z3="7.37689319">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06046834" y3="-3.75473146" z3="6.81315342">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.86682859" y3="-2.80862352" z3="5.8730999">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.27019974" y3="-1.74948126" z3="6.55294612">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62417113" y3="-0.13620259" z3="7.08567232">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85703376" y3="0.50769095" z3="6.64111042">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.48903372" y3="0.92575565" z3="7.64440361">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.45338897" y3="0.10097349" z3="8.37954183">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25881867" y3="0.66899613" z3="6.89389114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82931663" y3="1.83442576" z3="8.17778512">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12432879" y3="1.13572516" z3="6.99323824">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83034543" y3="0.21523672" z3="6.46348677">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.17568675" y3="1.94323528" z3="6.24213225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03328685" y3="1.48041922" z3="7.99972453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.82359599" y3="0.6236372" z3="8.66275468">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38209387" y3="2.31160496" z3="8.65402516">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73447361" y3="1.97088538" z3="7.37191319">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.69904511" y3="2.58542354" z3="6.31163369">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90666911" y3="2.08226333" z3="8.11640869">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7619,.8165,3.9133;-1.0232,1.1586,2.8945;.312,1.0086,4.0668;-1.3188,1.4472,4.6266;-1.0965,-.6619,4.0941;-.8279,-.9725,5.1191;-.4721,-1.2645,3.406;-2.5716,-.9975,3.843;-2.7138,-2.0925,3.9386;-2.8144,-.7416,2.791;-3.5825,-.3068,4.7723;-4.5971,-.5456,4.4067;-3.4664,.7917,4.7414;-3.5128,-.8078,6.2219;-2.3523,-.6785,8.4579;-3.2353,-1.2676,8.7691;-2.2329,.1454,9.197;-1.1021,-1.5734,8.5491;-.8898,-1.8316,9.6087;-.233,-.9862,8.1924;-1.2264,-2.8633,7.7379;-1.5454,-2.6093,6.7125;-2.0541,-3.4633,8.1559;.0451,-3.7159,7.6782;-.2001,-4.687,7.2082;.3857,-3.9511,8.7054;1.1927,-3.0731,6.8963;1.545,-2.1437,7.3769;2.0605,-3.7547,6.8132;.8668,-2.8086,5.8731;-4.2702,-1.7495,6.5529;-2.6242,-.1362,7.0857;-1.857,.5077,6.6411;-7.489,.9258,7.6444;-7.4534,.101,8.3795;-8.2588,.669,6.8939;-7.8293,1.8344,8.1778;-6.1243,1.1357,6.9932;-5.8303,.2152,6.4635;-6.1757,1.9432,6.2421;-5.0333,1.4804,7.9997;-4.8236,.6236,8.6628;-5.3821,2.3116,8.654;-3.7345,1.9709,7.3719;-3.699,2.5854,6.3116;-2.9067,2.0823,8.1164;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724081866236</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003191214752 0.000673406361 0.028552848025 0.008515199443</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016549216 -0.001221692 0.000134579 0.000322636 0.000740022 0.001031967 0.001180725 0.001685827 0.002372547 0.002908186 0.003275889 0.003895555 0.004041705 0.004477063 0.005473633 0.005976521 0.006412687 0.007864173 0.008334202 0.009655865 0.010460705 0.011446499 0.013508452 0.015171585 0.019561192 0.021581306 0.024135804 0.025268770 0.030440723 0.034054936 0.035279646 0.038963887 0.043512584 0.043796167 0.044642152 0.048358455 0.049520749 0.050055973 0.050734643 0.051897604 0.052250071 0.052499034 0.053222904 0.055027908 0.056006266 0.057663334 0.058806190 0.060290725 0.062596354 0.062881797 0.066598774 0.070536701 0.072955874 0.076663961 0.078670386 0.079105211 0.079320742 0.084288814 0.084709596 0.092612215 0.096474778 0.099154087 0.104572219 0.105685229 0.109461805 0.111646835 0.114178662 0.116579904 0.117651923 0.120165159 0.131175180 0.137079676 0.140690822 0.145027190 0.147622850 0.154495984 0.155267024 0.167475079 0.173174668 0.175372224 0.181336171 0.191424198 0.197859680 0.204418180 0.211349705 0.215977470 0.224376945 0.240342692 0.256878902 0.267234412 0.315907905 0.324534200 0.356210573 0.363746324 0.422054956 0.455253369 0.507722865 0.548531978 0.566638552 0.615087166 0.631226812 0.643846502 0.687939969 0.740750640 0.747863586 0.749597455 0.759781216 0.761614164 0.771470127 0.773571591 0.785496793 0.792044735 0.799477300 0.804047167 0.814509003 0.816629766 0.822063349 0.829107410 0.836393851 0.859938394 0.871598072 0.876902858 0.879288938 0.894346382 0.900738933 0.909269513 0.916058998 0.922047026 0.925331213 0.980417107 1.298791888 1.492434805</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">76</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.76472956" y3="0.8285971" z3="3.90927303">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.02435741" y3="1.1673824" z3="2.88806761">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.31768419" y3="1.01330294" z3="4.06363924">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.32400025" y3="1.46331824" z3="4.62000006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.09738428" y3="-0.65288862" z3="4.09625839">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.82565898" y3="-0.95917259" z3="5.12152678">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.46908062" y3="-1.25624945" z3="3.41082253">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56922112" y3="-0.99707118" z3="3.84573275">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.70128958" y3="-2.09053143" z3="3.94403821">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.81225913" y3="-0.74581284" z3="2.79267511">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58274349" y3="-0.307787" z3="4.77224883">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.59551759" y3="-0.5525755" z3="4.40717376">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.47039093" y3="0.7912708" z3="4.73809299">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.51027924" y3="-0.80337996" z3="6.22316338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.34486153" y3="-0.66619127" z3="8.45547511">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22775696" y3="-1.25149972" z3="8.77399604">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.21762392" y3="0.15888806" z3="9.19174086">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.0978818" y3="-1.56606846" z3="8.54072841">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88237585" y3="-1.82532098" z3="9.5993672">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22792349" y3="-0.9827714" z3="8.18053931">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23132511" y3="-2.85586248" z3="7.73099542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.54588693" y3="-2.60137186" z3="6.70302537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.066249" y3="-3.44800973" z3="8.14793299">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.03091662" y3="-3.72131552" z3="7.67855513">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.22221498" y3="-4.69036293" z3="7.20636218">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.36289943" y3="-3.96092337" z3="8.70867824">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.19100054" y3="-3.09010497" z3="6.9074205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.55154944" y3="-2.16636455" z3="7.39398068">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.04803989" y3="-3.78328431" z3="6.8298203">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.87797904" y3="-2.81811375" z3="5.88345845">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.26317142" y3="-1.74661729" z3="6.55839563">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.62297109" y3="-0.12497797" z3="7.08382135">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85597234" y3="0.51436114" z3="6.63501643">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4867075" y3="0.91253019" z3="7.650472">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.44148982" y3="0.08427833" z3="8.38119713">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.258909" y3="0.65349278" z3="6.90349188">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.83123265" y3="1.81637929" z3="8.18982609">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12626167" y3="1.13320757" z3="6.99388396">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.83118349" y3="0.21696568" z3="6.45886491">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.1852073" y3="1.94349032" z3="6.24688934">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03229678" y3="1.47706565" z3="7.99732672">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.82084122" y3="0.61848747" z3="8.65855032">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.38025443" y3="2.30712044" z3="8.65440636">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73493916" y3="1.9675898" z3="7.36559687">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70346608" y3="2.58060769" z3="6.304175">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90812226" y3="2.08674947" z3="8.11118537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7647,.8286,3.9093;-1.0244,1.1674,2.8881;.3177,1.0133,4.0636;-1.324,1.4633,4.62;-1.0974,-.6529,4.0963;-.8257,-.9592,5.1215;-.4691,-1.2562,3.4108;-2.5692,-.9971,3.8457;-2.7013,-2.0905,3.944;-2.8123,-.7458,2.7927;-3.5827,-.3078,4.7722;-4.5955,-.5526,4.4072;-3.4704,.7913,4.7381;-3.5103,-.8034,6.2232;-2.3449,-.6662,8.4555;-3.2278,-1.2515,8.774;-2.2176,.1589,9.1917;-1.0979,-1.5661,8.5407;-.8824,-1.8253,9.5994;-.2279,-.9828,8.1805;-1.2313,-2.8559,7.731;-1.5459,-2.6014,6.703;-2.0662,-3.448,8.1479;.0309,-3.7213,7.6786;-.2222,-4.6904,7.2064;.3629,-3.9609,8.7087;1.191,-3.0901,6.9074;1.5515,-2.1664,7.394;2.048,-3.7833,6.8298;.878,-2.8181,5.8835;-4.2632,-1.7466,6.5584;-2.623,-.125,7.0838;-1.856,.5144,6.635;-7.4867,.9125,7.6505;-7.4415,.0843,8.3812;-8.2589,.6535,6.9035;-7.8312,1.8164,8.1898;-6.1263,1.1332,6.9939;-5.8312,.217,6.4589;-6.1852,1.9435,6.2469;-5.0323,1.4771,7.9973;-4.8208,.6185,8.6586;-5.3803,2.3071,8.6544;-3.7349,1.9676,7.3656;-3.7035,2.5806,6.3042;-2.9081,2.0867,8.1112;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724089418425</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003125657744 0.000599711427 0.026316875004 0.008512294563</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016534243 -0.000972573 0.000140121 0.000324153 0.000739559 0.001033522 0.001212249 0.001761475 0.002379823 0.002912934 0.003267812 0.003905788 0.004041878 0.004477774 0.005474150 0.005993568 0.006412039 0.007861991 0.008346291 0.009656149 0.010461600 0.011541094 0.013580069 0.015174687 0.019749166 0.021580298 0.024221442 0.025269190 0.030457218 0.034177996 0.035308341 0.038973162 0.043597461 0.043830988 0.044646524 0.048361926 0.049522859 0.050056285 0.050739158 0.051913813 0.052249903 0.052499900 0.053266840 0.055032619 0.056011457 0.057667044 0.058833362 0.060403716 0.062638431 0.062926951 0.066600056 0.070530638 0.072970896 0.076707110 0.078667183 0.079170937 0.079583445 0.084290038 0.084712481 0.092614494 0.096487180 0.099156033 0.104577071 0.105689026 0.109506872 0.111721473 0.114178767 0.116620619 0.117666995 0.120165217 0.131174424 0.137084242 0.140723402 0.145029207 0.147649839 0.154502280 0.155267029 0.167640926 0.173359358 0.175394949 0.181336330 0.191442457 0.197857592 0.204416432 0.211505752 0.216335667 0.224389649 0.240373479 0.256942629 0.267236372 0.315975548 0.324677216 0.356992204 0.363778626 0.422244666 0.455661277 0.507738605 0.548543382 0.566645202 0.615155360 0.631251838 0.643965871 0.687977113 0.740799537 0.747864260 0.749598584 0.759876185 0.761613921 0.771474272 0.773601496 0.785512740 0.792046550 0.799488813 0.804069759 0.814517814 0.816694585 0.822206779 0.830156265 0.836413549 0.860011778 0.872082874 0.877111601 0.879304634 0.894350067 0.900895023 0.909332618 0.916063711 0.922053697 0.925331748 0.980457547 1.298890353 1.492438164</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">77</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.77021512" y3="0.83823011" z3="3.90431441">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.03467425" y3="1.17425148" z3="2.88366166">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.30348565" y3="1.03961981" z3="4.05741237">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.33353497" y3="1.46560571" z3="4.61438799">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.09143812" y3="-0.64305243" z3="4.09147175">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81609864" y3="-0.94794909" z3="5.11623338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.46365074" y3="-1.24305614" z3="3.40400184">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56402786" y3="-0.99344561" z3="3.84504824">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.69412904" y3="-2.08865537" z3="3.94536299">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.81125597" y3="-0.74530147" z3="2.79249269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58052834" y3="-0.30837122" z3="4.77182121">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.59182714" y3="-0.56079839" z3="4.40821499">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.47720035" y3="0.79047165" z3="4.73577983">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50505372" y3="-0.79950556" z3="6.22395733">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33693573" y3="-0.65501076" z3="8.45432755">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22132153" y3="-1.23479695" z3="8.7787408">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.20235365" y3="0.17194696" z3="9.18697905">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09465849" y3="-1.56156696" z3="8.53744285">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.87743428" y3="-1.81942328" z3="9.59612767">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22254539" y3="-0.98375599" z3="8.17272134">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23797153" y3="-2.85272362" z3="7.73105348">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.54528682" y3="-2.59767481" z3="6.70141153">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.08061836" y3="-3.43517198" z3="8.1451409">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.01744254" y3="-3.72985761" z3="7.6839725">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.24153567" y3="-4.69307025" z3="7.20588499">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.34252592" y3="-3.97636046" z3="8.71538022">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.18851845" y3="-3.10679798" z3="6.92040414">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.5584968" y3="-2.19181994" z3="7.41497355">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.03945235" y3="-3.80901212" z3="6.83919526">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.87894967" y3="-2.82415505" z3="5.89627307">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.25613131" y3="-1.74242868" z3="6.56362946">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61857671" y3="-0.11625131" z3="7.08236324">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85170177" y3="0.52245319" z3="6.63048474">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.48311443" y3="0.89844747" z3="7.65500164">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.431924" y3="0.0648636" z3="8.37978445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25675771" y3="0.64207548" z3="6.90766582">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.8275192" y3="1.79727715" z3="8.20214389">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12657565" y3="1.12988541" z3="6.99425528">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82867399" y3="0.21823268" z3="6.45120122">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19211646" y3="1.94518155" z3="6.25231622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.03049285" y3="1.47434965" z3="7.99528514">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.81842995" y3="0.61786182" z3="8.65739812">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.3765269" y3="2.30512297" z3="8.6504513">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73411948" y3="1.96495404" z3="7.35991627">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70697031" y3="2.57655834" z3="6.29666937">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90891376" y3="2.09308018" z3="8.10513247">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7702,.8382,3.9043;-1.0347,1.1743,2.8837;.3035,1.0396,4.0574;-1.3335,1.4656,4.6144;-1.0914,-.6431,4.0915;-.8161,-.9479,5.1162;-.4637,-1.2431,3.404;-2.564,-.9934,3.845;-2.6941,-2.0887,3.9454;-2.8113,-.7453,2.7925;-3.5805,-.3084,4.7718;-4.5918,-.5608,4.4082;-3.4772,.7905,4.7358;-3.5051,-.7995,6.224;-2.3369,-.655,8.4543;-3.2213,-1.2348,8.7787;-2.2024,.1719,9.187;-1.0947,-1.5616,8.5374;-.8774,-1.8194,9.5961;-.2225,-.9838,8.1727;-1.238,-2.8527,7.7311;-1.5453,-2.5977,6.7014;-2.0806,-3.4352,8.1451;.0174,-3.7299,7.684;-.2415,-4.6931,7.2059;.3425,-3.9764,8.7154;1.1885,-3.1068,6.9204;1.5585,-2.1918,7.415;2.0395,-3.809,6.8392;.8789,-2.8242,5.8963;-4.2561,-1.7424,6.5636;-2.6186,-.1163,7.0824;-1.8517,.5225,6.6305;-7.4831,.8984,7.655;-7.4319,.0649,8.3798;-8.2568,.6421,6.9077;-7.8275,1.7973,8.2021;-6.1266,1.1299,6.9943;-5.8287,.2182,6.4512;-6.1921,1.9452,6.2523;-5.0305,1.4743,7.9953;-4.8184,.6179,8.6574;-5.3765,2.3051,8.6505;-3.7341,1.965,7.3599;-3.707,2.5766,6.2967;-2.9089,2.0931,8.1051;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724097046256</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002639211374 0.000528544386 0.027385304190 0.008515374050</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016527389 -0.000752099 0.000139941 0.000325030 0.000740093 0.001034094 0.001208853 0.001809212 0.002392842 0.002926976 0.003289474 0.003919714 0.004046442 0.004480254 0.005474453 0.006000119 0.006416727 0.007860701 0.008343865 0.009655796 0.010464332 0.011624069 0.013572054 0.015177844 0.019867366 0.021580228 0.024284746 0.025276371 0.030489591 0.034307466 0.035375185 0.038972058 0.043633096 0.043897711 0.044653373 0.048364390 0.049526521 0.050058199 0.050745044 0.051939348 0.052250170 0.052500302 0.053289888 0.055038712 0.056025187 0.057674402 0.058861748 0.060477979 0.062684215 0.062959933 0.066602141 0.070534437 0.072971176 0.076795601 0.078670343 0.079174311 0.079785109 0.084293455 0.084713077 0.092616591 0.096499628 0.099156201 0.104575973 0.105693423 0.109527617 0.111755995 0.114180301 0.116630035 0.117671439 0.120165307 0.131175546 0.137086050 0.140753652 0.145029791 0.147710501 0.154528338 0.155268166 0.167730309 0.173388076 0.175397936 0.181340584 0.191523895 0.197857740 0.204430719 0.211504598 0.216764858 0.224394650 0.240410281 0.257071296 0.267290840 0.315980040 0.324764840 0.357401728 0.363830468 0.422265125 0.456156184 0.507773953 0.548554461 0.566688327 0.615267339 0.631351525 0.644005627 0.688110440 0.740884276 0.747868922 0.749598805 0.759898988 0.761613587 0.771475511 0.773605462 0.785567527 0.792052250 0.799488810 0.804070098 0.814555475 0.816860477 0.822239972 0.830914268 0.836419639 0.860015538 0.872203079 0.877151620 0.879314921 0.894357269 0.900973032 0.909456857 0.916163932 0.922069268 0.925366773 0.980487395 1.298891428 1.492462642</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">78</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.77732831" y3="0.85094102" z3="3.89790206">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.04320266" y3="1.18316" z3="2.87622231">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.30100866" y3="1.05072602" z3="4.04840037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.34178838" y3="1.48230483" z3="4.60771498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.09268887" y3="-0.63260192" z3="4.09009367">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81366958" y3="-0.93394775" z3="5.11520413">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.46177305" y3="-1.23087708" z3="3.40326905">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56205814" y3="-0.99192005" z3="3.84615645">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68472179" y3="-2.08666062" z3="3.94974954">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.81045266" y3="-0.74770428" z3="2.79271697">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58053877" y3="-0.30741484" z3="4.77160484">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.59268712" y3="-0.56140459" z3="4.40890288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.47671285" y3="0.79307503" z3="4.73453471">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.50232055" y3="-0.79567331" z3="6.22415831">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33158085" y3="-0.64428424" z3="8.45257037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21648314" y3="-1.21982085" z3="8.78295732">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.18977728" y3="0.18350064" z3="9.18270418">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09297081" y3="-1.55642074" z3="8.53208992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.87568891" y3="-1.8159525" z3="9.59026065">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21873211" y3="-0.98270622" z3="8.16731769">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.24207366" y3="-2.84609658" z3="7.72516851">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.5395094" y3="-2.58910546" z3="6.69355185">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.0927474" y3="-3.42038997" z3="8.13387603">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="0.00423748" y3="-3.73543287" z3="7.68754979">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.26160629" y3="-4.69830919" z3="7.20950679">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.3164709" y3="-3.98448721" z3="8.72089066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.18659827" y3="-3.12469301" z3="6.93351576">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.56333372" y3="-2.21430189" z3="7.4320715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.02904786" y3="-3.83639743" z3="6.85769832">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.89144227" y3="-2.83587237" z3="5.90938769">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24861096" y3="-1.74036303" z3="6.56723969">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61806426" y3="-0.10539612" z3="7.08119111">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84963913" y3="0.52775734" z3="6.62576202">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4781407" y3="0.88395398" z3="7.66023672">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.41752792" y3="0.0493472" z3="8.38223316">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.25401748" y3="0.62410279" z3="6.91751234">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82777037" y3="1.77847264" z3="8.21158664">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.12557375" y3="1.12586636" z3="6.99463484">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82602787" y3="0.21766625" z3="6.4489468">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19908373" y3="1.94165018" z3="6.25510144">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.02702396" y3="1.47233259" z3="7.99200888">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.81405434" y3="0.61483632" z3="8.65440748">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37347771" y3="2.30354516" z3="8.64898366">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73122493" y3="1.95917457" z3="7.3527996">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.7069413" y3="2.57000377" z3="6.28784014">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90781697" y3="2.09627364" z3="8.09965643">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7773,.8509,3.8979;-1.0432,1.1832,2.8762;.301,1.0507,4.0484;-1.3418,1.4823,4.6077;-1.0927,-.6326,4.0901;-.8137,-.9339,5.1152;-.4618,-1.2309,3.4033;-2.5621,-.9919,3.8462;-2.6847,-2.0867,3.9497;-2.8105,-.7477,2.7927;-3.5805,-.3074,4.7716;-4.5927,-.5614,4.4089;-3.4767,.7931,4.7345;-3.5023,-.7957,6.2242;-2.3316,-.6443,8.4526;-3.2165,-1.2198,8.783;-2.1898,.1835,9.1827;-1.093,-1.5564,8.5321;-.8757,-1.816,9.5903;-.2187,-.9827,8.1673;-1.2421,-2.8461,7.7252;-1.5395,-2.5891,6.6936;-2.0927,-3.4204,8.1339;.0042,-3.7354,7.6875;-.2616,-4.6983,7.2095;.3165,-3.9845,8.7209;1.1866,-3.1247,6.9335;1.5633,-2.2143,7.4321;2.029,-3.8364,6.8577;.8914,-2.8359,5.9094;-4.2486,-1.7404,6.5672;-2.6181,-.1054,7.0812;-1.8496,.5278,6.6258;-7.4781,.884,7.6602;-7.4175,.0493,8.3822;-8.254,.6241,6.9175;-7.8278,1.7785,8.2116;-6.1256,1.1259,6.9946;-5.826,.2177,6.4489;-6.1991,1.9417,6.2551;-5.027,1.4723,7.992;-4.8141,.6148,8.6544;-5.3735,2.3035,8.649;-3.7312,1.9592,7.3528;-3.7069,2.57,6.2878;-2.9078,2.0963,8.0997;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724107134104</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001892650035 0.000454093764 0.027430990932 0.008507626942</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016567750 -0.000690237 0.000152325 0.000325449 0.000783704 0.001043569 0.001208342 0.001846823 0.002420578 0.002922239 0.003268182 0.003917257 0.004044116 0.004477654 0.005483643 0.006009796 0.006428094 0.007864531 0.008342636 0.009655545 0.010464464 0.011689344 0.013575280 0.015176124 0.019953174 0.021582683 0.024338118 0.025290180 0.030514795 0.034395246 0.035460456 0.038973654 0.043648586 0.043969585 0.044652321 0.048374102 0.049526306 0.050066092 0.050754724 0.051960214 0.052251824 0.052500799 0.053297307 0.055037840 0.056077933 0.057673644 0.058859084 0.060493430 0.062704670 0.062974628 0.066602358 0.070582492 0.072972406 0.076922765 0.078695235 0.079179140 0.079971249 0.084302232 0.084716550 0.092619272 0.096504506 0.099156399 0.104576097 0.105703184 0.109529985 0.111767521 0.114181722 0.116630308 0.117672863 0.120172087 0.131175538 0.137086330 0.140758508 0.145031564 0.147737703 0.154585321 0.155270290 0.167738526 0.173396853 0.175401144 0.181347983 0.191574590 0.197865532 0.204429118 0.211508276 0.217028433 0.224396165 0.240420583 0.257111924 0.267311873 0.315981709 0.324821215 0.357492844 0.363835036 0.422287967 0.456400441 0.507849636 0.548566352 0.566784587 0.615341585 0.631423383 0.644048891 0.688193428 0.741139289 0.747878322 0.749598995 0.759899361 0.761616409 0.771478674 0.773628610 0.785662590 0.792054777 0.799497756 0.804070331 0.814594172 0.816955962 0.822253262 0.831317155 0.836419576 0.860079663 0.872239002 0.877187805 0.879368912 0.894360274 0.900999409 0.909581602 0.916382083 0.922091962 0.925445552 0.980530435 1.298891868 1.492464355</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">79</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.78293221" y3="0.86260466" z3="3.88974153">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.05613621" y3="1.19470466" z3="2.87039552">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.29243625" y3="1.06964067" z3="4.03576045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.34734177" y3="1.48709574" z3="4.60213164">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.09279023" y3="-0.62181267" z3="4.08058996">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80994146" y3="-0.92436487" z3="5.10413973">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.46324969" y3="-1.2183834" z3="3.3909638">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56408806" y3="-0.98260052" z3="3.84027653">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68607749" y3="-2.07870857" z3="3.94111628">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.81705377" y3="-0.73604816" z3="2.78856004">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58174561" y3="-0.30386027" z3="4.76961185">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.59133072" y3="-0.56455521" z3="4.40934715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.48676229" y3="0.79530415" z3="4.7337927">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49865134" y3="-0.7924081" z3="6.221689">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32772941" y3="-0.63767262" z3="8.44957614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.2132421" y3="-1.2104605" z3="8.78271287">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.18240774" y3="0.190739" z3="9.17803722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09201837" y3="-1.55332319" z3="8.52848249">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.87445728" y3="-1.81171069" z3="9.58725682">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21595628" y3="-0.98288929" z3="8.161009">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.24671087" y3="-2.84474427" z3="7.72434803">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.53528588" y3="-2.58871517" z3="6.68901857">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.10523801" y3="-3.41117401" z3="8.12795487">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.00636445" y3="-3.74306078" z3="7.69767804">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27418006" y3="-4.70210663" z3="7.21560005">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.29899291" y3="-3.99460213" z3="8.73505503">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.18780048" y3="-3.13975146" z3="6.9545919">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.56848038" y3="-2.23485312" z3="7.45950249">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.02458397" y3="-3.85888533" z3="6.8835392">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.90072503" y3="-2.84593077" z3="5.92762264">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24177342" y3="-1.73887033" z3="6.56607269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.6161025" y3="-0.09873369" z3="7.07853832">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84603083" y3="0.53174378" z3="6.62103239">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.47172733" y3="0.87100418" z3="7.66616954">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.40449778" y3="0.03386564" z3="8.3855422">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.24856242" y3="0.60942825" z3="6.92399284">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82251282" y3="1.76254891" z3="8.22103482">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.1230055" y3="1.1205685" z3="6.99644608">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.82132386" y3="0.21500531" z3="6.44591193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20214497" y3="1.93888888" z3="6.25927435">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.02266827" y3="1.4697102" z3="7.99109386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.81061093" y3="0.61696469" z3="8.65812815">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36617475" y3="2.30467241" z3="8.64168721">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72665376" y3="1.95378008" z3="7.34728172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70654111" y3="2.56372928" z3="6.28124301">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90496631" y3="2.09868297" z3="8.09433759">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7829,.8626,3.8897;-1.0561,1.1947,2.8704;.2924,1.0696,4.0358;-1.3473,1.4871,4.6021;-1.0928,-.6218,4.0806;-.8099,-.9244,5.1041;-.4632,-1.2184,3.391;-2.5641,-.9826,3.8403;-2.6861,-2.0787,3.9411;-2.8171,-.736,2.7886;-3.5817,-.3039,4.7696;-4.5913,-.5646,4.4093;-3.4868,.7953,4.7338;-3.4987,-.7924,6.2217;-2.3277,-.6377,8.4496;-3.2132,-1.2105,8.7827;-2.1824,.1907,9.178;-1.092,-1.5533,8.5285;-.8745,-1.8117,9.5873;-.216,-.9829,8.161;-1.2467,-2.8447,7.7243;-1.5353,-2.5887,6.689;-2.1052,-3.4112,8.128;-.0064,-3.7431,7.6977;-.2742,-4.7021,7.2156;.299,-3.9946,8.7351;1.1878,-3.1398,6.9546;1.5685,-2.2349,7.4595;2.0246,-3.8589,6.8835;.9007,-2.8459,5.9276;-4.2418,-1.7389,6.5661;-2.6161,-.0987,7.0785;-1.846,.5317,6.621;-7.4717,.871,7.6662;-7.4045,.0339,8.3855;-8.2486,.6094,6.924;-7.8225,1.7625,8.221;-6.123,1.1206,6.9964;-5.8213,.215,6.4459;-6.2021,1.9389,6.2593;-5.0227,1.4697,7.9911;-4.8106,.617,8.6581;-5.3662,2.3047,8.6417;-3.7267,1.9538,7.3473;-3.7065,2.5637,6.2812;-2.905,2.0987,8.0943;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724117510216</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001604536087 0.000505974797 0.024585355965 0.008512590592</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016564474 -0.000566658 0.000151278 0.000331300 0.000771158 0.001040868 0.001209558 0.001866594 0.002431958 0.002916992 0.003260329 0.003918346 0.004043516 0.004485822 0.005497719 0.006006126 0.006447091 0.007860943 0.008348540 0.009655883 0.010465218 0.011721048 0.013593305 0.015175898 0.019993133 0.021578275 0.024390703 0.025347074 0.030551299 0.034476483 0.035526688 0.038978617 0.043659706 0.044021078 0.044653920 0.048384740 0.049526475 0.050092080 0.050755692 0.052008893 0.052251320 0.052500930 0.053300675 0.055039521 0.056091744 0.057689088 0.058865520 0.060506201 0.062725664 0.062985218 0.066602257 0.070577368 0.072977514 0.077010645 0.078700370 0.079187107 0.080025412 0.084313698 0.084720921 0.092645013 0.096506807 0.099157126 0.104585809 0.105707438 0.109530077 0.111769419 0.114182745 0.116633469 0.117675807 0.120174550 0.131176630 0.137096134 0.140771167 0.145032136 0.147759886 0.154625742 0.155277829 0.167752329 0.173420236 0.175423232 0.181366376 0.191636115 0.197869616 0.204432380 0.211551272 0.217152557 0.224404097 0.240528796 0.257139652 0.267465481 0.316028487 0.324839348 0.357499920 0.363842249 0.422289741 0.456664676 0.507986140 0.548575648 0.566886026 0.615372211 0.631541023 0.644137751 0.688357174 0.741231233 0.747924918 0.749601303 0.759918519 0.761666444 0.771487653 0.773629994 0.785709904 0.792059965 0.799503649 0.804089638 0.814617988 0.817154166 0.822253755 0.831404167 0.836422323 0.860121357 0.872247243 0.877191256 0.879378024 0.894364268 0.901009604 0.909671459 0.916589733 0.922107814 0.925578816 0.980547693 1.298963151 1.492485635</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">80</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.79061737" y3="0.87265986" z3="3.88029853">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.06456511" y3="1.20647904" z3="2.86079907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.28623309" y3="1.0794391" z3="4.02447678">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.3541282" y3="1.49826192" z3="4.59493791">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.09622591" y3="-0.61240315" z3="4.06966263">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80849905" y3="-0.91542474" z3="5.09169418">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.46742105" y3="-1.20447406" z3="3.37661984">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5651144" y3="-0.97865853" z3="3.83394698">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68167145" y3="-2.07391019" z3="3.93517124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.8213028" y3="-0.73304746" z3="2.78287203">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58133214" y3="-0.30026736" z3="4.76643417">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.59524734" y3="-0.55630218" z3="4.40825202">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.48156629" y3="0.800996" z3="4.73209522">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49567695" y3="-0.78969349" z3="6.21770421">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32678478" y3="-0.63098299" z3="8.4464502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21367078" y3="-1.20076557" z3="8.78119554">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.17828953" y3="0.19778832" z3="9.17373926">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09405545" y3="-1.55085067" z3="8.52662367">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88026231" y3="-1.81043305" z3="9.58546351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21527047" y3="-0.98369001" z3="8.1624141">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.25013585" y3="-2.84107135" z3="7.72195246">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.52654609" y3="-2.58346073" z3="6.68478455">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.11603547" y3="-3.40072174" z3="8.11815928">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.01611592" y3="-3.74849325" z3="7.70641786">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.28715085" y3="-4.70682319" z3="7.22316268">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.27508534" y3="-4.00219273" z3="8.74518131">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.1884421" y3="-3.15481354" z3="6.97412838">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.57259321" y3="-2.25462897" z3="7.48408784">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.01988939" y3="-3.88058102" z3="6.90694327">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.91422558" y3="-2.85560377" z3="5.9471359">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23455183" y3="-1.73839726" z3="6.56284253">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61609956" y3="-0.09080449" z3="7.07555876">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84396593" y3="0.5359203" z3="6.61694382">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4645455" y3="0.85611776" z3="7.67345969">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.39004611" y3="0.02060698" z3="8.39298058">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.24189236" y3="0.58893589" z3="6.93438771">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82063448" y3="1.74525302" z3="8.22914629">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11885644" y3="1.11424096" z3="7.00001859">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.81424759" y3="0.21006613" z3="6.45062143">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20511896" y3="1.9303021" z3="6.26215376">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.01719183" y3="1.47052058" z3="7.99053793">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.80302869" y3="0.61953121" z3="8.66088618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36292073" y3="2.30763408" z3="8.64046123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72242546" y3="1.95055536" z3="7.34188506">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70627185" y3="2.56142999" z3="6.27474958">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90095462" y3="2.1022131" z3="8.08845049">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7906,.8727,3.8803;-1.0646,1.2065,2.8608;.2862,1.0794,4.0245;-1.3541,1.4983,4.5949;-1.0962,-.6124,4.0697;-.8085,-.9154,5.0917;-.4674,-1.2045,3.3766;-2.5651,-.9787,3.8339;-2.6817,-2.0739,3.9352;-2.8213,-.733,2.7829;-3.5813,-.3003,4.7664;-4.5952,-.5563,4.4083;-3.4816,.801,4.7321;-3.4957,-.7897,6.2177;-2.3268,-.631,8.4465;-3.2137,-1.2008,8.7812;-2.1783,.1978,9.1737;-1.0941,-1.5509,8.5266;-.8803,-1.8104,9.5855;-.2153,-.9837,8.1624;-1.2501,-2.8411,7.722;-1.5265,-2.5835,6.6848;-2.116,-3.4007,8.1182;-.0161,-3.7485,7.7064;-.2872,-4.7068,7.2232;.2751,-4.0022,8.7452;1.1884,-3.1548,6.9741;1.5726,-2.2546,7.4841;2.0199,-3.8806,6.9069;.9142,-2.8556,5.9471;-4.2346,-1.7384,6.5628;-2.6161,-.0908,7.0756;-1.844,.5359,6.6169;-7.4645,.8561,7.6735;-7.39,.0206,8.393;-8.2419,.5889,6.9344;-7.8206,1.7453,8.2291;-6.1189,1.1142,7;-5.8142,.2101,6.4506;-6.2051,1.9303,6.2622;-5.0172,1.4705,7.9905;-4.803,.6195,8.6609;-5.3629,2.3076,8.6405;-3.7224,1.9506,7.3419;-3.7063,2.5614,6.2747;-2.901,2.1022,8.0885;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724128786719</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001752144991 0.000432590778 0.036481347930 0.008514434925</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016486504 -0.000555946 0.000165885 0.000334976 0.000793016 0.001041004 0.001217216 0.001863971 0.002441387 0.002941546 0.003264464 0.003925984 0.004044647 0.004516852 0.005534758 0.006016763 0.006468856 0.007860112 0.008347912 0.009659488 0.010465132 0.011739697 0.013640165 0.015180338 0.020024082 0.021575606 0.024441718 0.025410577 0.030594761 0.034531568 0.035588169 0.038985161 0.043667541 0.044071114 0.044652664 0.048398363 0.049526503 0.050128999 0.050757828 0.052044783 0.052251337 0.052502598 0.053299605 0.055040626 0.056144100 0.057681294 0.058881974 0.060554181 0.062736241 0.062985356 0.066602002 0.070588022 0.072977952 0.077084096 0.078712296 0.079197769 0.080060532 0.084317974 0.084729097 0.092673875 0.096507249 0.099158008 0.104599363 0.105718075 0.109532100 0.111770734 0.114182506 0.116645235 0.117675809 0.120186177 0.131190754 0.137094512 0.140769922 0.145032311 0.147762200 0.154663927 0.155286015 0.167750797 0.173422806 0.175419901 0.181369285 0.191663957 0.197872750 0.204435143 0.211579828 0.217198834 0.224410985 0.240568583 0.257143565 0.267527609 0.316041034 0.324858702 0.357506616 0.363843299 0.422297970 0.456927061 0.508177310 0.548587599 0.567105366 0.615476055 0.631596192 0.644170102 0.688528104 0.741530304 0.748023809 0.749602227 0.759999828 0.761666827 0.771491010 0.773655131 0.785746252 0.792060900 0.799507958 0.804089856 0.814634608 0.817183200 0.822255290 0.831488370 0.836443633 0.860221326 0.872253495 0.877209624 0.879388289 0.894365798 0.901020964 0.909678542 0.916702586 0.922111929 0.925652738 0.980590569 1.299046410 1.492486718</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">81</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.79194153" y3="0.88118341" z3="3.86863006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.0729469" y3="1.21469884" z3="2.85197929">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.28454778" y3="1.08913649" z3="4.00686077">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.3526817" y3="1.50402677" z3="4.58669458">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.09815628" y3="-0.60461782" z3="4.05864707">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81112161" y3="-0.90923332" z3="5.08114027">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47015143" y3="-1.19948241" z3="3.36495953">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.56978355" y3="-0.96669896" z3="3.82395767">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.69061086" y3="-2.06366294" z3="3.92166502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.8277161" y3="-0.71628833" z3="2.77419805">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58359416" y3="-0.29266131" z3="4.76046425">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.59384965" y3="-0.5532702" z3="4.40392045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.49022851" y3="0.80647038" z3="4.72899602">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49396766" y3="-0.78704293" z3="6.21004446">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.3289485" y3="-0.63106301" z3="8.44075856">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21656005" y3="-1.20074425" z3="8.77340532">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.18168407" y3="0.19704858" z3="9.16894979">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09714067" y3="-1.55143539" z3="8.52363924">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88649113" y3="-1.81102492" z3="9.58352148">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21648761" y3="-0.98499918" z3="8.16135774">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.25180762" y3="-2.84225782" z3="7.71901817">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.51848844" y3="-2.58524101" z3="6.67823044">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.12363453" y3="-3.39799266" z3="8.10781096">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02133489" y3="-3.75409935" z3="7.71744916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29056192" y3="-4.71239146" z3="7.2331622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.26121039" y3="-4.00604602" z3="8.76110144">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.19343419" y3="-3.16515295" z3="6.99753872">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.57461039" y3="-2.26521824" z3="7.5104444">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.02206925" y3="-3.89428282" z3="6.94342462">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.93195521" y3="-2.86754369" z3="5.9660678">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23011013" y3="-1.73917078" z3="6.55201244">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61602474" y3="-0.08916496" z3="7.07018775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84306385" y3="0.53756964" z3="6.61284917">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4579367" y3="0.84667321" z3="7.68396249">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37645153" y3="0.01312309" z3="8.40603146">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23616571" y3="0.57324495" z3="6.94797504">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.81604242" y3="1.73597909" z3="8.23738631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11597356" y3="1.10777538" z3="7.00558628">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80901293" y3="0.20307687" z3="6.45743916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20758515" y3="1.92190518" z3="6.26547426">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.01340701" y3="1.47159431" z3="7.9924186">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.79746783" y3="0.62697232" z3="8.66898864">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.3578949" y3="2.31300875" z3="8.63460049">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71986186" y3="1.95142731" z3="7.33899586">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70782044" y3="2.56210411" z3="6.27224211">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.89708789" y3="2.10422427" z3="8.08370064">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7919,.8812,3.8686;-1.0729,1.2147,2.852;.2845,1.0891,4.0069;-1.3527,1.504,4.5867;-1.0982,-.6046,4.0586;-.8111,-.9092,5.0811;-.4702,-1.1995,3.365;-2.5698,-.9667,3.824;-2.6906,-2.0637,3.9217;-2.8277,-.7163,2.7742;-3.5836,-.2927,4.7605;-4.5938,-.5533,4.4039;-3.4902,.8065,4.729;-3.494,-.787,6.21;-2.3289,-.6311,8.4408;-3.2166,-1.2007,8.7734;-2.1817,.197,9.1689;-1.0971,-1.5514,8.5236;-.8865,-1.811,9.5835;-.2165,-.985,8.1614;-1.2518,-2.8423,7.719;-1.5185,-2.5852,6.6782;-2.1236,-3.398,8.1078;-.0213,-3.7541,7.7174;-.2906,-4.7124,7.2332;.2612,-4.006,8.7611;1.1934,-3.1652,6.9975;1.5746,-2.2652,7.5104;2.0221,-3.8943,6.9434;.932,-2.8675,5.9661;-4.2301,-1.7392,6.552;-2.616,-.0892,7.0702;-1.8431,.5376,6.6128;-7.4579,.8467,7.684;-7.3765,.0131,8.406;-8.2362,.5732,6.948;-7.816,1.736,8.2374;-6.116,1.1078,7.0056;-5.809,.2031,6.4574;-6.2076,1.9219,6.2655;-5.0134,1.4716,7.9924;-4.7975,.627,8.669;-5.3579,2.313,8.6346;-3.7199,1.9514,7.339;-3.7078,2.5621,6.2722;-2.8971,2.1042,8.0837;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724129485711</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002114272223 0.000513375038 0.033851658623 0.008515961673</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016319375 -0.000557709 0.000190077 0.000336079 0.000776845 0.001043045 0.001217674 0.001863524 0.002441095 0.002946792 0.003318139 0.003953816 0.004048656 0.004567404 0.005561809 0.006062017 0.006485787 0.007860264 0.008350566 0.009662650 0.010466736 0.011751130 0.013701712 0.015183766 0.020028571 0.021572722 0.024494756 0.025531070 0.030620917 0.034614816 0.035635291 0.038994857 0.043692402 0.044113513 0.044652390 0.048404811 0.049529747 0.050182450 0.050757424 0.052101052 0.052252911 0.052504725 0.053299801 0.055042319 0.056139501 0.057749157 0.058943017 0.060585132 0.062745690 0.062987091 0.066603242 0.070584399 0.072984796 0.077094829 0.078709519 0.079201409 0.080058964 0.084318080 0.084742868 0.092694641 0.096509892 0.099159256 0.104614825 0.105729691 0.109533428 0.111774527 0.114182688 0.116650549 0.117676879 0.120191402 0.131229574 0.137100229 0.140774230 0.145032311 0.147764501 0.154700998 0.155291894 0.167751349 0.173441507 0.175509052 0.181377079 0.191675923 0.197873637 0.204436250 0.211648974 0.217201642 0.224419546 0.240630336 0.257147162 0.267632746 0.316085051 0.324866051 0.357534307 0.363852077 0.422325218 0.457121927 0.508598920 0.548602548 0.567192926 0.615473967 0.631643714 0.644432692 0.688792740 0.741614991 0.748206824 0.749603318 0.760136168 0.761756951 0.771494872 0.773657340 0.785745943 0.792061031 0.799554655 0.804126608 0.814642897 0.817330495 0.822256024 0.831491226 0.836466481 0.860223409 0.872254152 0.877225730 0.879389404 0.894387221 0.901057400 0.909685182 0.916740582 0.922112454 0.925745416 0.980594431 1.299137898 1.492493323</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">82</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.79724911" y3="0.88617847" z3="3.86228661">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.07845329" y3="1.22695685" z3="2.84701812">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.28106767" y3="1.0910286" z3="4.00049357">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.3554057" y3="1.50679682" z3="4.58437048">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10286545" y3="-0.59979791" z3="4.04304749">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80901144" y3="-0.90996914" z3="5.06072775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47850526" y3="-1.18609051" z3="3.34243308">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5732741" y3="-0.96341199" z3="3.81163571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68992043" y3="-2.05878159" z3="3.90533875">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.83452534" y3="-0.70972414" z3="2.76369684">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58359762" y3="-0.28993909" z3="4.75371411">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60053143" y3="-0.54076088" z3="4.39852309">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.48198241" y3="0.81160128" z3="4.72587719">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49346555" y3="-0.78890634" z3="6.20163916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33235288" y3="-0.63345308" z3="8.43481829">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22113127" y3="-1.20317928" z3="8.76460337">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.18808974" y3="0.19532823" z3="9.16295996">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10062488" y3="-1.55328087" z3="8.52334201">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89443091" y3="-1.8123889" z3="9.584161">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.21871781" y3="-0.98672892" z3="8.16450214">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.25198703" y3="-2.84407432" z3="7.71831336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.50820439" y3="-2.58644421" z3="6.67549884">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.12882972" y3="-3.39696507" z3="8.09952839">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02366495" y3="-3.75907232" z3="7.72751625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.28956259" y3="-4.71429044" z3="7.23677057">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.24530749" y3="-4.01574248" z3="8.77207625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.19989646" y3="-3.17132295" z3="7.02193916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.5816734" y3="-2.27699219" z3="7.54429606">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.02723261" y3="-3.90322811" z3="6.96623616">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.94551041" y3="-2.86506452" z3="5.99056847">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23000292" y3="-1.74163508" z3="6.54128144">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61570174" y3="-0.09278323" z3="7.06303856">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84389414" y3="0.53745856" z3="6.6080031">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45305244" y3="0.84075426" z3="7.69459542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36942176" y3="0.01448204" z3="8.4235721">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23078365" y3="0.55844773" z3="6.9612505">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.81413949" y3="1.73341293" z3="8.24132978">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11232369" y3="1.10137521" z3="7.0128617">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80286532" y3="0.19311185" z3="6.47245087">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20776252" y3="1.90869416" z3="6.26635634">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00935304" y3="1.47734843" z3="7.99479975">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.78727515" y3="0.63720928" z3="8.67606269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35735678" y3="2.32111395" z3="8.63443331">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72021565" y3="1.95791927" z3="7.3361411">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71226569" y3="2.56784703" z3="6.26884369">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.89185962" y3="2.10741887" z3="8.07493568">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7972,.8862,3.8623;-1.0785,1.227,2.847;.2811,1.091,4.0005;-1.3554,1.5068,4.5844;-1.1029,-.5998,4.043;-.809,-.91,5.0607;-.4785,-1.1861,3.3424;-2.5733,-.9634,3.8116;-2.6899,-2.0588,3.9053;-2.8345,-.7097,2.7637;-3.5836,-.2899,4.7537;-4.6005,-.5408,4.3985;-3.482,.8116,4.7259;-3.4935,-.7889,6.2016;-2.3324,-.6335,8.4348;-3.2211,-1.2032,8.7646;-2.1881,.1953,9.163;-1.1006,-1.5533,8.5233;-.8944,-1.8124,9.5842;-.2187,-.9867,8.1645;-1.252,-2.8441,7.7183;-1.5082,-2.5864,6.6755;-2.1288,-3.397,8.0995;-.0237,-3.7591,7.7275;-.2896,-4.7143,7.2368;.2453,-4.0157,8.7721;1.1999,-3.1713,7.0219;1.5817,-2.277,7.5443;2.0272,-3.9032,6.9662;.9455,-2.8651,5.9906;-4.23,-1.7416,6.5413;-2.6157,-.0928,7.063;-1.8439,.5375,6.608;-7.4531,.8408,7.6946;-7.3694,.0145,8.4236;-8.2308,.5584,6.9613;-7.8141,1.7334,8.2413;-6.1123,1.1014,7.0129;-5.8029,.1931,6.4725;-6.2078,1.9087,6.2664;-5.0094,1.4773,7.9948;-4.7873,.6372,8.6761;-5.3574,2.3211,8.6344;-3.7202,1.9579,7.3361;-3.7123,2.5678,6.2688;-2.8919,2.1074,8.0749;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724125277186</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002455454989 0.000500169459 0.035096173169 0.008518594135</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016182030 -0.000764321 0.000214176 0.000348935 0.000777841 0.001040606 0.001224542 0.001869379 0.002446813 0.002946418 0.003420873 0.003967644 0.004083260 0.004655421 0.005574825 0.006130442 0.006507088 0.007875025 0.008363509 0.009663296 0.010466247 0.011751622 0.013770765 0.015193676 0.020028307 0.021571050 0.024539278 0.025638112 0.030651187 0.034731238 0.035688009 0.039004091 0.043725474 0.044171396 0.044652929 0.048405699 0.049533721 0.050218214 0.050756322 0.052142778 0.052258780 0.052506323 0.053300469 0.055045281 0.056140949 0.057764481 0.059008604 0.060700960 0.062749064 0.063017789 0.066604089 0.070586839 0.072985182 0.077095298 0.078717731 0.079201362 0.080059435 0.084319003 0.084747973 0.092717204 0.096512063 0.099159817 0.104649244 0.105753685 0.109544292 0.111785215 0.114186615 0.116650824 0.117683098 0.120200523 0.131303301 0.137099871 0.140772822 0.145032004 0.147767220 0.154711360 0.155293038 0.167751565 0.173440553 0.175519436 0.181379486 0.191686285 0.197881953 0.204438992 0.211690088 0.217203510 0.224473395 0.240632705 0.257184594 0.267671705 0.316084459 0.324899368 0.357604686 0.363862519 0.422409659 0.457324562 0.509255419 0.548610091 0.567339433 0.615492311 0.631664170 0.644514097 0.689136347 0.741707636 0.748508459 0.749603746 0.760366193 0.761755295 0.771504048 0.773684321 0.785753740 0.792065500 0.799570602 0.804128981 0.814642840 0.817337516 0.822256585 0.831538613 0.836531070 0.860228223 0.872316881 0.877248063 0.879390606 0.894488422 0.901068685 0.909696779 0.916749154 0.922120041 0.925746470 0.980604063 1.299280676 1.492492901</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">83</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.79906251" y3="0.8929503" z3="3.85602625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.08177334" y3="1.23516746" z3="2.84226545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.27696123" y3="1.10101516" z3="3.994392">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.35872631" y3="1.51006974" z3="4.58020259">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10379621" y3="-0.59417405" z3="4.03501239">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81447219" y3="-0.9070262" z3="5.05489423">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47756438" y3="-1.18354511" z3="3.33450687">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57547488" y3="-0.95561162" z3="3.80227132">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.69552129" y3="-2.05314838" z3="3.89397997">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.8362164" y3="-0.69940103" z3="2.75462421">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58640496" y3="-0.287582" z3="4.74620596">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.59783668" y3="-0.5450392" z3="4.39121199">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.49243557" y3="0.81161155" z3="4.72021615">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49429059" y3="-0.79136107" z3="6.19291505">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33734954" y3="-0.64041569" z3="8.42841911">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22745344" y3="-1.21053927" z3="8.75418845">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.1966834" y3="0.18846292" z3="9.15749708">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10532057" y3="-1.55933588" z3="8.52270338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90682151" y3="-1.82225051" z3="9.58365283">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22155502" y3="-0.990948" z3="8.17274103">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.24906771" y3="-2.84676" z3="7.71194929">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.49550004" y3="-2.5850983" z3="6.66743631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.12998431" y3="-3.40036213" z3="8.08301165">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02200779" y3="-3.7631788" z3="7.73208697">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.28490947" y3="-4.71925459" z3="7.23859048">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.23491479" y3="-4.02075451" z3="8.77964819">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.20990797" y3="-3.17558538" z3="7.04098896">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.58266743" y3="-2.27918497" z3="7.5662029">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.03709897" y3="-3.90723951" z3="7.00133233">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.97127856" y3="-2.87276116" z3="6.00523289">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23169898" y3="-1.74566819" z3="6.52878566">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61515577" y3="-0.10091013" z3="7.05556225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84578854" y3="0.53450959" z3="6.60401216">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4499799" y3="0.8436991" z3="7.70761852">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36403293" y3="0.02621958" z3="8.44742498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22861317" y3="0.55156011" z3="6.97967726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.81010202" y3="1.74333577" z3="8.24262739">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11078039" y3="1.09519322" z3="7.02035535">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80122737" y3="0.18022176" z3="6.49168779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20775798" y3="1.89321233" z3="6.26401554">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00744447" y3="1.48406573" z3="7.99675932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.77892926" y3="0.65111384" z3="8.68401496">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35672286" y3="2.33127809" z3="8.63014923">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72254465" y3="1.96838669" z3="7.33222181">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71814843" y3="2.57381819" z3="6.26420215">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88764294" y3="2.11170078" z3="8.06436761">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.7991,.893,3.856;-1.0818,1.2352,2.8423;.277,1.101,3.9944;-1.3587,1.5101,4.5802;-1.1038,-.5942,4.035;-.8145,-.907,5.0549;-.4776,-1.1835,3.3345;-2.5755,-.9556,3.8023;-2.6955,-2.0531,3.894;-2.8362,-.6994,2.7546;-3.5864,-.2876,4.7462;-4.5978,-.545,4.3912;-3.4924,.8116,4.7202;-3.4943,-.7914,6.1929;-2.3373,-.6404,8.4284;-3.2275,-1.2105,8.7542;-2.1967,.1885,9.1575;-1.1053,-1.5593,8.5227;-.9068,-1.8223,9.5837;-.2216,-.9909,8.1727;-1.2491,-2.8468,7.7119;-1.4955,-2.5851,6.6674;-2.13,-3.4004,8.083;-.022,-3.7632,7.7321;-.2849,-4.7193,7.2386;.2349,-4.0208,8.7796;1.2099,-3.1756,7.041;1.5827,-2.2792,7.5662;2.0371,-3.9072,7.0013;.9713,-2.8728,6.0052;-4.2317,-1.7457,6.5288;-2.6152,-.1009,7.0556;-1.8458,.5345,6.604;-7.45,.8437,7.7076;-7.364,.0262,8.4474;-8.2286,.5516,6.9797;-7.8101,1.7433,8.2426;-6.1108,1.0952,7.0204;-5.8012,.1802,6.4917;-6.2078,1.8932,6.264;-5.0074,1.4841,7.9968;-4.7789,.6511,8.684;-5.3567,2.3313,8.6301;-3.7225,1.9684,7.3322;-3.7181,2.5738,6.2642;-2.8876,2.1117,8.0644;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724128243599</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002652776097 0.000488231169 0.028087847887 0.008517565547</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016147216 -0.000728181 0.000233556 0.000344236 0.000786132 0.001042457 0.001229042 0.001883349 0.002458058 0.002946037 0.003487015 0.003976844 0.004106206 0.004678961 0.005580357 0.006148821 0.006511852 0.007875660 0.008362916 0.009668718 0.010466174 0.011757073 0.013823762 0.015191940 0.020028161 0.021570302 0.024581080 0.025740843 0.030656115 0.034838082 0.035741905 0.039017629 0.043759903 0.044239645 0.044653648 0.048406540 0.049551433 0.050247254 0.050759801 0.052171482 0.052262246 0.052511725 0.053303051 0.055045184 0.056140144 0.057828743 0.059063537 0.060800826 0.062754468 0.063063948 0.066610026 0.070592376 0.072986988 0.077102050 0.078756230 0.079203038 0.080065062 0.084335225 0.084752853 0.092718546 0.096517703 0.099162833 0.104656954 0.105777649 0.109543925 0.111804103 0.114190766 0.116651533 0.117700593 0.120203046 0.131359549 0.137100219 0.140775988 0.145031685 0.147770392 0.154754187 0.155293244 0.167752982 0.173458881 0.175572821 0.181379365 0.191685710 0.197930569 0.204442636 0.211729848 0.217209038 0.224486151 0.240652540 0.257201059 0.267703676 0.316115260 0.324917366 0.357622484 0.363901998 0.422464104 0.457468744 0.510058256 0.548625779 0.567378069 0.615494855 0.631675520 0.644685372 0.689569377 0.741749271 0.748793045 0.749605924 0.760547745 0.761757515 0.771513011 0.773698212 0.785802997 0.792080359 0.799571824 0.804163945 0.814646532 0.817340622 0.822262558 0.831585257 0.836569218 0.860265215 0.872398624 0.877275918 0.879392665 0.894550609 0.901073683 0.909707143 0.916773094 0.922148832 0.925753626 0.980611086 1.299338424 1.492493083</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">84</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.80763453" y3="0.90071703" z3="3.85663288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.09180117" y3="1.24591021" z3="2.84420892">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.26999178" y3="1.10953135" z3="3.99476091">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.36813487" y3="1.51410301" z3="4.58347427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10641018" y3="-0.58818562" z3="4.0288969">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81230445" y3="-0.90272369" z3="5.04532974">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.4784192" y3="-1.16739172" z3="3.32498188">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57515855" y3="-0.95688094" z3="3.7952926">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68724261" y3="-2.05325591" z3="3.88407258">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.83687199" y3="-0.69910499" z3="2.74835413">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.58823172" y3="-0.2930846" z3="4.74086358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6035419" y3="-0.54690093" z3="4.38488914">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.491904" y3="0.80851296" z3="4.71641898">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49698221" y3="-0.79914408" z3="6.18698815">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33935078" y3="-0.6501627" z3="8.42233119">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22953512" y3="-1.22156963" z3="8.7456252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.20250522" y3="0.17971912" z3="9.15117956">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10591806" y3="-1.56645272" z3="8.52131005">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91083401" y3="-1.82981034" z3="9.58337053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22153935" y3="-0.99571402" z3="8.17445108">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.24490731" y3="-2.85325905" z3="7.70755483">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.48263128" y3="-2.58948054" z3="6.66134216">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.1293059" y3="-3.40695021" z3="8.07029237">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.01836532" y3="-3.76998008" z3="7.73584457">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27463882" y3="-4.72123272" z3="7.23273985">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.22712321" y3="-4.03405379" z3="8.78425313">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.22103834" y3="-3.1788999" z3="7.06078395">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.59015017" y3="-2.28526379" z3="7.59429074">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05042273" y3="-3.90959457" z3="7.02182221">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.98940706" y3="-2.87012993" z3="6.02393163">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23872114" y3="-1.7512513" z3="6.52203533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61390314" y3="-0.11464247" z3="7.04773173">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84953393" y3="0.52878189" z3="6.59876718">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45091825" y3="0.85351132" z3="7.71782298">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36809102" y3="0.04809782" z3="8.47044923">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22995556" y3="0.55196778" z3="6.99385539">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.8092659" y3="1.76239398" z3="8.239638">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11142132" y3="1.0925884" z3="7.02623456">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80238124" y3="0.16961828" z3="6.50927379">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20762345" y3="1.88107404" z3="6.25931342">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00727098" y3="1.49344765" z3="7.99708009">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.77113257" y3="0.66600673" z3="8.68860168">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35816755" y3="2.34293948" z3="8.62663243">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72832374" y3="1.9808493" z3="7.32715066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72656249" y3="2.5799814" z3="6.25679071">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88466129" y3="2.11582472" z3="8.05022336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8076,.9007,3.8566;-1.0918,1.2459,2.8442;.27,1.1095,3.9948;-1.3681,1.5141,4.5835;-1.1064,-.5882,4.0289;-.8123,-.9027,5.0453;-.4784,-1.1674,3.325;-2.5752,-.9569,3.7953;-2.6872,-2.0533,3.8841;-2.8369,-.6991,2.7484;-3.5882,-.2931,4.7409;-4.6035,-.5469,4.3849;-3.4919,.8085,4.7164;-3.497,-.7991,6.187;-2.3394,-.6502,8.4223;-3.2295,-1.2216,8.7456;-2.2025,.1797,9.1512;-1.1059,-1.5665,8.5213;-.9108,-1.8298,9.5834;-.2215,-.9957,8.1745;-1.2449,-2.8533,7.7076;-1.4826,-2.5895,6.6613;-2.1293,-3.407,8.0703;-.0184,-3.77,7.7358;-.2746,-4.7212,7.2327;.2271,-4.0341,8.7843;1.221,-3.1789,7.0608;1.5902,-2.2853,7.5943;2.0504,-3.9096,7.0218;.9894,-2.8701,6.0239;-4.2387,-1.7513,6.522;-2.6139,-.1146,7.0477;-1.8495,.5288,6.5988;-7.4509,.8535,7.7178;-7.3681,.0481,8.4704;-8.23,.552,6.9939;-7.8093,1.7624,8.2396;-6.1114,1.0926,7.0262;-5.8024,.1696,6.5093;-6.2076,1.8811,6.2593;-5.0073,1.4934,7.9971;-4.7711,.666,8.6886;-5.3582,2.3429,8.6266;-3.7283,1.9808,7.3272;-3.7266,2.58,6.2568;-2.8847,2.1158,8.0502;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724139203843</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002160484549 0.000411105544 0.027065160399 0.008514049435</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016207462 -0.000366012 0.000213146 0.000346323 0.000791808 0.001043184 0.001221652 0.001889014 0.002466245 0.002968798 0.003513498 0.003973708 0.004138631 0.004711236 0.005582652 0.006155652 0.006514428 0.007882698 0.008369321 0.009668431 0.010467607 0.011756856 0.013848582 0.015193621 0.020029102 0.021571691 0.024618262 0.025775260 0.030656090 0.034934584 0.035796065 0.039026995 0.043795531 0.044277051 0.044657701 0.048406654 0.049557099 0.050261347 0.050758368 0.052185549 0.052268293 0.052511045 0.053305997 0.055048961 0.056155090 0.057854380 0.059137833 0.060892617 0.062754639 0.063083896 0.066616474 0.070594813 0.072987300 0.077106212 0.078806696 0.079203016 0.080065758 0.084340451 0.084755963 0.092720195 0.096518939 0.099164106 0.104672450 0.105787502 0.109549854 0.111825656 0.114195660 0.116652764 0.117708637 0.120203342 0.131387507 0.137101397 0.140775385 0.145031521 0.147772928 0.154769616 0.155293322 0.167753313 0.173481133 0.175580306 0.181384779 0.191685609 0.197967448 0.204455810 0.211729277 0.217221387 0.224525424 0.240681806 0.257276556 0.267720761 0.316120625 0.324965485 0.357636331 0.363903120 0.422611849 0.457556566 0.510689299 0.548642402 0.567394725 0.615509455 0.631691399 0.644815359 0.689866502 0.741748238 0.748975047 0.749606089 0.760639034 0.761761325 0.771538313 0.773702269 0.785825782 0.792112892 0.799577830 0.804178955 0.814655924 0.817343145 0.822277516 0.831667331 0.836596946 0.860327915 0.872427153 0.877279630 0.879408887 0.894609099 0.901073817 0.909717581 0.916853571 0.922171577 0.925759408 0.980608699 1.299395038 1.492496775</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">85</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.81552066" y3="0.90985665" z3="3.8570658">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.09827919" y3="1.2570708" z3="2.84472217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.25816381" y3="1.12691654" z3="4.00051881">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.38250252" y3="1.51667577" z3="4.58368105">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10647078" y3="-0.58100594" z3="4.0252459">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81306188" y3="-0.89733608" z3="5.04214752">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47563124" y3="-1.15880236" z3="3.32005142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57454655" y3="-0.95576439" z3="3.79153797">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68343588" y3="-2.05420113" z3="3.8798045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.83755211" y3="-0.69948245" z3="2.74466005">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59178069" y3="-0.29910047" z3="4.73744475">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60219334" y3="-0.56237752" z3="4.38142811">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.50493331" y3="0.80140124" z3="4.71230768">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49842082" y3="-0.80517129" z3="6.18387816">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33921349" y3="-0.65734003" z3="8.41817729">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.23035435" y3="-1.22785512" z3="8.74085356">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.2030055" y3="0.17358753" z3="9.14624581">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10594521" y3="-1.57389951" z3="8.52045347">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91778082" y3="-1.84323372" z3="9.58161085">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.22009649" y3="-1.00114168" z3="8.18304389">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23887029" y3="-2.85548819" z3="7.69886247">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.46612426" y3="-2.58505364" z3="6.65210395">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.12809102" y3="-3.40894921" z3="8.05030019">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.0147376" y3="-3.77539332" z3="7.73474804">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.26903818" y3="-4.72495533" z3="7.22518294">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.21817076" y3="-4.04540052" z3="8.7838802">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.2326651" y3="-3.1840943" z3="7.07579785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.59323338" y3="-2.29048453" z3="7.61411843">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06151633" y3="-3.91507665" z3="7.04888737">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.01456338" y3="-2.87591942" z3="6.03621459">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24255547" y3="-1.75614973" z3="6.5195552">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.61143697" y3="-0.12516873" z3="7.04224277">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85170118" y3="0.52470211" z3="6.59486439">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45285687" y3="0.86586864" z3="7.7251544">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37311908" y3="0.0715006" z3="8.49035732">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2325045" y3="0.55548184" z3="7.00581946">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.8079948" y3="1.78421233" z3="8.23197867">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11184627" y3="1.08940535" z3="7.0308752">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80592271" y3="0.15792385" z3="6.5288703">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20501308" y3="1.86651966" z3="6.25274832">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00697626" y3="1.50068259" z3="7.99664648">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7635848" y3="0.67753289" z3="8.69073388">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36020648" y3="2.35125285" z3="8.62460201">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73280353" y3="1.99238432" z3="7.32175048">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73354901" y3="2.58454974" z3="6.24910657">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88262442" y3="2.12177618" z3="8.03760801">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8155,.9099,3.8571;-1.0983,1.2571,2.8447;.2582,1.1269,4.0005;-1.3825,1.5167,4.5837;-1.1065,-.581,4.0252;-.8131,-.8973,5.0421;-.4756,-1.1588,3.3201;-2.5745,-.9558,3.7915;-2.6834,-2.0542,3.8798;-2.8376,-.6995,2.7447;-3.5918,-.2991,4.7374;-4.6022,-.5624,4.3814;-3.5049,.8014,4.7123;-3.4984,-.8052,6.1839;-2.3392,-.6573,8.4182;-3.2304,-1.2279,8.7409;-2.203,.1736,9.1462;-1.1059,-1.5739,8.5205;-.9178,-1.8432,9.5816;-.2201,-1.0011,8.183;-1.2389,-2.8555,7.6989;-1.4661,-2.5851,6.6521;-2.1281,-3.4089,8.0503;-.0147,-3.7754,7.7347;-.269,-4.725,7.2252;.2182,-4.0454,8.7839;1.2327,-3.1841,7.0758;1.5932,-2.2905,7.6141;2.0615,-3.9151,7.0489;1.0146,-2.8759,6.0362;-4.2426,-1.7561,6.5196;-2.6114,-.1252,7.0422;-1.8517,.5247,6.5949;-7.4529,.8659,7.7252;-7.3731,.0715,8.4904;-8.2325,.5555,7.0058;-7.808,1.7842,8.232;-6.1118,1.0894,7.0309;-5.8059,.1579,6.5289;-6.205,1.8665,6.2527;-5.007,1.5007,7.9966;-4.7636,.6775,8.6907;-5.3602,2.3513,8.6246;-3.7328,1.9924,7.3218;-3.7335,2.5845,6.2491;-2.8826,2.1218,8.0376;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724148247081</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001566717660 0.000334147356 0.028375968670 0.008518076351</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016184003 -0.000131439 0.000232214 0.000384281 0.000785742 0.001066438 0.001225159 0.001895448 0.002487005 0.002969060 0.003524527 0.003972380 0.004159156 0.004715610 0.005583008 0.006154431 0.006517436 0.007880464 0.008371958 0.009669268 0.010467305 0.011756977 0.013853742 0.015193987 0.020028885 0.021570875 0.024633054 0.025789844 0.030656055 0.034987416 0.035850799 0.039034519 0.043805800 0.044298542 0.044663725 0.048410742 0.049560543 0.050267127 0.050758363 0.052192428 0.052268567 0.052511615 0.053307726 0.055049494 0.056163936 0.057859239 0.059139772 0.060958443 0.062758056 0.063105571 0.066620282 0.070598044 0.072988238 0.077108469 0.078827069 0.079204033 0.080065782 0.084345303 0.084769462 0.092720991 0.096519854 0.099168021 0.104677894 0.105795492 0.109550135 0.111838505 0.114198191 0.116652647 0.117729280 0.120203677 0.131394367 0.137103650 0.140775724 0.145032098 0.147779501 0.154781363 0.155294360 0.167758309 0.173517923 0.175582209 0.181386180 0.191687086 0.198021469 0.204456285 0.211737957 0.217225038 0.224541934 0.240688047 0.257274282 0.267737988 0.316138644 0.324997084 0.357635592 0.363906380 0.422636857 0.457619075 0.511028333 0.548642770 0.567402991 0.615509297 0.631798635 0.644825327 0.690044457 0.741746661 0.749067814 0.749608148 0.760688529 0.761797005 0.771560792 0.773710569 0.785832587 0.792120827 0.799628993 0.804208833 0.814655574 0.817373859 0.822290563 0.831825648 0.836601039 0.860329084 0.872499334 0.877294625 0.879412200 0.894616764 0.901086493 0.909721066 0.916860412 0.922173814 0.925760706 0.980625582 1.299395258 1.492506379</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">86</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.82972201" y3="0.92440649" z3="3.84993918">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.11982662" y3="1.26981071" z3="2.83988093">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.24506054" y3="1.14580402" z3="3.98662099">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.39583296" y3="1.52884052" z3="4.58055823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11054095" y3="-0.56884631" z3="4.01763778">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81130859" y3="-0.88358212" z3="5.03276846">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47743301" y3="-1.13943378" z3="3.30999076">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57553395" y3="-0.95424286" z3="3.78755896">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.67483702" y3="-2.05233352" z3="3.87622452">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.84234134" y3="-0.6996464" z3="2.7412164">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.5944073" y3="-0.30307473" z3="4.73572631">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6063674" y3="-0.56810657" z3="4.38091242">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.51000018" y3="0.79889555" z3="4.71066876">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49776961" y3="-0.80965468" z3="6.18194325">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.33547904" y3="-0.66189975" z3="8.41427393">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22717704" y3="-1.23124098" z3="8.73738567">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.19889807" y3="0.1699988" z3="9.14121819">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.10329555" y3="-1.57967339" z3="8.51952514">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91910151" y3="-1.85019331" z3="9.58163756">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.2151287" y3="-1.00738892" z3="8.18526498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23482832" y3="-2.86034245" z3="7.69518401">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.4508901" y3="-2.58720648" z3="6.64646727">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.12988899" y3="-3.4104026" z3="8.03682559">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.01477129" y3="-3.78529997" z3="7.74090442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.26598266" y3="-4.73014936" z3="7.22346784">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.20577106" y3="-4.0607451" z3="8.79161374">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24246169" y3="-3.19665513" z3="7.09799585">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.60069579" y3="-2.30492946" z3="7.64179949">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07044433" y3="-3.92943606" z3="7.07726334">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.03701043" y3="-2.88516132" z3="6.05710702">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24315684" y3="-1.75971329" z3="6.51918456">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.6073723" y3="-0.13241613" z3="7.03732992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.85181179" y3="0.52230317" z3="6.59041667">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45339924" y3="0.87230434" z3="7.72865232">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37646315" y3="0.08552464" z3="8.50142193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23296003" y3="0.55704745" z3="7.0111908">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80699135" y3="1.79616497" z3="8.2267607">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11174752" y3="1.0867537" z3="7.03323682">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80591794" y3="0.15054987" z3="6.53786806">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20316719" y3="1.85837833" z3="6.24897533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.0065868" y3="1.50399659" z3="7.99636151">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75835301" y3="0.68387644" z3="8.69176816">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35983403" y3="2.35503552" z3="8.62203597">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.7359752" y3="1.99937229" z3="7.31859488">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73889083" y3="2.58796947" z3="6.24478498">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.8814232" y3="2.12519805" z3="8.02972464">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8297,.9244,3.8499;-1.1198,1.2698,2.8399;.2451,1.1458,3.9866;-1.3958,1.5288,4.5806;-1.1105,-.5688,4.0176;-.8113,-.8836,5.0328;-.4774,-1.1394,3.31;-2.5755,-.9542,3.7876;-2.6748,-2.0523,3.8762;-2.8423,-.6996,2.7412;-3.5944,-.3031,4.7357;-4.6064,-.5681,4.3809;-3.51,.7989,4.7107;-3.4978,-.8097,6.1819;-2.3355,-.6619,8.4143;-3.2272,-1.2312,8.7374;-2.1989,.17,9.1412;-1.1033,-1.5797,8.5195;-.9191,-1.8502,9.5816;-.2151,-1.0074,8.1853;-1.2348,-2.8603,7.6952;-1.4509,-2.5872,6.6465;-2.1299,-3.4104,8.0368;-.0148,-3.7853,7.7409;-.266,-4.7301,7.2235;.2058,-4.0607,8.7916;1.2425,-3.1967,7.098;1.6007,-2.3049,7.6418;2.0704,-3.9294,7.0773;1.037,-2.8852,6.0571;-4.2432,-1.7597,6.5192;-2.6074,-.1324,7.0373;-1.8518,.5223,6.5904;-7.4534,.8723,7.7287;-7.3765,.0855,8.5014;-8.233,.557,7.0112;-7.807,1.7962,8.2268;-6.1117,1.0868,7.0332;-5.8059,.1505,6.5379;-6.2032,1.8584,6.249;-5.0066,1.504,7.9964;-4.7584,.6839,8.6918;-5.3598,2.355,8.622;-3.736,1.9994,7.3186;-3.7389,2.588,6.2448;-2.8814,2.1252,8.0297;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724151847405</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000995249562 0.000273113939 0.033774798504 0.008525259383</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016155343 -0.000126639 0.000261126 0.000432824 0.000785891 0.001058642 0.001225017 0.001897879 0.002498847 0.002983006 0.003523782 0.003973349 0.004167184 0.004716270 0.005590739 0.006162108 0.006516986 0.007880122 0.008373004 0.009670045 0.010468561 0.011760423 0.013855810 0.015193857 0.020028714 0.021572165 0.024648277 0.025797622 0.030660065 0.035018335 0.035888668 0.039038790 0.043815084 0.044302523 0.044670313 0.048411200 0.049561173 0.050275694 0.050760006 0.052195197 0.052271826 0.052511428 0.053309211 0.055054928 0.056192080 0.057865740 0.059167181 0.060969957 0.062757320 0.063103930 0.066622052 0.070604751 0.072989116 0.077109786 0.078848280 0.079203630 0.080066720 0.084353920 0.084769839 0.092721609 0.096520427 0.099170254 0.104679063 0.105794351 0.109550251 0.111845646 0.114201682 0.116654618 0.117731030 0.120205385 0.131394399 0.137107735 0.140777954 0.145034378 0.147781451 0.154813865 0.155296272 0.167758097 0.173525799 0.175583253 0.181386111 0.191689414 0.198050340 0.204459781 0.211742511 0.217234591 0.224548492 0.240700303 0.257293990 0.267749140 0.316138518 0.325013012 0.357636309 0.363907741 0.422664064 0.457634754 0.511150473 0.548648407 0.567403069 0.615525450 0.631861657 0.644907988 0.690130981 0.741789208 0.749076992 0.749608171 0.760692108 0.761798357 0.771571629 0.773711907 0.785832933 0.792136809 0.799678861 0.804231664 0.814662315 0.817376267 0.822296973 0.831898192 0.836602220 0.860330314 0.872499270 0.877304025 0.879413652 0.894627863 0.901097541 0.909721147 0.916884114 0.922194220 0.925760807 0.980627735 1.299395856 1.492509000</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">87</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.8383132" y3="0.93388379" z3="3.8379304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.13119619" y3="1.28088343" z3="2.82840093">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.2349511" y3="1.15900538" z3="3.97361441">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.40440261" y3="1.53440659" z3="4.56999659">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11546443" y3="-0.55985343" z3="4.00519196">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81081378" y3="-0.87515955" z3="5.01858939">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.4856147" y3="-1.13002211" z3="3.29359613">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58204133" y3="-0.94701522" z3="3.7825681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68058922" y3="-2.04625345" z3="3.87061001">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.85528385" y3="-0.69217244" z3="2.73797023">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59747864" y3="-0.29881267" z3="4.73638129">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60919001" y3="-0.56676629" z3="4.38571585">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.51673739" y3="0.80265017" z3="4.7120747">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49438727" y3="-0.80658017" z3="6.18183688">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32875909" y3="-0.6584777" z3="8.41217306">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.22145256" y3="-1.22533389" z3="8.73709514">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.18920669" y3="0.17379093" z3="9.13814955">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09902838" y3="-1.57956822" z3="8.51782983">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91844652" y3="-1.8527571" z3="9.57958135">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.20862706" y3="-1.00923055" z3="8.18739278">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23161609" y3="-2.85822142" z3="7.69121626">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.4352709" y3="-2.58242248" z3="6.64091925">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13419796" y3="-3.40155098" z3="8.02348702">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.01899005" y3="-3.79261791" z3="7.7486435">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27208261" y3="-4.73542149" z3="7.22730648">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.18808224" y3="-4.07169611" z3="8.80099809">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24990036" y3="-3.21281352" z3="7.121694">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.60697791" y3="-2.32501261" z3="7.67094895">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07181664" y3="-3.95231747" z3="7.11103814">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.05884902" y3="-2.89964297" z3="6.07862723">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23797573" y3="-1.7574275" z3="6.52100113">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.60214635" y3="-0.1291442" z3="7.0354001">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84855365" y3="0.52745853" z3="6.58753614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45151319" y3="0.86622837" z3="7.72852798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37178152" y3="0.07958332" z3="8.50086078">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2304869" y3="0.54822848" z3="7.01168822">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80822172" y3="1.78869892" z3="8.22629984">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11010445" y3="1.08434762" z3="7.03322823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80403134" y3="0.14928394" z3="6.538347">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20333532" y3="1.85568444" z3="6.24964988">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00491148" y3="1.50229272" z3="7.99605124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75428459" y3="0.6805386" z3="8.68913184">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36087321" y3="2.35089984" z3="8.625615">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73576492" y3="2.00090736" z3="7.31853945">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.74010678" y3="2.58986426" z3="6.24495113">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88126443" y3="2.12811097" z3="8.02948278">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8383,.9339,3.8379;-1.1312,1.2809,2.8284;.235,1.159,3.9736;-1.4044,1.5344,4.57;-1.1155,-.5599,4.0052;-.8108,-.8752,5.0186;-.4856,-1.13,3.2936;-2.582,-.947,3.7826;-2.6806,-2.0463,3.8706;-2.8553,-.6922,2.738;-3.5975,-.2988,4.7364;-4.6092,-.5668,4.3857;-3.5167,.8027,4.7121;-3.4944,-.8066,6.1818;-2.3288,-.6585,8.4122;-3.2215,-1.2253,8.7371;-2.1892,.1738,9.1381;-1.099,-1.5796,8.5178;-.9184,-1.8528,9.5796;-.2086,-1.0092,8.1874;-1.2316,-2.8582,7.6912;-1.4353,-2.5824,6.6409;-2.1342,-3.4016,8.0235;-.019,-3.7926,7.7486;-.2721,-4.7354,7.2273;.1881,-4.0717,8.801;1.2499,-3.2128,7.1217;1.607,-2.325,7.6709;2.0718,-3.9523,7.111;1.0588,-2.8996,6.0786;-4.238,-1.7574,6.521;-2.6021,-.1291,7.0354;-1.8486,.5275,6.5875;-7.4515,.8662,7.7285;-7.3718,.0796,8.5009;-8.2305,.5482,7.0117;-7.8082,1.7887,8.2263;-6.1101,1.0843,7.0332;-5.804,.1493,6.5383;-6.2033,1.8557,6.2496;-5.0049,1.5023,7.9961;-4.7543,.6805,8.6891;-5.3609,2.3509,8.6256;-3.7358,2.0009,7.3185;-3.7401,2.5899,6.245;-2.8813,2.1281,8.0295;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724156074575</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001156817277 0.000253408228 0.027156541908 0.008511248663</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016131953 -0.000095780 0.000266142 0.000407393 0.000787073 0.001066820 0.001225723 0.001908920 0.002515860 0.002993979 0.003524645 0.003981575 0.004178583 0.004720028 0.005592474 0.006179376 0.006517916 0.007883069 0.008373165 0.009671041 0.010467613 0.011761877 0.013860017 0.015193364 0.020029272 0.021569796 0.024662897 0.025796605 0.030672496 0.035037024 0.035927808 0.039040138 0.043822279 0.044304290 0.044672064 0.048411051 0.049561206 0.050281266 0.050759712 0.052197784 0.052270439 0.052511737 0.053308804 0.055054013 0.056209558 0.057864503 0.059161519 0.060983495 0.062755215 0.063104276 0.066627209 0.070620152 0.072989523 0.077111058 0.078849577 0.079205079 0.080069479 0.084355819 0.084774566 0.092726090 0.096520365 0.099172723 0.104678964 0.105794529 0.109550294 0.111852320 0.114201779 0.116654482 0.117732965 0.120208640 0.131394615 0.137108920 0.140779132 0.145033281 0.147789538 0.154814954 0.155296550 0.167759313 0.173535454 0.175586442 0.181386311 0.191695863 0.198052778 0.204473217 0.211744550 0.217237887 0.224572715 0.240698949 0.257294120 0.267752422 0.316142132 0.325025230 0.357641761 0.363908115 0.422686917 0.457648005 0.511232696 0.548649737 0.567403120 0.615530959 0.631969166 0.644912552 0.690151431 0.741825324 0.749081125 0.749608035 0.760701401 0.761804106 0.771603513 0.773712806 0.785840768 0.792138419 0.799726283 0.804247657 0.814665028 0.817383341 0.822298894 0.832007951 0.836606728 0.860338674 0.872505228 0.877312998 0.879424043 0.894630268 0.901098979 0.909730726 0.916889260 0.922193407 0.925761258 0.980634710 1.299399537 1.492515412</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">88</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.85271717" y3="0.94698541" z3="3.82506896">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.15835273" y3="1.29088319" z3="2.81891652">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.22230814" y3="1.1755387" z3="3.94789514">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.41332541" y3="1.54782708" z3="4.56313618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12170408" y3="-0.54802695" z3="3.99566567">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.8108585" y3="-0.86120349" z3="5.00828225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49186423" y3="-1.11480276" z3="3.28177095">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58646056" y3="-0.9429141" z3="3.77998057">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.67812898" y3="-2.04174892" z3="3.86991081">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86514103" y3="-0.69016475" z3="2.73612158">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60002595" y3="-0.29788793" z3="4.73754958">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61309096" y3="-0.56695368" z3="4.39025314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.52086613" y3="0.80418635" z3="4.71301153">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49133351" y3="-0.80642816" z3="6.18258333">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32107514" y3="-0.65731454" z3="8.41032736">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21414887" y3="-1.22218985" z3="8.73762114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.17921623" y3="0.17602154" z3="9.13453805">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09327963" y3="-1.58070661" z3="8.51679821">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91364708" y3="-1.85338572" z3="9.57911141">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.20129437" y3="-1.01265954" z3="8.18581448">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22874277" y3="-2.85961363" z3="7.69070538">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.42274912" y3="-2.58340713" z3="6.63852066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13737318" y3="-3.39662727" z3="8.01642261">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02295167" y3="-3.80157368" z3="7.75832038">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27721609" y3="-4.7421133" z3="7.23359707">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.17194847" y3="-4.08272916" z3="8.81257685">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25535614" y3="-3.22860503" z3="7.14340734">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61477055" y3="-2.34337056" z3="7.69756124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07283501" y3="-3.97313119" z3="7.13787941">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.07627354" y3="-2.91082894" z3="6.09952412">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23455595" y3="-1.75700889" z3="6.52398126">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59580086" y3="-0.1302407" z3="7.03305354">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84518023" y3="0.52877861" z3="6.58425674">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.449443" y3="0.86292703" z3="7.72492894">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36971111" y3="0.0728116" z3="8.49392362">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22781529" y3="0.54884188" z3="7.00604856">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80572253" y3="1.78314158" z3="8.22689599">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10849626" y3="1.08441336" z3="7.03069193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80032146" y3="0.15155645" z3="6.53099111">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20196949" y3="1.85969079" z3="6.2504412">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00417449" y3="1.49878536" z3="7.99576297">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75257071" y3="0.67463266" z3="8.68489725">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35967239" y3="2.34407093" z3="8.62771232">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.7355417" y3="2.00306247" z3="7.32073335">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73962832" y3="2.59454835" z3="6.24890233">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.8812935" y3="2.12738937" z3="8.03179521">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8527,.947,3.8251;-1.1584,1.2909,2.8189;.2223,1.1755,3.9479;-1.4133,1.5478,4.5631;-1.1217,-.548,3.9957;-.8109,-.8612,5.0083;-.4919,-1.1148,3.2818;-2.5865,-.9429,3.78;-2.6781,-2.0417,3.8699;-2.8651,-.6902,2.7361;-3.6,-.2979,4.7375;-4.6131,-.567,4.3903;-3.5209,.8042,4.713;-3.4913,-.8064,6.1826;-2.3211,-.6573,8.4103;-3.2141,-1.2222,8.7376;-2.1792,.176,9.1345;-1.0933,-1.5807,8.5168;-.9136,-1.8534,9.5791;-.2013,-1.0127,8.1858;-1.2287,-2.8596,7.6907;-1.4227,-2.5834,6.6385;-2.1374,-3.3966,8.0164;-.023,-3.8016,7.7583;-.2772,-4.7421,7.2336;.1719,-4.0827,8.8126;1.2554,-3.2286,7.1434;1.6148,-2.3434,7.6976;2.0728,-3.9731,7.1379;1.0763,-2.9108,6.0995;-4.2346,-1.757,6.524;-2.5958,-.1302,7.0331;-1.8452,.5288,6.5843;-7.4494,.8629,7.7249;-7.3697,.0728,8.4939;-8.2278,.5488,7.006;-7.8057,1.7831,8.2269;-6.1085,1.0844,7.0307;-5.8003,.1516,6.531;-6.202,1.8597,6.2504;-5.0042,1.4988,7.9958;-4.7526,.6746,8.6849;-5.3597,2.3441,8.6277;-3.7355,2.0031,7.3207;-3.7396,2.5945,6.2489;-2.8813,2.1274,8.0318;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724158552180</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001295211035 0.000258430427 0.029540890418 0.008525783051</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016105544 -0.000130017 0.000279767 0.000406441 0.000792833 0.001064170 0.001231406 0.001908209 0.002525572 0.003010406 0.003526311 0.003979606 0.004184219 0.004723037 0.005604181 0.006199388 0.006517758 0.007882479 0.008373867 0.009673118 0.010467444 0.011762273 0.013858875 0.015192962 0.020030584 0.021569964 0.024666914 0.025796631 0.030684544 0.035056825 0.035962551 0.039042109 0.043828291 0.044303844 0.044680096 0.048410910 0.049561645 0.050285724 0.050760135 0.052198612 0.052270061 0.052513259 0.053308774 0.055055271 0.056243404 0.057864613 0.059171819 0.060987911 0.062755174 0.063111638 0.066630797 0.070637810 0.072992299 0.077112454 0.078850210 0.079206448 0.080081736 0.084356403 0.084773408 0.092728976 0.096521573 0.099173228 0.104681569 0.105800346 0.109550286 0.111855667 0.114202482 0.116654667 0.117733253 0.120212573 0.131399222 0.137111347 0.140780818 0.145035212 0.147797414 0.154817342 0.155299687 0.167759139 0.173535634 0.175588428 0.181386003 0.191695928 0.198054014 0.204479182 0.211758738 0.217242773 0.224569434 0.240709327 0.257298055 0.267754755 0.316147347 0.325040751 0.357643832 0.363923793 0.422713073 0.457653396 0.511264030 0.548650525 0.567404054 0.615551067 0.632032440 0.644938181 0.690157759 0.741948646 0.749081867 0.749607793 0.760701761 0.761808181 0.771603882 0.773712752 0.785859503 0.792138282 0.799765303 0.804263487 0.814674519 0.817383191 0.822306947 0.832088670 0.836613077 0.860338949 0.872506465 0.877343038 0.879423164 0.894640394 0.901100825 0.909739408 0.916890023 0.922198177 0.925761294 0.980634898 1.299399912 1.492521730</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">89</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.86273192" y3="0.95945247" z3="3.81524221">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.17125871" y3="1.30239238" z3="2.80884056">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.20991481" y3="1.19533511" z3="3.93793763">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.42621858" y3="1.55494397" z3="4.55314614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12288318" y3="-0.53666173" z3="3.98692881">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80554165" y3="-0.84764633" z3="4.99776279">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49383759" y3="-1.10051847" z3="3.27023182">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58718586" y3="-0.9387931" z3="3.77743395">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.67411003" y3="-2.03844817" z3="3.86861413">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87112655" y3="-0.68862707" z3="2.73443118">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60115446" y3="-0.29781833" z3="4.73743186">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61365108" y3="-0.57176212" z3="4.3925873">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.52747029" y3="0.80443115" z3="4.71224843">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48762864" y3="-0.80445693" z3="6.18272073">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31285636" y3="-0.65155805" z3="8.4075126">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20707866" y3="-1.21247471" z3="8.73887969">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.16560051" y3="0.18286667" z3="9.12949803">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08843856" y3="-1.57978337" z3="8.51309339">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91040343" y3="-1.85349485" z3="9.57518251">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19410262" y3="-1.01540636" z3="8.18273378">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22807145" y3="-2.85807083" z3="7.68704036">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.41171555" y3="-2.58107057" z3="6.63354155">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14354237" y3="-3.38702947" z3="8.00582118">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.0304875" y3="-3.81003909" z3="7.76479735">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.28629682" y3="-4.74747843" z3="7.2359677">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.15211897" y3="-4.09497515" z3="8.81995516">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.2584002" y3="-3.24630773" z3="7.1653767">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.617116" y3="-2.36631022" z3="7.72551622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06959898" y3="-3.99764281" z3="7.1674203">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.09222772" y3="-2.92582956" z3="6.12024464">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22958486" y3="-1.75487905" z3="6.52786614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59044538" y3="-0.12617358" z3="7.03007559">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84202557" y3="0.53397665" z3="6.57926003">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44742161" y3="0.85551598" z3="7.72777628">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36282252" y3="0.06304638" z3="8.49402241">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22680569" y3="0.54035083" z3="7.01045283">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80700926" y3="1.77283164" z3="8.23320053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10830574" y3="1.08395066" z3="7.03076727">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79981363" y3="0.15376819" z3="6.5284506">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20652825" y3="1.86118616" z3="6.25314234">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00225917" y3="1.49777996" z3="7.9939948">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74766442" y3="0.67164757" z3="8.68019012">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35936125" y3="2.3402448" z3="8.63042491">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73622612" y3="2.00419564" z3="7.31766493">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.74303993" y3="2.5947997" z3="6.24522687">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88063974" y3="2.13099644" z3="8.02723387">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8627,.9595,3.8152;-1.1713,1.3024,2.8088;.2099,1.1953,3.9379;-1.4262,1.5549,4.5531;-1.1229,-.5367,3.9869;-.8055,-.8476,4.9978;-.4938,-1.1005,3.2702;-2.5872,-.9388,3.7774;-2.6741,-2.0384,3.8686;-2.8711,-.6886,2.7344;-3.6012,-.2978,4.7374;-4.6137,-.5718,4.3926;-3.5275,.8044,4.7122;-3.4876,-.8045,6.1827;-2.3129,-.6516,8.4075;-3.2071,-1.2125,8.7389;-2.1656,.1829,9.1295;-1.0884,-1.5798,8.5131;-.9104,-1.8535,9.5752;-.1941,-1.0154,8.1827;-1.2281,-2.8581,7.687;-1.4117,-2.5811,6.6335;-2.1435,-3.387,8.0058;-.0305,-3.81,7.7648;-.2863,-4.7475,7.236;.1521,-4.095,8.82;1.2584,-3.2463,7.1654;1.6171,-2.3663,7.7255;2.0696,-3.9976,7.1674;1.0922,-2.9258,6.1202;-4.2296,-1.7549,6.5279;-2.5904,-.1262,7.0301;-1.842,.534,6.5793;-7.4474,.8555,7.7278;-7.3628,.063,8.494;-8.2268,.5404,7.0105;-7.807,1.7728,8.2332;-6.1083,1.084,7.0308;-5.7998,.1538,6.5285;-6.2065,1.8612,6.2531;-5.0023,1.4978,7.994;-4.7477,.6716,8.6802;-5.3594,2.3402,8.6304;-3.7362,2.0042,7.3177;-3.743,2.5948,6.2452;-2.8806,2.131,8.0272;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724160735523</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000941252782 0.000246717600 0.027268179188 0.008494771950</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016071375 -0.000163918 0.000308006 0.000409714 0.000787179 0.001066057 0.001230284 0.001912851 0.002533418 0.003010384 0.003529056 0.003990318 0.004188552 0.004733892 0.005604489 0.006216353 0.006519037 0.007889460 0.008372594 0.009676326 0.010467894 0.011764266 0.013858452 0.015192211 0.020034288 0.021567943 0.024678127 0.025799087 0.030694076 0.035066256 0.035989050 0.039041830 0.043832229 0.044303998 0.044682882 0.048410841 0.049562661 0.050290076 0.050759860 0.052197973 0.052270112 0.052515143 0.053309041 0.055054629 0.056256142 0.057869986 0.059172061 0.060989021 0.062759200 0.063119127 0.066630462 0.070671221 0.072993882 0.077113675 0.078850383 0.079207938 0.080087206 0.084363787 0.084773083 0.092732878 0.096521589 0.099173326 0.104680847 0.105805975 0.109550974 0.111858053 0.114205335 0.116655543 0.117733842 0.120212483 0.131406343 0.137119344 0.140781207 0.145046592 0.147818612 0.154827211 0.155301165 0.167759276 0.173540113 0.175596027 0.181385983 0.191696170 0.198054182 0.204483754 0.211780673 0.217246803 0.224572434 0.240713850 0.257299623 0.267769674 0.316150450 0.325046376 0.357650976 0.363935175 0.422723422 0.457656232 0.511281851 0.548652923 0.567404229 0.615555048 0.632069860 0.644937643 0.690161972 0.742009934 0.749086520 0.749608102 0.760702465 0.761811170 0.771619586 0.773714051 0.785884627 0.792138940 0.799824675 0.804264875 0.814695389 0.817398521 0.822310555 0.832167708 0.836614019 0.860359415 0.872509486 0.877388091 0.879422555 0.894661172 0.901101245 0.909801370 0.916903437 0.922211384 0.925762129 0.980636658 1.299413231 1.492522819</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">90</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.87852219" y3="0.97333152" z3="3.8073906">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.19852689" y3="1.3137148" z3="2.8041943">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.19475207" y3="1.21552755" z3="3.91973951">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.43924461" y3="1.56731704" z3="4.55075825">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12763178" y3="-0.52494254" z3="3.98068806">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80384962" y3="-0.83403775" z3="4.99043465">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49753161" y3="-1.08459801" z3="3.26135176">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58974539" y3="-0.93756489" z3="3.77761992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.66847435" y3="-2.03749706" z3="3.8712586">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87916432" y3="-0.69132241" z3="2.73507947">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60421975" y3="-0.30099702" z3="4.74000275">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61613197" y3="-0.58047613" z3="4.39818021">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.53555463" y3="0.80164215" z3="4.71276151">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.4846264" y3="-0.80549291" z3="6.1858687">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30257901" y3="-0.64896188" z3="8.40638555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19643772" y3="-1.20753911" z3="8.74229059">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15182407" y3="0.18723165" z3="9.12541489">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08016558" y3="-1.57955275" z3="8.51122203">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90182773" y3="-1.85335709" z3="9.57345766">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18459462" y3="-1.01767726" z3="8.17960533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22486439" y3="-2.85740581" z3="7.68514505">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.39991755" y3="-2.57967312" z3="6.6299819">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14709479" y3="-3.3785203" z3="7.99833047">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03556052" y3="-3.81840189" z3="7.77119955">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29512907" y3="-4.75329293" z3="7.23823345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.13513993" y3="-4.10642739" z3="8.82788072">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26334185" y3="-3.26314972" z3="7.18346043">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6263928" y3="-2.38679031" z3="7.74971988">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06836204" y3="-4.02110643" z3="7.18925933">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.10917137" y3="-2.9370535" z3="6.13790073">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.2256992" y3="-1.75515938" z3="6.53534042">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58350468" y3="-0.12766124" z3="7.02825229">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83920556" y3="0.53585524" z3="6.57503879">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44644409" y3="0.85420018" z3="7.72195428">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36353999" y3="0.05674313" z3="8.48288541">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22572805" y3="0.54546486" z3="7.00161161">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80329498" y3="1.76877271" z3="8.23384993">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10776237" y3="1.08527625" z3="7.02680924">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.7982933" y3="0.15742635" z3="6.51890834">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20499286" y3="1.86636792" z3="6.25320823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00229532" y3="1.49446827" z3="7.99286798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74660769" y3="0.6645931" z3="8.6736389">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35884497" y3="2.33285922" z3="8.63390762">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73687661" y3="2.00759471" z3="7.3189892">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.7433096" y3="2.59899071" z3="6.24756584">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88151105" y3="2.1317377" z3="8.0282443">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8785,.9733,3.8074;-1.1985,1.3137,2.8042;.1948,1.2155,3.9197;-1.4392,1.5673,4.5508;-1.1276,-.5249,3.9807;-.8038,-.834,4.9904;-.4975,-1.0846,3.2614;-2.5897,-.9376,3.7776;-2.6685,-2.0375,3.8713;-2.8792,-.6913,2.7351;-3.6042,-.301,4.74;-4.6161,-.5805,4.3982;-3.5356,.8016,4.7128;-3.4846,-.8055,6.1859;-2.3026,-.649,8.4064;-3.1964,-1.2075,8.7423;-2.1518,.1872,9.1254;-1.0802,-1.5796,8.5112;-.9018,-1.8534,9.5735;-.1846,-1.0177,8.1796;-1.2249,-2.8574,7.6851;-1.3999,-2.5797,6.63;-2.1471,-3.3785,7.9983;-.0356,-3.8184,7.7712;-.2951,-4.7533,7.2382;.1351,-4.1064,8.8279;1.2633,-3.2631,7.1835;1.6264,-2.3868,7.7497;2.0684,-4.0211,7.1893;1.1092,-2.9371,6.1379;-4.2257,-1.7552,6.5353;-2.5835,-.1277,7.0283;-1.8392,.5359,6.575;-7.4464,.8542,7.722;-7.3635,.0567,8.4829;-8.2257,.5455,7.0016;-7.8033,1.7688,8.2338;-6.1078,1.0853,7.0268;-5.7983,.1574,6.5189;-6.205,1.8664,6.2532;-5.0023,1.4945,7.9929;-4.7466,.6646,8.6736;-5.3588,2.3329,8.6339;-3.7369,2.0076,7.319;-3.7433,2.599,6.2476;-2.8815,2.1317,8.0282;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724161440895</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001244716895 0.000254960921 0.023581056185 0.008511998477</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016041648 -0.000155212 0.000366543 0.000426737 0.000805345 0.001066153 0.001230150 0.001909485 0.002539155 0.003011950 0.003536604 0.004003054 0.004187561 0.004754701 0.005609962 0.006228714 0.006518293 0.007890229 0.008371541 0.009678538 0.010470606 0.011767301 0.013859069 0.015191717 0.020035403 0.021568004 0.024683030 0.025803061 0.030700038 0.035078034 0.036000981 0.039041746 0.043839923 0.044304051 0.044685636 0.048411087 0.049563513 0.050290951 0.050759900 0.052197367 0.052269832 0.052517850 0.053309567 0.055054894 0.056264006 0.057878686 0.059187541 0.060993171 0.062773336 0.063127747 0.066632024 0.070701608 0.072998996 0.077113841 0.078851058 0.079210645 0.080098138 0.084367473 0.084778704 0.092737335 0.096523538 0.099173602 0.104682698 0.105814969 0.109550677 0.111859111 0.114207698 0.116655750 0.117734364 0.120212536 0.131413228 0.137124354 0.140781930 0.145065005 0.147833387 0.154832201 0.155303036 0.167759633 0.173542291 0.175596238 0.181385403 0.191695998 0.198055703 0.204490629 0.211815534 0.217252120 0.224595018 0.240743699 0.257302796 0.267781830 0.316189850 0.325053657 0.357651644 0.363970014 0.422752019 0.457657636 0.511291584 0.548659342 0.567404135 0.615581762 0.632071527 0.644943585 0.690162273 0.742155572 0.749089945 0.749608144 0.760702461 0.761820921 0.771620907 0.773714915 0.785918278 0.792138934 0.799850070 0.804266312 0.814720448 0.817398335 0.822352314 0.832194283 0.836615722 0.860359040 0.872510278 0.877453129 0.879421648 0.894662854 0.901102584 0.909836061 0.916904387 0.922232762 0.925762568 0.980670306 1.299414432 1.492533829</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">91</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.88725165" y3="0.9867843" z3="3.80045144">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.21020811" y3="1.32399235" z3="2.79705256">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.18350526" y3="1.23679841" z3="3.91184556">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.45116054" y3="1.5762758" z3="4.5434256">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12585819" y3="-0.51248767" z3="3.97573537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79753078" y3="-0.81832834" z3="4.98472998">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49419918" y3="-1.06854727" z3="3.25533808">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58556217" y3="-0.93470435" z3="3.77651845">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65680906" y3="-2.03469974" z3="3.87219785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87833204" y3="-0.69241048" z3="2.73413909">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60282764" y3="-0.30278974" z3="4.7389545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6136999" y3="-0.58840558" z3="4.39842246">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54074157" y3="0.80025107" z3="4.710065">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48004057" y3="-0.80321397" z3="6.18581239">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29439197" y3="-0.64016892" z3="8.4036642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.18981019" y3="-1.19329138" z3="8.74525071">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.13620254" y3="0.19764501" z3="9.11943459">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07633387" y3="-1.57729639" z3="8.5069606">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89795653" y3="-1.85036596" z3="9.56925571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.1781403" y3="-1.02072303" z3="8.17327061">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22787141" y3="-2.85595559" z3="7.68325249">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.39569016" y3="-2.57910412" z3="6.62719612">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15535791" y3="-3.36870687" z3="7.99291231">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.04658283" y3="-3.82656895" z3="7.77675451">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.30804857" y3="-4.75867937" z3="7.24196311">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.11507146" y3="-4.11636614" z3="8.83370031">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.2597845" y3="-3.28135964" z3="7.19962572">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62196074" y3="-2.40870934" z3="7.76834129">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05954968" y3="-4.04468749" z3="7.21205484">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.11605871" y3="-2.9550072" z3="6.15362579">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.21979557" y3="-1.75244442" z3="6.53962545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.57871442" y3="-0.12098062" z3="7.02519818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83547684" y3="0.54095908" z3="6.569528">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44300684" y3="0.84192298" z3="7.7279123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35042183" y3="0.04017614" z3="8.48384939">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22484523" y3="0.5325145" z3="7.01080526">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80377162" y3="1.75146178" z3="8.24620701">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.1083045" y3="1.08485274" z3="7.02687506">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79689553" y3="0.16130828" z3="6.51374743">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21451773" y3="1.86965962" z3="6.25742891">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00018165" y3="1.49435175" z3="7.98950955">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74215963" y3="0.66443684" z3="8.66928296">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35624774" y3="2.33176356" z3="8.63186158">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73706232" y3="2.00742497" z3="7.31282943">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.74685927" y3="2.59699617" z3="6.24003584">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88103074" y3="2.13688345" z3="8.02124063">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8873,.9868,3.8005;-1.2102,1.324,2.7971;.1835,1.2368,3.9118;-1.4512,1.5763,4.5434;-1.1259,-.5125,3.9757;-.7975,-.8183,4.9847;-.4942,-1.0685,3.2553;-2.5856,-.9347,3.7765;-2.6568,-2.0347,3.8722;-2.8783,-.6924,2.7341;-3.6028,-.3028,4.739;-4.6137,-.5884,4.3984;-3.5407,.8003,4.7101;-3.48,-.8032,6.1858;-2.2944,-.6402,8.4037;-3.1898,-1.1933,8.7453;-2.1362,.1976,9.1194;-1.0763,-1.5773,8.507;-.898,-1.8504,9.5693;-.1781,-1.0207,8.1733;-1.2279,-2.856,7.6833;-1.3957,-2.5791,6.6272;-2.1554,-3.3687,7.9929;-.0466,-3.8266,7.7768;-.308,-4.7587,7.242;.1151,-4.1164,8.8337;1.2598,-3.2814,7.1996;1.622,-2.4087,7.7683;2.0595,-4.0447,7.2121;1.1161,-2.955,6.1536;-4.2198,-1.7524,6.5396;-2.5787,-.121,7.0252;-1.8355,.541,6.5695;-7.443,.8419,7.7279;-7.3504,.0402,8.4838;-8.2248,.5325,7.0108;-7.8038,1.7515,8.2462;-6.1083,1.0849,7.0269;-5.7969,.1613,6.5137;-6.2145,1.8697,6.2574;-5.0002,1.4944,7.9895;-4.7422,.6644,8.6693;-5.3562,2.3318,8.6319;-3.7371,2.0074,7.3128;-3.7469,2.597,6.24;-2.881,2.1369,8.0212;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724160821303</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001041828945 0.000246949543 0.028932025078 0.008509045858</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016015908 -0.000179035 0.000402196 0.000464317 0.000847734 0.001071880 0.001236415 0.001908359 0.002538502 0.003010085 0.003536039 0.004021490 0.004189317 0.004807442 0.005606419 0.006235324 0.006519705 0.007890416 0.008376021 0.009680908 0.010474654 0.011770521 0.013860069 0.015194329 0.020036570 0.021567017 0.024686821 0.025816286 0.030699709 0.035080308 0.036003386 0.039041687 0.043844358 0.044304226 0.044685055 0.048412151 0.049563576 0.050290787 0.050760593 0.052196178 0.052270951 0.052526547 0.053310418 0.055062147 0.056262284 0.057894302 0.059199592 0.061002565 0.062786222 0.063131973 0.066631836 0.070741000 0.073006065 0.077113775 0.078851515 0.079212996 0.080103429 0.084376951 0.084800939 0.092744788 0.096523407 0.099176258 0.104682148 0.105817177 0.109550621 0.111859396 0.114211046 0.116658240 0.117737729 0.120213670 0.131415202 0.137133947 0.140784096 0.145093595 0.147858514 0.154839732 0.155303725 0.167759712 0.173547391 0.175604377 0.181387190 0.191702592 0.198062759 0.204491713 0.211850188 0.217258011 0.224622407 0.240764653 0.257304153 0.267812453 0.316248666 0.325056812 0.357654344 0.364008809 0.422770037 0.457659815 0.511296441 0.548663322 0.567404348 0.615589323 0.632099835 0.644951957 0.690162457 0.742162052 0.749093617 0.749611283 0.760703171 0.761820852 0.771633437 0.773722558 0.785937742 0.792142295 0.799866355 0.804273635 0.814746775 0.817418144 0.822389726 0.832200691 0.836626007 0.860361147 0.872512552 0.877545283 0.879420737 0.894664154 0.901103269 0.909945724 0.916908166 0.922295463 0.925764440 0.980717746 1.299420855 1.492536944</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">92</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.90260821" y3="0.99992379" z3="3.79520526">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.23343747" y3="1.33574833" z3="2.79361859">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.16742391" y3="1.25803522" z3="3.90119778">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.46760845" y3="1.58526652" z3="4.54136163">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.1286836" y3="-0.5019394" z3="3.97074051">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79259563" y3="-0.80625235" z3="4.97768656">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49613076" y3="-1.05275339" z3="3.24666376">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58673854" y3="-0.93550847" z3="3.77795452">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65031253" y3="-2.03650348" z3="3.87711841">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.8845955" y3="-0.69846312" z3="2.7355998">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60663088" y3="-0.30788937" z3="4.74085497">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61570954" y3="-0.60112254" z3="4.40212669">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.55130555" y3="0.79550823" z3="4.70895738">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.4797326" y3="-0.80423513" z3="6.1890451">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.28488949" y3="-0.63825864" z3="8.40200844">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.17974537" y3="-1.18888166" z3="8.74815128">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.12332602" y3="0.20127822" z3="9.11459662">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.06871371" y3="-1.57721887" z3="8.50476458">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89106711" y3="-1.85198506" z3="9.56688621">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.16953742" y3="-1.02218564" z3="8.1716885">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22411849" y3="-2.85394955" z3="7.67913571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.38257722" y3="-2.57492972" z3="6.62158668">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15803814" y3="-3.3598165" z3="7.98170617">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.05153065" y3="-3.83358429" z3="7.78062637">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.31719099" y3="-4.76156032" z3="7.23836023">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.09720019" y3="-4.12949475" z3="8.83892742">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26653166" y3="-3.29620642" z3="7.21859716">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.63506205" y3="-2.42984317" z3="7.79727332">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05822633" y3="-4.06805622" z3="7.23290139">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.13503634" y3="-2.96090614" z3="6.17234235">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22192545" y3="-1.74977" z3="6.54855961">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.57250245" y3="-0.12394969" z3="7.02264808">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83356073" y3="0.54190864" z3="6.56398416">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44185558" y3="0.84283144" z3="7.7242664">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35030778" y3="0.03643528" z3="8.47465323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22459556" y3="0.53916041" z3="7.00543981">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80000375" y3="1.74961634" z3="8.24966455">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10860628" y3="1.08801807" z3="7.02343115">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79858348" y3="0.16668458" z3="6.505129">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21428474" y3="1.87595748" z3="6.25803258">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99937799" y3="1.49178455" z3="7.9872295">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73916317" y3="0.65613906" z3="8.66001313">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35526441" y3="2.32426313" z3="8.63780928">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.7380489" y3="2.01058712" z3="7.31175594">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.74740835" y3="2.59881708" z3="6.23876227">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.8811368" y3="2.13775663" z3="8.01882615">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9026,.9999,3.7952;-1.2334,1.3357,2.7936;.1674,1.258,3.9012;-1.4676,1.5853,4.5414;-1.1287,-.5019,3.9707;-.7926,-.8063,4.9777;-.4961,-1.0528,3.2467;-2.5867,-.9355,3.778;-2.6503,-2.0365,3.8771;-2.8846,-.6985,2.7356;-3.6066,-.3079,4.7409;-4.6157,-.6011,4.4021;-3.5513,.7955,4.709;-3.4797,-.8042,6.189;-2.2849,-.6383,8.402;-3.1797,-1.1889,8.7482;-2.1233,.2013,9.1146;-1.0687,-1.5772,8.5048;-.8911,-1.852,9.5669;-.1695,-1.0222,8.1717;-1.2241,-2.8539,7.6791;-1.3826,-2.5749,6.6216;-2.158,-3.3598,7.9817;-.0515,-3.8336,7.7806;-.3172,-4.7616,7.2384;.0972,-4.1295,8.8389;1.2665,-3.2962,7.2186;1.6351,-2.4298,7.7973;2.0582,-4.0681,7.2329;1.135,-2.9609,6.1723;-4.2219,-1.7498,6.5486;-2.5725,-.1239,7.0226;-1.8336,.5419,6.564;-7.4419,.8428,7.7243;-7.3503,.0364,8.4747;-8.2246,.5392,7.0054;-7.8,1.7496,8.2497;-6.1086,1.088,7.0234;-5.7986,.1667,6.5051;-6.2143,1.876,6.258;-4.9994,1.4918,7.9872;-4.7392,.6561,8.66;-5.3553,2.3243,8.6378;-3.738,2.0106,7.3118;-3.7474,2.5988,6.2388;-2.8811,2.1378,8.0188;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724156329818</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001222701525 0.000290948961 0.022764190646 0.008548594574</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.016000974 -0.000234768 0.000416442 0.000504058 0.000909261 0.001088756 0.001254482 0.001911267 0.002549490 0.003024456 0.003539017 0.004028158 0.004201791 0.004873302 0.005605670 0.006236103 0.006523581 0.007890562 0.008377285 0.009683414 0.010480921 0.011774404 0.013865910 0.015202056 0.020036912 0.021570011 0.024687099 0.025830665 0.030705464 0.035080895 0.036003383 0.039041706 0.043846428 0.044305280 0.044689012 0.048412194 0.049566261 0.050294149 0.050761230 0.052195784 0.052271264 0.052535207 0.053313035 0.055073059 0.056279583 0.057921704 0.059241210 0.061026314 0.062803885 0.063134010 0.066633278 0.070764300 0.073026512 0.077116544 0.078856439 0.079212482 0.080108448 0.084376618 0.084825231 0.092753048 0.096523398 0.099181046 0.104682081 0.105817036 0.109551171 0.111860359 0.114210815 0.116666281 0.117738218 0.120217308 0.131415801 0.137140800 0.140788149 0.145105557 0.147871947 0.154841920 0.155305304 0.167760209 0.173551008 0.175607234 0.181396063 0.191720088 0.198082732 0.204498769 0.211885779 0.217268982 0.224782805 0.240854237 0.257314243 0.267823968 0.316387847 0.325067851 0.357680148 0.364024079 0.422822148 0.457685336 0.511298082 0.548662714 0.567404492 0.615596668 0.632255599 0.644953465 0.690168389 0.742165604 0.749094245 0.749611677 0.760706738 0.761827960 0.771633927 0.773733903 0.785941652 0.792143090 0.799866418 0.804276693 0.814751178 0.817421177 0.822447060 0.832202088 0.836641098 0.860369626 0.872514635 0.877629338 0.879439998 0.894719824 0.901104133 0.909984594 0.916915612 0.922317805 0.925781107 0.980738113 1.299420678 1.492539353</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">93</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.91357052" y3="1.01449136" z3="3.79130619">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.25088793" y3="1.34767312" z3="2.79145066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.15503303" y3="1.27944975" z3="3.89267524">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.47900207" y3="1.5962452" z3="4.54015925">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12879376" y3="-0.48841967" z3="3.96666006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78821907" y3="-0.79102092" z3="4.97261762">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49437683" y3="-1.03432419" z3="3.24084843">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58328518" y3="-0.93231734" z3="3.77708399">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.63779157" y3="-2.0328264" z3="3.87715413">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.8844487" y3="-0.69873175" z3="2.73507205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60589404" y3="-0.31041487" z3="4.74055092">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61360898" y3="-0.61023672" z3="4.40323768">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.55747466" y3="0.79318392" z3="4.70692289">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.47549962" y3="-0.80254536" z3="6.18988775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.27638879" y3="-0.62959295" z3="8.39990987">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.17218814" y3="-1.17527566" z3="8.75227307">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.10819493" y3="0.21233989" z3="9.1084255">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.06374719" y3="-1.57393064" z3="8.5016013">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88437102" y3="-1.84561097" z3="9.56426353">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.16262722" y3="-1.02418289" z3="8.16403286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22663272" y3="-2.85305293" z3="7.6802893">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.37991386" y3="-2.5765293" z3="6.62184541">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.1647315" y3="-3.35073499" z3="7.98237712">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.06185066" y3="-3.84161131" z3="7.78764007">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.33021019" y3="-4.76852249" z3="7.24679193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.07891941" y3="-4.13628831" z3="8.84595691">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26090849" y3="-3.31532836" z3="7.23106814">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62776903" y3="-2.45009122" z3="7.80836175">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.0486217" y3="-4.09082041" z3="7.2525544">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.13902901" y3="-2.98311131" z3="6.18442189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.21641415" y3="-1.74699908" z3="6.55411213">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.56757041" y3="-0.11853197" z3="7.01985205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.82886646" y3="0.54397252" z3="6.55816828">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43727235" y3="0.82946843" z3="7.72696513">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.33678144" y3="0.01658102" z3="8.46971822">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2222924" y3="0.52833269" z3="7.00964257">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79714245" y3="1.72974004" z3="8.26167104">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10819878" y3="1.08804966" z3="7.02137151">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79468711" y3="0.17224751" z3="6.49444908">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.22224764" y3="1.88185441" z3="6.2622866">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99698801" y3="1.49074755" z3="7.9833788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73691366" y3="0.65604761" z3="8.65558164">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35007041" y3="2.32308955" z3="8.63276826">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73634575" y3="2.00949439" z3="7.30574771">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.74868674" y3="2.59670177" z3="6.23192849">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88006259" y3="2.14179787" z3="8.01280682">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9136,1.0145,3.7913;-1.2509,1.3477,2.7915;.155,1.2794,3.8927;-1.479,1.5962,4.5402;-1.1288,-.4884,3.9667;-.7882,-.791,4.9726;-.4944,-1.0343,3.2408;-2.5833,-.9323,3.7771;-2.6378,-2.0328,3.8772;-2.8844,-.6987,2.7351;-3.6059,-.3104,4.7406;-4.6136,-.6102,4.4032;-3.5575,.7932,4.7069;-3.4755,-.8025,6.1899;-2.2764,-.6296,8.3999;-3.1722,-1.1753,8.7523;-2.1082,.2123,9.1084;-1.0637,-1.5739,8.5016;-.8844,-1.8456,9.5643;-.1626,-1.0242,8.164;-1.2266,-2.8531,7.6803;-1.3799,-2.5765,6.6218;-2.1647,-3.3507,7.9824;-.0619,-3.8416,7.7876;-.3302,-4.7685,7.2468;.0789,-4.1363,8.846;1.2609,-3.3153,7.2311;1.6278,-2.4501,7.8084;2.0486,-4.0908,7.2526;1.139,-2.9831,6.1844;-4.2164,-1.747,6.5541;-2.5676,-.1185,7.0199;-1.8289,.544,6.5582;-7.4373,.8295,7.727;-7.3368,.0166,8.4697;-8.2223,.5283,7.0096;-7.7971,1.7297,8.2617;-6.1082,1.088,7.0214;-5.7947,.1722,6.4944;-6.2222,1.8819,6.2623;-4.997,1.4907,7.9834;-4.7369,.656,8.6556;-5.3501,2.3231,8.6328;-3.7363,2.0095,7.3057;-3.7487,2.5967,6.2319;-2.8801,2.1418,8.0128;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724152776954</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001544882929 0.000282378581 0.032270537540 0.008758809843</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015983887 -0.000261741 0.000421464 0.000503113 0.000930969 0.001113874 0.001264715 0.001909707 0.002574500 0.003048922 0.003556569 0.004027449 0.004216464 0.004940307 0.005605756 0.006237515 0.006528349 0.007894788 0.008377333 0.009683459 0.010489852 0.011775438 0.013872315 0.015211356 0.020037774 0.021583137 0.024687565 0.025845191 0.030727602 0.035081865 0.036009261 0.039044265 0.043845958 0.044305413 0.044699246 0.048411750 0.049571926 0.050299951 0.050761284 0.052195381 0.052271032 0.052542350 0.053314993 0.055096170 0.056324367 0.057948061 0.059268254 0.061036666 0.062803218 0.063136077 0.066632009 0.070763606 0.073050207 0.077124773 0.078858890 0.079215216 0.080107875 0.084378097 0.084835550 0.092756248 0.096523336 0.099188223 0.104681802 0.105824204 0.109551293 0.111863229 0.114210430 0.116671595 0.117740276 0.120225319 0.131416180 0.137148257 0.140795558 0.145109587 0.147884690 0.154842493 0.155307194 0.167760291 0.173550935 0.175619299 0.181403589 0.191762752 0.198103029 0.204496546 0.211888943 0.217272350 0.224900202 0.240877572 0.257319803 0.267828829 0.316457804 0.325071988 0.357732352 0.364037987 0.422847250 0.457719606 0.511298228 0.548663380 0.567407849 0.615600389 0.632539246 0.644966448 0.690168400 0.742287640 0.749094627 0.749617382 0.760709459 0.761828337 0.771637169 0.773756241 0.785942193 0.792143159 0.799866751 0.804288270 0.814753696 0.817439636 0.822474937 0.832208928 0.836684501 0.860372432 0.872519679 0.877667933 0.879447315 0.894771893 0.901105207 0.910017865 0.916936604 0.922322895 0.925822798 0.980756942 1.299422209 1.492541349</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">94</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.92654757" y3="1.02772152" z3="3.78431331">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.26989826" y3="1.35888916" z3="2.78551963">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.14014625" y3="1.30102974" z3="3.8817718">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.493874" y3="1.60449936" z3="4.53504644">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.13001268" y3="-0.47718019" z3="3.96103122">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78330312" y3="-0.77717877" z3="4.96564202">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49441201" y3="-1.01900803" z3="3.23276273">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58275113" y3="-0.93146965" z3="3.77703365">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.63013491" y3="-2.03274152" z3="3.88015659">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88812107" y3="-0.70263322" z3="2.73509738">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.6083312" y3="-0.31405031" z3="4.74048617">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61436304" y3="-0.62106829" z3="4.40455712">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.56671493" y3="0.78996289" z3="4.70462659">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.47474527" y3="-0.80173147" z3="6.19100806">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.26891684" y3="-0.62485576" z3="8.39710586">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.1652221" y3="-1.16665217" z3="8.75344248">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.09627506" y3="0.21835326" z3="9.10266148">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.059486" y3="-1.57298222" z3="8.49885398">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88222653" y3="-1.84660981" z3="9.56122163">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.1563209" y3="-1.02620914" z3="8.16284236">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22653739" y3="-2.85042295" z3="7.67665686">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.37103782" y3="-2.57291589" z3="6.61675782">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.17057391" y3="-3.34083951" z3="7.97197353">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.07025572" y3="-3.84764558" z3="7.79269542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.34163138" y3="-4.76958597" z3="7.24402067">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.05890734" y3="-4.14850358" z3="8.85221936">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26425481" y3="-3.32963803" z3="7.25261966">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.63883744" y3="-2.47239675" z3="7.84063229">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.04265355" y3="-4.11475794" z3="7.27433883">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.15313305" y3="-2.98757332" z3="6.20640322">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.21783205" y3="-1.74246086" z3="6.5610935">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.56247402" y3="-0.11745121" z3="7.01634057">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.82532337" y3="0.54550152" z3="6.55144245">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43275812" y3="0.8237647" z3="7.72882791">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.32645725" y3="0.00408554" z3="8.46326645">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22071879" y3="0.5269247" z3="7.01293126">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79323677" y3="1.71809966" z3="8.27410681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10797654" y3="1.09161362" z3="7.01920919">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79639688" y3="0.18056877" z3="6.48504504">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.22749215" y3="1.89012266" z3="6.26642822">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99324117" y3="1.48839041" z3="7.97937212">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73041368" y3="0.6473532" z3="8.6450138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34568939" y3="2.31642855" z3="8.63788118">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73475444" y3="2.00880732" z3="7.30073981">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.74780075" y3="2.59423198" z3="6.22579831">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87764302" y3="2.1426698" z3="8.00689344">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9265,1.0277,3.7843;-1.2699,1.3589,2.7855;.1401,1.301,3.8818;-1.4939,1.6045,4.535;-1.13,-.4772,3.961;-.7833,-.7772,4.9656;-.4944,-1.019,3.2328;-2.5828,-.9315,3.777;-2.6301,-2.0327,3.8802;-2.8881,-.7026,2.7351;-3.6083,-.3141,4.7405;-4.6144,-.6211,4.4046;-3.5667,.79,4.7046;-3.4747,-.8017,6.191;-2.2689,-.6249,8.3971;-3.1652,-1.1667,8.7534;-2.0963,.2184,9.1027;-1.0595,-1.573,8.4989;-.8822,-1.8466,9.5612;-.1563,-1.0262,8.1628;-1.2265,-2.8504,7.6767;-1.371,-2.5729,6.6168;-2.1706,-3.3408,7.972;-.0703,-3.8476,7.7927;-.3416,-4.7696,7.244;.0589,-4.1485,8.8522;1.2643,-3.3296,7.2526;1.6388,-2.4724,7.8406;2.0427,-4.1148,7.2743;1.1531,-2.9876,6.2064;-4.2178,-1.7425,6.5611;-2.5625,-.1175,7.0163;-1.8253,.5455,6.5514;-7.4328,.8238,7.7288;-7.3265,.0041,8.4633;-8.2207,.5269,7.0129;-7.7932,1.7181,8.2741;-6.108,1.0916,7.0192;-5.7964,.1806,6.485;-6.2275,1.8901,6.2664;-4.9932,1.4884,7.9794;-4.7304,.6474,8.645;-5.3457,2.3164,8.6379;-3.7348,2.0088,7.3007;-3.7478,2.5942,6.2258;-2.8776,2.1427,8.0069;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724146294748</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001552331968 0.000319639503 0.026344933919 0.008599803546</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015977201 -0.000286759 0.000420124 0.000504006 0.000928736 0.001125051 0.001269045 0.001910245 0.002596669 0.003069644 0.003593578 0.004039109 0.004227741 0.005005071 0.005605513 0.006243441 0.006537337 0.007901291 0.008376663 0.009683414 0.010489284 0.011775324 0.013883882 0.015225005 0.020041465 0.021604746 0.024687538 0.025854558 0.030766433 0.035085543 0.036014602 0.039047858 0.043849407 0.044305509 0.044714814 0.048411567 0.049576107 0.050302417 0.050761671 0.052196615 0.052271161 0.052547199 0.053316248 0.055109830 0.056380915 0.057958104 0.059311170 0.061049237 0.062801968 0.063138420 0.066631627 0.070766862 0.073072828 0.077136610 0.078861449 0.079222221 0.080107759 0.084389461 0.084836355 0.092758025 0.096523271 0.099193020 0.104682704 0.105842886 0.109551834 0.111866465 0.114212380 0.116675054 0.117740282 0.120232539 0.131416364 0.137154444 0.140806259 0.145110898 0.147887425 0.154842728 0.155307610 0.167760525 0.173551532 0.175626942 0.181408594 0.191788288 0.198114261 0.204501248 0.211892515 0.217275082 0.224992111 0.240951422 0.257336362 0.267821750 0.316551952 0.325077456 0.357763767 0.364038041 0.422891423 0.457778934 0.511298917 0.548680612 0.567423277 0.615603599 0.632793558 0.644967250 0.690168679 0.742454882 0.749096836 0.749619805 0.760712483 0.761829602 0.771637763 0.773774721 0.785943162 0.792143325 0.799867268 0.804288306 0.814780742 0.817451965 0.822478961 0.832209475 0.836697870 0.860380877 0.872533974 0.877691996 0.879511055 0.894821109 0.901105566 0.910022903 0.916976716 0.922329500 0.925884846 0.980756388 1.299429787 1.492549154</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">95</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.91353806" y3="1.01360665" z3="3.79077662">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.25028024" y3="1.34705861" z3="2.7906333">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.15477811" y3="1.27885271" z3="3.89272905">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.47952116" y3="1.5948545" z3="4.53921486">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12884556" y3="-0.48948236" z3="3.96650449">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78818394" y3="-0.79184058" z3="4.97244569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49457963" y3="-1.03580814" z3="3.24065661">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58388188" y3="-0.9330296" z3="3.77725818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.63924067" y3="-2.03387717" z3="3.87782963">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88497105" y3="-0.69967422" z3="2.7351403">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60671015" y3="-0.31069316" z3="4.74032606">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61427226" y3="-0.6106016" z3="4.4027912">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.55818892" y3="0.79295449" z3="4.70666179">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.47680802" y3="-0.80265925" z3="6.18968103">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.27740977" y3="-0.6306171" z3="8.39962292">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.17314878" y3="-1.1765898" z3="8.75104826">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.10999926" y3="0.21088056" z3="9.10856125">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.0646927" y3="-1.57447619" z3="8.50181642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88664025" y3="-1.84769905" z3="9.56420817">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.16352209" y3="-1.02403355" z3="8.16624563">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22639028" y3="-2.85238824" z3="7.67904422">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.3791102" y3="-2.57503334" z3="6.62049063">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.16463108" y3="-3.35064697" z3="7.97956434">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.06148854" y3="-3.84035967" z3="7.7869098">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.32974983" y3="-4.76607095" z3="7.24329773">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.07883677" y3="-4.13718285" z3="8.84551416">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26298626" y3="-3.31292048" z3="7.23332059">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.63305192" y3="-2.44990706" z3="7.81428735">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.04904239" y3="-4.09019013" z3="7.25202717">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.14068869" y3="-2.97665801" z3="6.18709625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.21891843" y3="-1.7461365" z3="6.55424414">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.56797155" y3="-0.11950938" z3="7.01957684">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.82905738" y3="0.54344559" z3="6.5577849">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43672342" y3="0.83117119" z3="7.72738795">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.33635724" y3="0.01782331" z3="8.46939334">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2222813" y3="0.53057612" z3="7.01044259">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.7964987" y3="1.73112662" z3="8.26312709">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10812713" y3="1.08935785" z3="7.02147053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79650187" y3="0.17369838" z3="6.49455915">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.22200194" y3="1.88306068" z3="6.26279827">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.996035" y3="1.49032744" z3="7.98304929">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73519974" y3="0.65324667" z3="8.653485">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34953783" y3="2.32157442" z3="8.63572155">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73576428" y3="2.00875825" z3="7.30543124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.74745959" y3="2.59565238" z3="6.23136654">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87911323" y3="2.14051517" z3="8.01234608">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9135,1.0136,3.7908;-1.2503,1.3471,2.7906;.1548,1.2789,3.8927;-1.4795,1.5949,4.5392;-1.1288,-.4895,3.9665;-.7882,-.7918,4.9724;-.4946,-1.0358,3.2407;-2.5839,-.933,3.7773;-2.6392,-2.0339,3.8778;-2.885,-.6997,2.7351;-3.6067,-.3107,4.7403;-4.6143,-.6106,4.4028;-3.5582,.793,4.7067;-3.4768,-.8027,6.1897;-2.2774,-.6306,8.3996;-3.1731,-1.1766,8.751;-2.11,.2109,9.1086;-1.0647,-1.5745,8.5018;-.8866,-1.8477,9.5642;-.1635,-1.024,8.1662;-1.2264,-2.8524,7.679;-1.3791,-2.575,6.6205;-2.1646,-3.3506,7.9796;-.0615,-3.8404,7.7869;-.3297,-4.7661,7.2433;.0788,-4.1372,8.8455;1.263,-3.3129,7.2333;1.6331,-2.4499,7.8143;2.049,-4.0902,7.252;1.1407,-2.9767,6.1871;-4.2189,-1.7461,6.5542;-2.568,-.1195,7.0196;-1.8291,.5434,6.5578;-7.4367,.8312,7.7274;-7.3364,.0178,8.4694;-8.2223,.5306,7.0104;-7.7965,1.7311,8.2631;-6.1081,1.0894,7.0215;-5.7965,.1737,6.4946;-6.222,1.8831,6.2628;-4.996,1.4903,7.983;-4.7352,.6532,8.6535;-5.3495,2.3216,8.6357;-3.7358,2.0088,7.3054;-3.7475,2.5957,6.2314;-2.8791,2.1405,8.0123;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724157002644</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000472676755 0.000099438213 0.025017897638 0.008530004804</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015630873 -0.001024808 0.000022034 0.000493434 0.000583735 0.000989826 0.001236323 0.001892615 0.002413453 0.002989918 0.003544031 0.004057681 0.004240341 0.004844251 0.005602559 0.006256829 0.006567246 0.007901482 0.008373673 0.009690288 0.010474315 0.011771149 0.013941607 0.015246558 0.020047813 0.021652196 0.024682871 0.025854199 0.030962740 0.035086071 0.036051760 0.039055003 0.043856698 0.044305409 0.044804527 0.048415220 0.049608935 0.050307418 0.050764736 0.052216395 0.052273122 0.052580520 0.053314215 0.055168081 0.056599686 0.057919394 0.059619823 0.061154296 0.062802414 0.063135937 0.066629608 0.070771818 0.073198510 0.077226299 0.078879913 0.079290165 0.080108451 0.084435618 0.084874711 0.092757086 0.096523529 0.099219695 0.104685620 0.105954140 0.109553965 0.111885446 0.114225268 0.116705018 0.117743071 0.120276923 0.131414477 0.137162599 0.140889632 0.145103073 0.147916732 0.154847802 0.155301141 0.167764255 0.173559666 0.175618668 0.181440941 0.191967172 0.198198222 0.204510985 0.211896488 0.217276628 0.225409320 0.241168040 0.257406081 0.267806003 0.316939818 0.325092136 0.357903805 0.364021205 0.423097554 0.458082273 0.511304752 0.548736997 0.567535294 0.615604075 0.633998506 0.644982119 0.690169797 0.743053552 0.749099744 0.749628801 0.760724831 0.761873631 0.771640189 0.773847247 0.785949892 0.792150622 0.799877620 0.804288859 0.814911463 0.817468984 0.822486550 0.832213536 0.836744858 0.860440039 0.872611416 0.877813200 0.879803431 0.895017852 0.901108023 0.910084714 0.917100921 0.922367641 0.926177165 0.980758114 1.299474386 1.492562581</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">96</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.91740766" y3="1.0105667" z3="3.78922197">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.2544849" y3="1.34586349" z3="2.78973647">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.15108824" y3="1.27659881" z3="3.89156687">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.48392323" y3="1.59025258" z3="4.53890055">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.13065651" y3="-0.49317762" z3="3.96178979">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78756154" y3="-0.79737176" z3="4.96629761">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49665635" y3="-1.03660807" z3="3.23383622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58544534" y3="-0.9382897" z3="3.77327422">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.63958785" y3="-2.03904498" z3="3.87473962">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88664643" y3="-0.7061538" z3="2.73084256">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60930381" y3="-0.31523431" z3="4.73513456">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61689799" y3="-0.61337543" z3="4.39554726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.55937262" y3="0.78849607" z3="4.70165382">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48386907" y3="-0.80742049" z3="6.18501003">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.28671168" y3="-0.64132207" z3="8.39608023">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.18290173" y3="-1.19068968" z3="8.74081537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.12682823" y3="0.19974406" z3="9.10726683">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07140479" y3="-1.58067815" z3="8.50471132">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90167202" y3="-1.85871963" z3="9.56757244">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.16918966" y3="-1.02540103" z3="8.17948562">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22123309" y3="-2.85421901" z3="7.67321604">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.36585913" y3="-2.57028996" z3="6.61491119">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.16040003" y3="-3.35813105" z3="7.96295623">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.05275262" y3="-3.83714848" z3="7.78514143">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.31160098" y3="-4.76028472" z3="7.23200519">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.07736594" y3="-4.14155846" z3="8.84289212">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.27339083" y3="-3.2976222" z3="7.24653463">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.63336371" y3="-2.43953696" z3="7.83930525">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06292387" y3="-4.07071681" z3="7.26492863">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.15760479" y3="-2.95184426" z3="6.20198321">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23360348" y3="-1.74525614" z3="6.54949831">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.57082304" y3="-0.13048589" z3="7.01461542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.82901359" y3="0.5282915" z3="6.5543431">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43642781" y3="0.84623876" z3="7.7354989">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.33610604" y3="0.03144633" z3="8.47597228">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22699579" y3="0.55173" z3="7.02177749">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.78754112" y3="1.74735782" z3="8.27344472">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10962992" y3="1.0986334" z3="7.02429945">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80453848" y3="0.18328834" z3="6.49056662">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.22149147" y3="1.89741179" z3="6.26975534">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99188293" y3="1.48669652" z3="7.98423062">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73385874" y3="0.64476611" z3="8.64772458">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.33668126" y3="2.31482446" z3="8.64275681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73200796" y3="2.00493181" z3="7.30467537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.74408343" y3="2.59332619" z3="6.23196557">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87265384" y3="2.13057216" z3="8.00940638">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9174,1.0106,3.7892;-1.2545,1.3459,2.7897;.1511,1.2766,3.8916;-1.4839,1.5903,4.5389;-1.1307,-.4932,3.9618;-.7876,-.7974,4.9663;-.4967,-1.0366,3.2338;-2.5854,-.9383,3.7733;-2.6396,-2.039,3.8747;-2.8866,-.7062,2.7308;-3.6093,-.3152,4.7351;-4.6169,-.6134,4.3955;-3.5594,.7885,4.7017;-3.4839,-.8074,6.185;-2.2867,-.6413,8.3961;-3.1829,-1.1907,8.7408;-2.1268,.1997,9.1073;-1.0714,-1.5807,8.5047;-.9017,-1.8587,9.5676;-.1692,-1.0254,8.1795;-1.2212,-2.8542,7.6732;-1.3659,-2.5703,6.6149;-2.1604,-3.3581,7.963;-.0528,-3.8371,7.7851;-.3116,-4.7603,7.232;.0774,-4.1416,8.8429;1.2734,-3.2976,7.2465;1.6334,-2.4395,7.8393;2.0629,-4.0707,7.2649;1.1576,-2.9518,6.202;-4.2336,-1.7453,6.5495;-2.5708,-.1305,7.0146;-1.829,.5283,6.5543;-7.4364,.8462,7.7355;-7.3361,.0314,8.476;-8.227,.5517,7.0218;-7.7875,1.7474,8.2734;-6.1096,1.0986,7.0243;-5.8045,.1833,6.4906;-6.2215,1.8974,6.2698;-4.9919,1.4867,7.9842;-4.7339,.6448,8.6477;-5.3367,2.3148,8.6428;-3.732,2.0049,7.3047;-3.7441,2.5933,6.232;-2.8727,2.1306,8.0094;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724145534458</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002680294140 0.000448290642 0.027523633038 0.008506530989</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015621151 -0.000032636 0.000147246 0.000493684 0.000583349 0.000991044 0.001236796 0.001892868 0.002416299 0.002999370 0.003544016 0.004057511 0.004244603 0.004844535 0.005636122 0.006259874 0.006568497 0.007909840 0.008387013 0.009706829 0.010474290 0.011774776 0.013959285 0.015248351 0.020049255 0.021658561 0.024688532 0.025854605 0.031003352 0.035086141 0.036055850 0.039056377 0.043874337 0.044306700 0.044820409 0.048417620 0.049610003 0.050307920 0.050765525 0.052217552 0.052279067 0.052580733 0.053315549 0.055169020 0.056639874 0.057920503 0.059619688 0.061154782 0.062812013 0.063136199 0.066630471 0.070779775 0.073200921 0.077232023 0.078880706 0.079290163 0.080111706 0.084437779 0.084888982 0.092761781 0.096523922 0.099220535 0.104688679 0.105986891 0.109554595 0.111888421 0.114225592 0.116710330 0.117751031 0.120285327 0.131415357 0.137191630 0.140948601 0.145103785 0.147918612 0.154847549 0.155305284 0.167768681 0.173563763 0.175620081 0.181457742 0.191984347 0.198201410 0.204512789 0.212033638 0.217285458 0.225418373 0.241184816 0.257409148 0.267861450 0.316945699 0.325113621 0.357913425 0.364021320 0.423111945 0.458104538 0.511313903 0.548748937 0.567573585 0.615613484 0.634609017 0.644986207 0.690189603 0.743155104 0.749100200 0.749631135 0.760729200 0.761874126 0.771651493 0.773890231 0.785950227 0.792150750 0.799877629 0.804290274 0.815041501 0.817566591 0.822486395 0.832223370 0.836832328 0.860478845 0.872616539 0.877899939 0.879803087 0.895030754 0.901120847 0.910158859 0.917107666 0.922381101 0.926179245 0.980923560 1.299573702 1.492568809</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">97</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.90363959" y3="0.9972337" z3="3.79675383">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.23405036" y3="1.33444075" z3="2.79574193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.16608011" y3="1.2552265" z3="3.90361412">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.46897879" y3="1.58101349" z3="4.54382792">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12975956" y3="-0.5047401" z3="3.96922337">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79498638" y3="-0.81107865" z3="4.97605695">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49637522" y3="-1.05431196" z3="3.2449494">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58711297" y3="-0.9381124" z3="3.77394351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65015521" y3="-2.03879997" z3="3.8720198">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88315382" y3="-0.70048459" z3="2.73131303">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60875577" y3="-0.31101511" z3="4.73515866">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61726565" y3="-0.60337315" z3="4.39401783">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.55264188" y3="0.79234997" z3="4.70433305">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48619682" y3="-0.80736208" z3="6.18361548">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29510914" y3="-0.64578118" z3="8.39878039">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19052338" y3="-1.19935634" z3="8.73902326">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.13933127" y3="0.1929976" z3="9.1139175">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07650095" y3="-1.58122235" z3="8.50611506">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90408474" y3="-1.85751295" z3="9.56861985">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.17709304" y3="-1.0225067" z3="8.17948541">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.2222059" y3="-2.85694739" z3="7.67679511">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.37731296" y3="-2.575895" z3="6.61973941">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15394628" y3="-3.36874966" z3="7.97463276">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.04471297" y3="-3.83071465" z3="7.77964086">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.30111346" y3="-4.75771186" z3="7.23266314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.10042569" y3="-4.1298423" z3="8.83682715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.27212621" y3="-3.28372834" z3="7.22676717">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.63222635" y3="-2.41930174" z3="7.81178162">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06821238" y3="-4.05111377" z3="7.23966827">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.1442835" y3="-2.94264483" z3="6.18307467">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23292723" y3="-1.74905128" z3="6.54278017">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.57778722" y3="-0.12970675" z3="7.01896518">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83328678" y3="0.5301513" z3="6.56098257">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43986421" y3="0.85082254" z3="7.7331629">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.34552889" y3="0.0391574" z3="8.47787573">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22771704" y3="0.5537643" z3="7.01736858">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79297269" y3="1.75510403" z3="8.26672147">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10957148" y3="1.09757253" z3="7.02582249">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80518999" y3="0.17876898" z3="6.49996794">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21768679" y3="1.89123203" z3="6.26614518">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99387841" y3="1.49158623" z3="7.98610849">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.73644778" y3="0.65220471" z3="8.65515899">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34204552" y3="2.32381137" z3="8.640619">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73184699" y3="2.00278912" z3="7.30716798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.74191521" y3="2.59132031" z3="6.23373925">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.8736507" y3="2.12997446" z3="8.01320181">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9036,.9972,3.7968;-1.2341,1.3344,2.7957;.1661,1.2552,3.9036;-1.469,1.581,4.5438;-1.1298,-.5047,3.9692;-.795,-.8111,4.9761;-.4964,-1.0543,3.2449;-2.5871,-.9381,3.7739;-2.6502,-2.0388,3.872;-2.8832,-.7005,2.7313;-3.6088,-.311,4.7352;-4.6173,-.6034,4.394;-3.5526,.7923,4.7043;-3.4862,-.8074,6.1836;-2.2951,-.6458,8.3988;-3.1905,-1.1994,8.739;-2.1393,.193,9.1139;-1.0765,-1.5812,8.5061;-.9041,-1.8575,9.5686;-.1771,-1.0225,8.1795;-1.2222,-2.8569,7.6768;-1.3773,-2.5759,6.6197;-2.1539,-3.3687,7.9746;-.0447,-3.8307,7.7796;-.3011,-4.7577,7.2327;.1004,-4.1298,8.8368;1.2721,-3.2837,7.2268;1.6322,-2.4193,7.8118;2.0682,-4.0511,7.2397;1.1443,-2.9426,6.1831;-4.2329,-1.7491,6.5428;-2.5778,-.1297,7.019;-1.8333,.5302,6.561;-7.4399,.8508,7.7332;-7.3455,.0392,8.4779;-8.2277,.5538,7.0174;-7.793,1.7551,8.2667;-6.1096,1.0976,7.0258;-5.8052,.1788,6.5;-6.2177,1.8912,6.2661;-4.9939,1.4916,7.9861;-4.7364,.6522,8.6552;-5.342,2.3238,8.6406;-3.7318,2.0028,7.3072;-3.7419,2.5913,6.2337;-2.8737,2.13,8.0132;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724158059991</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000835757877 0.000184747118 0.027761115581 0.008528059554</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015419325 -0.000133028 0.000156766 0.000487569 0.000599898 0.000985735 0.001240277 0.001828895 0.002466648 0.003003136 0.003543354 0.004059344 0.004242236 0.004855355 0.005632211 0.006273171 0.006563165 0.007918110 0.008398060 0.009697645 0.010470974 0.011777114 0.013962021 0.015250956 0.020050855 0.021661645 0.024700609 0.025864860 0.031033687 0.035086821 0.036056232 0.039057220 0.043880520 0.044308128 0.044834027 0.048418498 0.049609368 0.050311403 0.050765343 0.052217875 0.052279198 0.052579050 0.053316526 0.055169576 0.056664006 0.057932611 0.059595572 0.061139346 0.062827854 0.063134196 0.066631795 0.070778280 0.073201269 0.077231751 0.078878800 0.079291693 0.080108893 0.084438385 0.084894129 0.092765157 0.096523805 0.099220781 0.104692837 0.106009353 0.109554172 0.111888801 0.114225434 0.116709171 0.117757154 0.120289303 0.131415129 0.137196591 0.140956652 0.145129542 0.147918992 0.154848485 0.155304995 0.167769137 0.173565209 0.175621760 0.181463326 0.191985502 0.198205193 0.204518325 0.212071484 0.217295558 0.225415538 0.241174614 0.257408781 0.267902609 0.316943595 0.325117546 0.357916792 0.364033852 0.423120795 0.458111042 0.511313519 0.548755153 0.567593930 0.615613292 0.634684907 0.644989230 0.690193226 0.743247073 0.749099866 0.749636025 0.760729977 0.761876740 0.771657892 0.773892698 0.785950726 0.792151899 0.799878131 0.804298413 0.815116684 0.817572953 0.822493291 0.832232382 0.836851677 0.860480552 0.872619059 0.877920730 0.879834327 0.895035206 0.901120905 0.910171234 0.917108008 0.922400472 0.926178249 0.980937390 1.299630085 1.492568397</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">98</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.89040469" y3="0.9824367" z3="3.80420061">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.2149239" y3="1.3222889" z3="2.80217444">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.18101676" y3="1.23176749" z3="3.91443365">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.45315906" y3="1.57088479" z3="4.54948018">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12894547" y3="-0.51745617" z3="3.97581114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79924441" y3="-0.82584621" z3="4.98350227">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49794393" y3="-1.07158036" z3="3.25331262">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58900683" y3="-0.93943104" z3="3.77654095">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.66081023" y3="-2.03967137" z3="3.8721597">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88146959" y3="-0.69715347" z3="2.73398095">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.606742" y3="-0.30679276" z3="4.73828933">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61744883" y3="-0.59185299" z3="4.39668963">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54369955" y3="0.79618668" z3="4.70917786">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48623235" y3="-0.80706133" z3="6.18554122">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30074871" y3="-0.64823501" z3="8.40336618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.1952182" y3="-1.2051913" z3="8.74055646">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14821492" y3="0.18859402" z3="9.12141209">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07964943" y3="-1.58085504" z3="8.50867939">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90469157" y3="-1.85769741" z3="9.57059982">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.1821265" y3="-1.01969473" z3="8.1810197">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22359373" y3="-2.85616899" z3="7.67871441">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.38905981" y3="-2.57479338" z3="6.6230171">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15075933" y3="-3.37363442" z3="7.98310672">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03941645" y3="-3.82303152" z3="7.77191328">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29645501" y3="-4.75268053" z3="7.22903434">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.11825671" y3="-4.11978069" z3="8.82827091">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26891854" y3="-3.26912722" z3="7.20507257">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62808335" y3="-2.40081019" z3="7.7840205">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06974519" y3="-4.03131768" z3="7.21450862">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.12869146" y3="-2.93360784" z3="6.16059815">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.2301055" y3="-1.75286253" z3="6.53955083">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58218184" y3="-0.12864829" z3="7.0245705">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8361166" y3="0.52973432" z3="6.56894622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44250064" y3="0.8525074" z3="7.72817405">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35137692" y3="0.04657452" z3="8.47963984">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22729024" y3="0.55000932" z3="7.01109759">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79734323" y3="1.760951" z3="8.25183539">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10870006" y3="1.09328993" z3="7.02587508">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80124308" y3="0.17094824" z3="6.50709371">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21288017" y3="1.88173794" z3="6.26039486">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99775248" y3="1.49445875" z3="7.98892898">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.743379" y3="0.66152356" z3="8.66559257">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.3487495" y3="2.33154128" z3="8.63400505">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73255082" y3="2.00500885" z3="7.31230561">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.74007092" y3="2.59433893" z3="6.23977727">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87647532" y3="2.13065603" z3="8.02091592">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8904,.9824,3.8042;-1.2149,1.3223,2.8022;.181,1.2318,3.9144;-1.4532,1.5709,4.5495;-1.1289,-.5175,3.9758;-.7992,-.8258,4.9835;-.4979,-1.0716,3.2533;-2.589,-.9394,3.7765;-2.6608,-2.0397,3.8722;-2.8815,-.6972,2.734;-3.6067,-.3068,4.7383;-4.6174,-.5919,4.3967;-3.5437,.7962,4.7092;-3.4862,-.8071,6.1855;-2.3007,-.6482,8.4034;-3.1952,-1.2052,8.7406;-2.1482,.1886,9.1214;-1.0796,-1.5809,8.5087;-.9047,-1.8577,9.5706;-.1821,-1.0197,8.181;-1.2236,-2.8562,7.6787;-1.3891,-2.5748,6.623;-2.1508,-3.3736,7.9831;-.0394,-3.823,7.7719;-.2965,-4.7527,7.229;.1183,-4.1198,8.8283;1.2689,-3.2691,7.2051;1.6281,-2.4008,7.784;2.0697,-4.0313,7.2145;1.1287,-2.9336,6.1606;-4.2301,-1.7529,6.5396;-2.5822,-.1286,7.0246;-1.8361,.5297,6.5689;-7.4425,.8525,7.7282;-7.3514,.0466,8.4796;-8.2273,.55,7.0111;-7.7973,1.761,8.2518;-6.1087,1.0933,7.0259;-5.8012,.1709,6.5071;-6.2129,1.8817,6.2604;-4.9978,1.4945,7.9889;-4.7434,.6615,8.6656;-5.3487,2.3315,8.634;-3.7326,2.005,7.3123;-3.7401,2.5943,6.2398;-2.8765,2.1307,8.0209;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724160729004</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001240118287 0.000262175790 0.028776054357 0.008534724203</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015418696 -0.000105600 0.000110509 0.000472504 0.000594016 0.000985145 0.001241381 0.001806570 0.002405886 0.003012657 0.003537262 0.004067081 0.004244547 0.004868759 0.005614010 0.006254331 0.006539371 0.007920021 0.008393509 0.009684724 0.010450841 0.011777657 0.013963796 0.015252391 0.020051467 0.021661611 0.024691143 0.025858796 0.031066938 0.035092776 0.036058229 0.039063675 0.043882502 0.044309107 0.044859801 0.048421854 0.049610969 0.050313420 0.050765280 0.052217186 0.052278937 0.052576418 0.053316208 0.055172919 0.056674881 0.057935949 0.059591330 0.061140116 0.062849748 0.063132814 0.066633191 0.070790852 0.073203337 0.077236413 0.078878947 0.079298411 0.080116303 0.084440146 0.084887116 0.092770331 0.096525314 0.099218264 0.104695042 0.106027815 0.109553876 0.111889636 0.114226976 0.116713082 0.117760724 0.120287239 0.131415473 0.137200323 0.140955463 0.145144201 0.147918058 0.154850208 0.155303958 0.167767930 0.173567684 0.175618318 0.181462308 0.191999630 0.198218100 0.204521066 0.212114088 0.217307916 0.225428223 0.241161962 0.257413849 0.267969267 0.316950119 0.325112747 0.357917354 0.364040541 0.423123099 0.458108433 0.511315244 0.548763156 0.567616576 0.615614014 0.634737062 0.644991011 0.690196233 0.743379365 0.749098709 0.749635572 0.760730657 0.761879069 0.771662755 0.773893832 0.785953849 0.792154730 0.799879856 0.804302322 0.815130051 0.817582588 0.822497157 0.832247778 0.836889299 0.860503657 0.872619661 0.877933346 0.879855928 0.895040615 0.901122465 0.910193204 0.917105601 0.922426671 0.926181064 0.980955840 1.299688017 1.492577635</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">99</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.87975039" y3="0.96982371" z3="3.81188851">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.1979287" y3="1.31136142" z3="2.80826597">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.19269896" y3="1.21253666" z3="3.92655463">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.44204989" y3="1.56166275" z3="4.5547337">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12837227" y3="-0.52867593" z3="3.98381327">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80490171" y3="-0.83855656" z3="4.99334386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49783968" y3="-1.08775848" z3="3.26424749">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59042965" y3="-0.9414398" z3="3.77971405">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.66910287" y3="-2.04146553" z3="3.87324958">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87897244" y3="-0.69534257" z3="2.73694053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.6064004" y3="-0.30504354" z3="4.74059581">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61766689" y3="-0.58501449" z3="4.39734682">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.53804467" y3="0.79764577" z3="4.71364064">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48909137" y3="-0.80854625" z3="6.18679942">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30658005" y3="-0.65355538" z3="8.40736932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20007037" y3="-1.2136948" z3="8.74187042">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15696838" y3="0.18175618" z3="9.12783599">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08263485" y3="-1.58249596" z3="8.5109698">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90464865" y3="-1.85814696" z3="9.57277835">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18787149" y3="-1.01811432" z3="8.18136536">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.2235226" y3="-2.85892666" z3="7.68192001">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.39913501" y3="-2.57898108" z3="6.62769191">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14357772" y3="-3.38399019" z3="7.99360002">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03101525" y3="-3.81620612" z3="7.76520684">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.28537579" y3="-4.74909321" z3="7.22741008">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.1389099" y3="-4.10854447" z3="8.82064543">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26667838" y3="-3.25370737" z3="7.18327784">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62447444" y3="-2.3797566" z3="7.75524445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07425544" y3="-4.00881469" z3="7.18702079">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.11488598" y3="-2.92217574" z3="6.139722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23206637" y3="-1.75644856" z3="6.53686268">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58785896" y3="-0.13018173" z3="7.02995404">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84077585" y3="0.53040737" z3="6.5759457">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44607658" y3="0.86016654" z3="7.7215253">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36328987" y3="0.05880829" z3="8.4781842">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22676625" y3="0.55581682" z3="7.00065359">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80230242" y3="1.77271304" z3="8.23867288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10763295" y3="1.09317217" z3="7.02562388">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80060729" y3="0.16675211" z3="6.51488327">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.2058097" y3="1.87703277" z3="6.25460052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00031029" y3="1.49768901" z3="7.99138496">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74778005" y3="0.66585884" z3="8.67217415">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35427293" y3="2.33760692" z3="8.63326869">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.7331253" y3="2.00297322" z3="7.3172336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73737322" y3="2.59357576" z3="6.2444939">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87787277" y3="2.12777383" z3="8.027364">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8798,.9698,3.8119;-1.1979,1.3114,2.8083;.1927,1.2125,3.9266;-1.442,1.5617,4.5547;-1.1284,-.5287,3.9838;-.8049,-.8386,4.9933;-.4978,-1.0878,3.2642;-2.5904,-.9414,3.7797;-2.6691,-2.0415,3.8732;-2.879,-.6953,2.7369;-3.6064,-.305,4.7406;-4.6177,-.585,4.3973;-3.538,.7976,4.7136;-3.4891,-.8085,6.1868;-2.3066,-.6536,8.4074;-3.2001,-1.2137,8.7419;-2.157,.1818,9.1278;-1.0826,-1.5825,8.511;-.9046,-1.8581,9.5728;-.1879,-1.0181,8.1814;-1.2235,-2.8589,7.6819;-1.3991,-2.579,6.6277;-2.1436,-3.384,7.9936;-.031,-3.8162,7.7652;-.2854,-4.7491,7.2274;.1389,-4.1085,8.8206;1.2667,-3.2537,7.1833;1.6245,-2.3798,7.7552;2.0743,-4.0088,7.187;1.1149,-2.9222,6.1397;-4.2321,-1.7564,6.5369;-2.5879,-.1302,7.03;-1.8408,.5304,6.5759;-7.4461,.8602,7.7215;-7.3633,.0588,8.4782;-8.2268,.5558,7.0007;-7.8023,1.7727,8.2387;-6.1076,1.0932,7.0256;-5.8006,.1668,6.5149;-6.2058,1.877,6.2546;-5.0003,1.4977,7.9914;-4.7478,.6659,8.6722;-5.3543,2.3376,8.6333;-3.7331,2.003,7.3172;-3.7374,2.5936,6.2445;-2.8779,2.1278,8.0274;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724161013615</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001445755831 0.000264610262 0.033518179891 0.008513968174</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015140015 -0.000378967 0.000060753 0.000412831 0.000566957 0.000943045 0.001235380 0.001715654 0.002421763 0.003036612 0.003501124 0.004059461 0.004246086 0.004955913 0.005580768 0.006247670 0.006498371 0.007934458 0.008391725 0.009670166 0.010440631 0.011775488 0.013961034 0.015253999 0.020052838 0.021660442 0.024688298 0.025856080 0.031125445 0.035096294 0.036079432 0.039088234 0.043879128 0.044313138 0.044873427 0.048414241 0.049614368 0.050316879 0.050760455 0.052214122 0.052277537 0.052576391 0.053316324 0.055177724 0.056685137 0.057924805 0.059567331 0.061134900 0.062868973 0.063132509 0.066633606 0.070799521 0.073200662 0.077236488 0.078878104 0.079301783 0.080115026 0.084445091 0.084882093 0.092785427 0.096518786 0.099211847 0.104695703 0.106070601 0.109554316 0.111891456 0.114230584 0.116705097 0.117753322 0.120292124 0.131420083 0.137200310 0.140958396 0.145169651 0.147927787 0.154851354 0.155305053 0.167769052 0.173572975 0.175610395 0.181463761 0.192006747 0.198211452 0.204521768 0.212185878 0.217312024 0.225402232 0.241130065 0.257409005 0.268005112 0.316932785 0.325104662 0.357915609 0.364058270 0.423120058 0.458112384 0.511326539 0.548766227 0.567639006 0.615613007 0.634757431 0.644990304 0.690202137 0.743561165 0.749099502 0.749637560 0.760732656 0.761883539 0.771667718 0.773885733 0.785963366 0.792164042 0.799896952 0.804301637 0.815194839 0.817530036 0.822496487 0.832254922 0.836961419 0.860480185 0.872625831 0.877930047 0.879857861 0.895057321 0.901127176 0.910221475 0.917111465 0.922430548 0.926183433 0.980980678 1.299871646 1.492530346</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">100</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.87536536" y3="0.95610377" z3="3.82148173">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.191024" y3="1.29782472" z3="2.81746316">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.19762389" y3="1.19568549" z3="3.93740488">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.43700089" y3="1.55052342" z3="4.56337227">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12830023" y3="-0.5413958" z3="3.99252967">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80721822" y3="-0.8519042" z3="5.00237277">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49787781" y3="-1.10136953" z3="3.27410789">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59061205" y3="-0.95045326" z3="3.785092">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.67254052" y3="-2.04995969" z3="3.87962474">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87534149" y3="-0.70477751" z3="2.74125439">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60751476" y3="-0.3099075" z3="4.74242502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61895377" y3="-0.58742188" z3="4.39681664">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.53620891" y3="0.79256727" z3="4.71392521">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49534182" y3="-0.81162852" z3="6.18971785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31605667" y3="-0.66006167" z3="8.41112861">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20856653" y3="-1.22403415" z3="8.74144364">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.17108493" y3="0.17333033" z3="9.13466835">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.088781" y3="-1.58484973" z3="8.5139176">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91189385" y3="-1.86538106" z3="9.574463">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19562157" y3="-1.01540379" z3="8.18914914">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22287166" y3="-2.85739259" z3="7.67826642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.40405258" y3="-2.57283453" z3="6.62619456">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13854914" y3="-3.39042079" z3="7.9902912">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02364595" y3="-3.80738472" z3="7.75179429">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27339073" y3="-4.73715239" z3="7.20583692">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.15149832" y3="-4.10843045" z3="8.80418992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26988461" y3="-3.23171437" z3="7.173047">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62677355" y3="-2.36390216" z3="7.75476557">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07980603" y3="-3.98413457" z3="7.16437311">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.11122354" y3="-2.88865756" z3="6.13386907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.24114486" y3="-1.75737465" z3="6.53873213">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59454404" y3="-0.13470051" z3="7.03386193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84253137" y3="0.51803249" z3="6.58029932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44558298" y3="0.86726768" z3="7.72050286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35937263" y3="0.05897701" z3="8.47061149">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22933509" y3="0.56972827" z3="7.0003975">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79810745" y3="1.77586969" z3="8.2449751">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10876404" y3="1.10380908" z3="7.02282434">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80251429" y3="0.18059165" z3="6.50488535">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20685042" y3="1.89243813" z3="6.25681477">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99994035" y3="1.50112774" z3="7.98974906">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75469335" y3="0.66972984" z3="8.6717935">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34854712" y3="2.34384737" z3="8.62876665">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.7278293" y3="2.00124834" z3="7.3162669">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72835544" y3="2.59033246" z3="6.2435245">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87485155" y3="2.12406903" z3="8.02889622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8754,.9561,3.8215;-1.191,1.2978,2.8175;.1976,1.1957,3.9374;-1.437,1.5505,4.5634;-1.1283,-.5414,3.9925;-.8072,-.8519,5.0024;-.4979,-1.1014,3.2741;-2.5906,-.9505,3.7851;-2.6725,-2.05,3.8796;-2.8753,-.7048,2.7413;-3.6075,-.3099,4.7424;-4.619,-.5874,4.3968;-3.5362,.7926,4.7139;-3.4953,-.8116,6.1897;-2.3161,-.6601,8.4111;-3.2086,-1.224,8.7414;-2.1711,.1733,9.1347;-1.0888,-1.5848,8.5139;-.9119,-1.8654,9.5745;-.1956,-1.0154,8.1891;-1.2229,-2.8574,7.6783;-1.4041,-2.5728,6.6262;-2.1385,-3.3904,7.9903;-.0236,-3.8074,7.7518;-.2734,-4.7372,7.2058;.1515,-4.1084,8.8042;1.2699,-3.2317,7.173;1.6268,-2.3639,7.7548;2.0798,-3.9841,7.1644;1.1112,-2.8887,6.1339;-4.2411,-1.7574,6.5387;-2.5945,-.1347,7.0339;-1.8425,.518,6.5803;-7.4456,.8673,7.7205;-7.3594,.059,8.4706;-8.2293,.5697,7.0004;-7.7981,1.7759,8.245;-6.1088,1.1038,7.0228;-5.8025,.1806,6.5049;-6.2069,1.8924,6.2568;-4.9999,1.5011,7.9897;-4.7547,.6697,8.6718;-5.3485,2.3438,8.6288;-3.7278,2.0012,7.3163;-3.7284,2.5903,6.2435;-2.8749,2.1241,8.0289;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724154111307</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002106855475 0.000393741812 0.027336915963 0.008469540511</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015136529 -0.000195460 0.000097617 0.000411785 0.000591179 0.000944360 0.001235318 0.001729857 0.002431153 0.003038984 0.003500528 0.004075569 0.004248217 0.004975050 0.005585983 0.006249887 0.006498236 0.007944638 0.008391675 0.009672052 0.010440407 0.011775458 0.013961189 0.015258155 0.020054181 0.021661459 0.024691703 0.025858738 0.031167873 0.035099225 0.036090922 0.039112854 0.043879188 0.044315398 0.044908196 0.048418589 0.049616341 0.050319804 0.050767660 0.052215308 0.052277141 0.052577227 0.053316855 0.055185949 0.056700655 0.057926866 0.059567561 0.061140902 0.062882674 0.063132124 0.066636455 0.070817380 0.073204428 0.077241936 0.078879039 0.079310180 0.080123509 0.084445706 0.084886414 0.092795963 0.096522403 0.099211889 0.104699989 0.106109127 0.109555731 0.111893661 0.114237763 0.116704959 0.117757947 0.120298161 0.131424137 0.137202799 0.140963970 0.145180826 0.147931443 0.154853385 0.155316609 0.167772448 0.173575011 0.175615066 0.181464703 0.192027630 0.198221310 0.204521264 0.212267405 0.217336053 0.225424352 0.241126155 0.257421589 0.268035102 0.316937557 0.325107920 0.357915848 0.364064375 0.423120655 0.458113752 0.511349800 0.548770403 0.567663033 0.615618683 0.634812085 0.645007660 0.690211864 0.743890232 0.749099670 0.749639228 0.760734301 0.761885624 0.771683503 0.773888634 0.785966115 0.792199376 0.799906065 0.804307554 0.815258175 0.817530664 0.822504733 0.832258719 0.837152389 0.860504703 0.872626213 0.877971266 0.879859065 0.895090739 0.901130957 0.910245706 0.917111040 0.922438388 0.926191593 0.980999734 1.300168214 1.492536716</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">101</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.86223205" y3="0.94108305" z3="3.82658397">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.17098179" y3="1.28440591" z3="2.82065855">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.21178798" y3="1.17314716" z3="3.947501">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.42296371" y3="1.53925023" z3="4.56518216">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12718206" y3="-0.55449684" z3="3.99904565">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81244588" y3="-0.86599144" z3="5.01075925">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49850613" y3="-1.12123009" z3="3.28382512">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.59235042" y3="-0.95253714" z3="3.7876013">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68272953" y3="-2.0516964" z3="3.88133643">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87320554" y3="-0.7041955" z3="2.7433368">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.6066018" y3="-0.30581886" z3="4.74352216">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61895592" y3="-0.5769531" z3="4.39625675">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.52835949" y3="0.79622463" z3="4.71691841">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49880597" y3="-0.81010262" z3="6.18996148">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32202344" y3="-0.6630449" z3="8.41416787">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21397939" y3="-1.22987922" z3="8.74111655">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.18048664" y3="0.16901893" z3="9.14000913">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09237184" y3="-1.58451888" z3="8.51664108">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91402798" y3="-1.86365891" z3="9.57743683">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.20102702" y3="-1.01256191" z3="8.19090675">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22334699" y3="-2.85799437" z3="7.68158689">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.41343357" y3="-2.5743752" z3="6.63085238">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13259016" y3="-3.3981622" z3="7.99994926">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.0166575" y3="-3.79909374" z3="7.74612461">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.2646067" y3="-4.73200129" z3="7.20535289">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16950011" y3="-4.09561135" z3="8.7975888">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26618381" y3="-3.21500901" z3="7.15222977">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62031547" y3="-2.34244137" z3="7.72742866">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.08329798" y3="-3.95987008" z3="7.13879346">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.09641176" y3="-2.87608518" z3="6.11390995">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.245764" y3="-1.75592041" z3="6.53573189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59957841" y3="-0.13399378" z3="7.0380614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84589403" y3="0.52018795" z3="6.58580231">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44835865" y3="0.87172651" z3="7.7150509">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36994417" y3="0.06551386" z3="8.46638669">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22870531" y3="0.5744584" z3="6.99070073">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80274649" y3="1.78181256" z3="8.23767042">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10779826" y3="1.1045814" z3="7.02349557">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80301023" y3="0.1800005" z3="6.50824683">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20174625" y3="1.89262539" z3="6.25615675">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.0009456" y3="1.50047994" z3="7.993231">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75743107" y3="0.66639511" z3="8.6747588">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35123847" y3="2.34281469" z3="8.63388451">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72766159" y3="1.99623063" z3="7.32306347">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72540355" y3="2.58957946" z3="6.25114685">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87536832" y3="2.1181637" z3="8.03791621">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8622,.9411,3.8266;-1.171,1.2844,2.8207;.2118,1.1731,3.9475;-1.423,1.5393,4.5652;-1.1272,-.5545,3.999;-.8124,-.866,5.0108;-.4985,-1.1212,3.2838;-2.5924,-.9525,3.7876;-2.6827,-2.0517,3.8813;-2.8732,-.7042,2.7433;-3.6066,-.3058,4.7435;-4.619,-.577,4.3963;-3.5284,.7962,4.7169;-3.4988,-.8101,6.19;-2.322,-.663,8.4142;-3.214,-1.2299,8.7411;-2.1805,.169,9.14;-1.0924,-1.5845,8.5166;-.914,-1.8637,9.5774;-.201,-1.0126,8.1909;-1.2233,-2.858,7.6816;-1.4134,-2.5744,6.6309;-2.1326,-3.3982,7.9999;-.0167,-3.7991,7.7461;-.2646,-4.732,7.2054;.1695,-4.0956,8.7976;1.2662,-3.215,7.1522;1.6203,-2.3424,7.7274;2.0833,-3.9599,7.1388;1.0964,-2.8761,6.1139;-4.2458,-1.7559,6.5357;-2.5996,-.134,7.0381;-1.8459,.5202,6.5858;-7.4484,.8717,7.7151;-7.3699,.0655,8.4664;-8.2287,.5745,6.9907;-7.8027,1.7818,8.2377;-6.1078,1.1046,7.0235;-5.803,.18,6.5082;-6.2017,1.8926,6.2562;-5.0009,1.5005,7.9932;-4.7574,.6664,8.6748;-5.3512,2.3428,8.6339;-3.7277,1.9962,7.3231;-3.7254,2.5896,6.2511;-2.8754,2.1182,8.0379;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724155826781</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001769162280 0.000315711325 0.036860715840 0.008525026045</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.015134419 -0.000295075 0.000122768 0.000410664 0.000578213 0.000952802 0.001236864 0.001734935 0.002429348 0.003043029 0.003500740 0.004086316 0.004249441 0.004989941 0.005584503 0.006248113 0.006497779 0.007954777 0.008392804 0.009677511 0.010441877 0.011775277 0.013961204 0.015264970 0.020055063 0.021661247 0.024695480 0.025861610 0.031206268 0.035102152 0.036104379 0.039130209 0.043879480 0.044317298 0.044937686 0.048422572 0.049617403 0.050321069 0.050772046 0.052216740 0.052278300 0.052577489 0.053315668 0.055185920 0.056707043 0.057929057 0.059568100 0.061144622 0.062884622 0.063129817 0.066641573 0.070821945 0.073207691 0.077244523 0.078881274 0.079317959 0.080127240 0.084445101 0.084891799 0.092804616 0.096524316 0.099211919 0.104701111 0.106131677 0.109557077 0.111897076 0.114248694 0.116705017 0.117764394 0.120299927 0.131426447 0.137205425 0.140974562 0.145181991 0.147938056 0.154855623 0.155321373 0.167775481 0.173576569 0.175616559 0.181465120 0.192059783 0.198229577 0.204522509 0.212300892 0.217345027 0.225460010 0.241130887 0.257420896 0.268061552 0.316937862 0.325106579 0.357916185 0.364063972 0.423120557 0.458113373 0.511380769 0.548776355 0.567676527 0.615620132 0.634847376 0.645011376 0.690218957 0.744093428 0.749099924 0.749640004 0.760736448 0.761890450 0.771686172 0.773894050 0.785970078 0.792235852 0.799915661 0.804309418 0.815273745 0.817531401 0.822527381 0.832258957 0.837326964 0.860515447 0.872626673 0.878007315 0.879860256 0.895113378 0.901130364 0.910245878 0.917113898 0.922444619 0.926205881 0.981014833 1.300391455 1.492541545</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">102</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.84816177" y3="0.93321296" z3="3.83004442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.15041499" y3="1.27604036" z3="2.82203779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.22686901" y3="1.15918479" z3="3.95498537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.40839442" y3="1.53706902" z3="4.56507475">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12259136" y3="-0.56023527" z3="4.00407922">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81296199" y3="-0.87182888" z3="5.01728058">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49484122" y3="-1.13106395" z3="3.29191689">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5892477" y3="-0.94979213" z3="3.78845165">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68596335" y3="-2.04840914" z3="3.8803162">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86672665" y3="-0.69784347" z3="2.74407027">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60095063" y3="-0.29905114" z3="4.74427743">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61480021" y3="-0.56497211" z3="4.39658489">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.51801064" y3="0.80259634" z3="4.71827802">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49441635" y3="-0.80583462" z3="6.19003474">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32208973" y3="-0.65949151" z3="8.41623854">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21413984" y3="-1.22625944" z3="8.74298404">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.18037219" y3="0.17209129" z3="9.14252533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09264851" y3="-1.58138418" z3="8.51839451">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.91076768" y3="-1.85699208" z3="9.57935109">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.20235669" y3="-1.01081794" z3="8.18785163">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22670506" y3="-2.85797375" z3="7.68890359">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.42736733" y3="-2.57927046" z3="6.6388163">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13107959" y3="-3.40014691" z3="8.01747128">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.01643505" y3="-3.79486958" z3="7.7464742">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.26896799" y3="-4.73347204" z3="7.21751374">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.18503528" y3="-4.08140559" z3="8.79820295">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25679439" y3="-3.21292482" z3="7.12981334">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61778404" y3="-2.3329049" z3="7.69056794">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07545353" y3="-3.95578428" z3="7.11183351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.06941763" y3="-2.88583098" z3="6.08984063">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.2390109" y3="-1.75501289" z3="6.53194332">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59825785" y3="-0.12984327" z3="7.04012327">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84573575" y3="0.52521613" z3="6.59060715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45340782" y3="0.87010172" z3="7.71341941">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37520931" y3="0.07235758" z3="8.4758832">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23126055" y3="0.563485" z3="6.99110361">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80932717" y3="1.78661494" z3="8.22156323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.1100213" y3="1.09459881" z3="7.02402211">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80357606" y3="0.16546622" z3="6.51749525">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19913158" y3="1.87664993" z3="6.25015814">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00716006" y3="1.49684488" z3="7.99565799">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.76269759" y3="0.66748056" z3="8.68051136">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36144037" y3="2.33959886" z3="8.63184596">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73352471" y3="1.99955942" z3="7.32772956">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.7319358" y3="2.59386267" z3="6.25777062">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88321495" y3="2.12184008" z3="8.04383922">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8482,.9332,3.83;-1.1504,1.276,2.822;.2269,1.1592,3.955;-1.4084,1.5371,4.5651;-1.1226,-.5602,4.0041;-.813,-.8718,5.0173;-.4948,-1.1311,3.2919;-2.5892,-.9498,3.7885;-2.686,-2.0484,3.8803;-2.8667,-.6978,2.7441;-3.601,-.2991,4.7443;-4.6148,-.565,4.3966;-3.518,.8026,4.7183;-3.4944,-.8058,6.19;-2.3221,-.6595,8.4162;-3.2141,-1.2263,8.743;-2.1804,.1721,9.1425;-1.0926,-1.5814,8.5184;-.9108,-1.857,9.5794;-.2024,-1.0108,8.1879;-1.2267,-2.858,7.6889;-1.4274,-2.5793,6.6388;-2.1311,-3.4001,8.0175;-.0164,-3.7949,7.7465;-.269,-4.7335,7.2175;.185,-4.0814,8.7982;1.2568,-3.2129,7.1298;1.6178,-2.3329,7.6906;2.0755,-3.9558,7.1118;1.0694,-2.8858,6.0898;-4.239,-1.755,6.5319;-2.5983,-.1298,7.0401;-1.8457,.5252,6.5906;-7.4534,.8701,7.7134;-7.3752,.0724,8.4759;-8.2313,.5635,6.9911;-7.8093,1.7866,8.2216;-6.11,1.0946,7.024;-5.8036,.1655,6.5175;-6.1991,1.8766,6.2502;-5.0072,1.4968,7.9957;-4.7627,.6675,8.6805;-5.3614,2.3396,8.6318;-3.7335,1.9996,7.3277;-3.7319,2.5939,6.2578;-2.8832,2.1218,8.0438;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724158262291</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001872252349 0.000359795959 0.034818177154 0.008527404035</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.014942454 -0.000299708 0.000154322 0.000226766 0.000507242 0.000941016 0.001234377 0.001712134 0.002425779 0.003025576 0.003480770 0.004170262 0.004249673 0.004990749 0.005587353 0.006241500 0.006496050 0.007937801 0.008402590 0.009677562 0.010441789 0.011775394 0.013960948 0.015275737 0.020060638 0.021668501 0.024705116 0.025862595 0.031222576 0.035089131 0.036122023 0.039145816 0.043877959 0.044314056 0.044981346 0.048429532 0.049622262 0.050325963 0.050772934 0.052211026 0.052271633 0.052578100 0.053313014 0.055186931 0.056718308 0.057928935 0.059543312 0.061148630 0.062889302 0.063127284 0.066651836 0.070828616 0.073208047 0.077243543 0.078883448 0.079331566 0.080118998 0.084448879 0.084893907 0.092797229 0.096521522 0.099210556 0.104706316 0.106162623 0.109556901 0.111899180 0.114269946 0.116697541 0.117767660 0.120301939 0.131428444 0.137205538 0.140968684 0.145172021 0.147943062 0.154856743 0.155323851 0.167777625 0.173575287 0.175607550 0.181462564 0.192060200 0.198233444 0.204508940 0.212357500 0.217350879 0.225455820 0.241129693 0.257427571 0.268070231 0.316939964 0.325111866 0.357916564 0.364040140 0.423111626 0.458116292 0.511402588 0.548774065 0.567688701 0.615593507 0.634869682 0.645010963 0.690211083 0.744216828 0.749099425 0.749640075 0.760734472 0.761874994 0.771709187 0.773895783 0.785969998 0.792267224 0.799926673 0.804305236 0.815289101 0.817516074 0.822548822 0.832273567 0.837530108 0.860538074 0.872626497 0.878038530 0.879853363 0.895109315 0.901130099 0.910254663 0.917115414 0.922427279 0.926230786 0.981035566 1.300644076 1.492553833</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">103</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.83666762" y3="0.92102902" z3="3.83522371">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.13479495" y3="1.26289152" z3="2.82579773">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.23908382" y3="1.14196671" z3="3.96282414">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.39582978" y3="1.52888181" z3="4.56730495">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11938043" y3="-0.57055975" z3="4.01246855">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.8140322" y3="-0.88094783" z3="5.02742919">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49298087" y3="-1.14741794" z3="3.30342456">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5874574" y3="-0.95332543" z3="3.79474132">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68947369" y3="-2.05125998" z3="3.8890512">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86154684" y3="-0.70271751" z3="2.74928102">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59800182" y3="-0.2966672" z3="4.74771149">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61187866" y3="-0.55960523" z3="4.39908039">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.51091597" y3="0.80458867" z3="4.72085618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49423871" y3="-0.80282358" z3="6.19362614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.32126234" y3="-0.65728235" z3="8.42044219">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.21256194" y3="-1.22501273" z3="8.74754985">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.17970203" y3="0.1739001" z3="9.14706265">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.09085662" y3="-1.57792266" z3="8.5201177">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90483281" y3="-1.85130663" z3="9.58102351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.20242195" y3="-1.00713044" z3="8.18509163">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22736389" y3="-2.85616855" z3="7.69343663">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.4392847" y3="-2.57972813" z3="6.64495926">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.12630367" y3="-3.40171373" z3="8.03186909">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.01294654" y3="-3.78823586" z3="7.74043902">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.26845978" y3="-4.73049627" z3="7.21911684">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.20169696" y3="-4.06886348" z3="8.7907764">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24982583" y3="-3.20391321" z3="7.1045482">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61198044" y3="-2.31879099" z3="7.65574976">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.07224619" y3="-3.94265943" z3="7.08208718">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.04961975" y3="-2.88399228" z3="6.06506537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23861939" y3="-1.75231485" z3="6.53470156">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59910398" y3="-0.12630499" z3="7.04522841">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84750764" y3="0.5327745" z3="6.59592714">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45967298" y3="0.87305487" z3="7.70408603">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.39293402" y3="0.07476814" z3="8.46489761">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23387671" y3="0.57185013" z3="6.97478024">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.81502335" y3="1.7898832" z3="8.21409886">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.1119304" y3="1.09436652" z3="7.02279214">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80598254" y3="0.16516763" z3="6.51584416">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19576757" y3="1.87803537" z3="6.2496972">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.01140427" y3="1.49268988" z3="7.99886705">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.76687181" y3="0.65793426" z3="8.6793">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36836372" y3="2.33178698" z3="8.63958557">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.7369684" y3="1.99701646" z3="7.33642827">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73246383" y3="2.59649293" z3="6.2678697">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88873599" y3="2.11853855" z3="8.05562847">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8367,.921,3.8352;-1.1348,1.2629,2.8258;.2391,1.142,3.9628;-1.3958,1.5289,4.5673;-1.1194,-.5706,4.0125;-.814,-.8809,5.0274;-.493,-1.1474,3.3034;-2.5875,-.9533,3.7947;-2.6895,-2.0513,3.8891;-2.8615,-.7027,2.7493;-3.598,-.2967,4.7477;-4.6119,-.5596,4.3991;-3.5109,.8046,4.7209;-3.4942,-.8028,6.1936;-2.3213,-.6573,8.4204;-3.2126,-1.225,8.7475;-2.1797,.1739,9.1471;-1.0909,-1.5779,8.5201;-.9048,-1.8513,9.581;-.2024,-1.0071,8.1851;-1.2274,-2.8562,7.6934;-1.4393,-2.5797,6.645;-2.1263,-3.4017,8.0319;-.0129,-3.7882,7.7404;-.2685,-4.7305,7.2191;.2017,-4.0689,8.7908;1.2498,-3.2039,7.1045;1.612,-2.3188,7.6557;2.0722,-3.9427,7.0821;1.0496,-2.884,6.0651;-4.2386,-1.7523,6.5347;-2.5991,-.1263,7.0452;-1.8475,.5328,6.5959;-7.4597,.8731,7.7041;-7.3929,.0748,8.4649;-8.2339,.5719,6.9748;-7.815,1.7899,8.2141;-6.1119,1.0944,7.0228;-5.806,.1652,6.5158;-6.1958,1.878,6.2497;-5.0114,1.4927,7.9989;-4.7669,.6579,8.6793;-5.3684,2.3318,8.6396;-3.737,1.997,7.3364;-3.7325,2.5965,6.2679;-2.8887,2.1185,8.0556;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724158866059</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002639271604 0.000371346760 0.038327138244 0.008539851315</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.014904520 -0.000166774 0.000151260 0.000226059 0.000508109 0.000936608 0.001236802 0.001720144 0.002424501 0.003025592 0.003481285 0.004208744 0.004248988 0.004992281 0.005585945 0.006241294 0.006496948 0.007941461 0.008401670 0.009680223 0.010442836 0.011775296 0.013962026 0.015285702 0.020062117 0.021675293 0.024714879 0.025863985 0.031247119 0.035089709 0.036131888 0.039162230 0.043887428 0.044318528 0.045005812 0.048438995 0.049625082 0.050329997 0.050774237 0.052211295 0.052272534 0.052577984 0.053312286 0.055188606 0.056717794 0.057928381 0.059538558 0.061148574 0.062888250 0.063127575 0.066685542 0.070830337 0.073208962 0.077242630 0.078889480 0.079348061 0.080126014 0.084449550 0.084901681 0.092799115 0.096521177 0.099210858 0.104705312 0.106175527 0.109556700 0.111901676 0.114300438 0.116697875 0.117768565 0.120303081 0.131428183 0.137208086 0.140971803 0.145171559 0.147942307 0.154858912 0.155324330 0.167789631 0.173576085 0.175606776 0.181462440 0.192091876 0.198232759 0.204509882 0.212383213 0.217348263 0.225492875 0.241145873 0.257425462 0.268078178 0.316938076 0.325111399 0.357919064 0.364048933 0.423115471 0.458116715 0.511432851 0.548773732 0.567699949 0.615604825 0.634879733 0.645011434 0.690218856 0.744261900 0.749100878 0.749640234 0.760735839 0.761890288 0.771714474 0.773901839 0.785969905 0.792300665 0.799931706 0.804304893 0.815290119 0.817533829 0.822614418 0.832275686 0.837763938 0.860538079 0.872630404 0.878042190 0.879856592 0.895129702 0.901132161 0.910260926 0.917118866 0.922428192 0.926245791 0.981085796 1.301072710 1.492555093</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">104</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.8258624" y3="0.91164318" z3="3.84431214">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.11749386" y3="1.25293704" z3="2.83255033">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.25012027" y3="1.12843493" z3="3.97640224">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.3857778" y3="1.52353578" z3="4.57260827">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11525316" y3="-0.57841921" z3="4.02310861">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81454744" y3="-0.88842867" z3="5.03950846">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48856756" y3="-1.15806326" z3="3.31722107">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58437097" y3="-0.95517931" z3="3.80068505">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.69140539" y3="-2.05288029" z3="3.89363329">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.85514255" y3="-0.70210783" z3="2.75479585">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59434649" y3="-0.29501838" z3="4.7519336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60912704" y3="-0.55488322" z3="4.40214044">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.5040829" y3="0.80599525" z3="4.72431456">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49256512" y3="-0.80048326" z3="6.19832911">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31943649" y3="-0.65376157" z3="8.42486467">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20959689" y3="-1.22211797" z3="8.7539392">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.17645115" y3="0.17720132" z3="9.15152129">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08823956" y3="-1.57399928" z3="8.52072725">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89567651" y3="-1.84380121" z3="9.58140691">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.20187753" y3="-1.00398003" z3="8.17846907">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22932273" y3="-2.8554245" z3="7.6994686">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.45429068" y3="-2.58367516" z3="6.65247931">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.12206271" y3="-3.40338149" z3="8.04997592">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.0107663" y3="-3.78265576" z3="7.73550195">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.26981484" y3="-4.72896242" z3="7.22369794">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.22004301" y3="-4.05563284" z3="8.78472716">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24108187" y3="-3.19844754" z3="7.07815686">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6084813" y3="-2.30749953" z3="7.61742263">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06581006" y3="-3.93438565" z3="7.04918855">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.02494489" y3="-2.88715593" z3="6.03901002">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23590586" y3="-1.75115098" z3="6.53842029">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59927776" y3="-0.12252077" z3="7.05008804">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84750192" y3="0.53364587" z3="6.60078653">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.46565533" y3="0.87579254" z3="7.6967058">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.39844699" y3="0.07779536" z3="8.46009635">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23980742" y3="0.57350005" z3="6.96856481">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82038489" y3="1.79465578" z3="8.20188275">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11551857" y3="1.0931459" z3="7.01799443">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.81092156" y3="0.16308574" z3="6.51246609">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19408854" y3="1.87691857" z3="6.24477434">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.01761723" y3="1.48796781" z3="7.99847369">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.77738273" y3="0.65348514" z3="8.67860765">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37530138" y3="2.32617636" z3="8.63916558">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.74064992" y3="1.99526094" z3="7.34059393">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73416488" y3="2.59527009" z3="6.27366639">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.89574713" y3="2.11802461" z3="8.0635012">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8259,.9116,3.8443;-1.1175,1.2529,2.8326;.2501,1.1284,3.9764;-1.3858,1.5235,4.5726;-1.1153,-.5784,4.0231;-.8145,-.8884,5.0395;-.4886,-1.1581,3.3172;-2.5844,-.9552,3.8007;-2.6914,-2.0529,3.8936;-2.8551,-.7021,2.7548;-3.5943,-.295,4.7519;-4.6091,-.5549,4.4021;-3.5041,.806,4.7243;-3.4926,-.8005,6.1983;-2.3194,-.6538,8.4249;-3.2096,-1.2221,8.7539;-2.1765,.1772,9.1515;-1.0882,-1.574,8.5207;-.8957,-1.8438,9.5814;-.2019,-1.004,8.1785;-1.2293,-2.8554,7.6995;-1.4543,-2.5837,6.6525;-2.1221,-3.4034,8.05;-.0108,-3.7827,7.7355;-.2698,-4.729,7.2237;.22,-4.0556,8.7847;1.2411,-3.1984,7.0782;1.6085,-2.3075,7.6174;2.0658,-3.9344,7.0492;1.0249,-2.8872,6.039;-4.2359,-1.7512,6.5384;-2.5993,-.1225,7.0501;-1.8475,.5336,6.6008;-7.4657,.8758,7.6967;-7.3984,.0778,8.4601;-8.2398,.5735,6.9686;-7.8204,1.7947,8.2019;-6.1155,1.0931,7.018;-5.8109,.1631,6.5125;-6.1941,1.8769,6.2448;-5.0176,1.488,7.9985;-4.7774,.6535,8.6786;-5.3753,2.3262,8.6392;-3.7406,1.9953,7.3406;-3.7342,2.5953,6.2737;-2.8957,2.118,8.0635;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724157912695</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002115557787 0.000340117544 0.039658141156 0.008630912305</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.014853270 -0.000135569 0.000150257 0.000225828 0.000508239 0.000935638 0.001239967 0.001713817 0.002423243 0.003027096 0.003481110 0.004242126 0.004268301 0.004993765 0.005585879 0.006241101 0.006496794 0.007940549 0.008406760 0.009683702 0.010442655 0.011775148 0.013961944 0.015297165 0.020065234 0.021689793 0.024723719 0.025864187 0.031267875 0.035089817 0.036138753 0.039171522 0.043891838 0.044321517 0.045025737 0.048448690 0.049629544 0.050334048 0.050773853 0.052211336 0.052273304 0.052577740 0.053311944 0.055198654 0.056720575 0.057930630 0.059535225 0.061146477 0.062890394 0.063126543 0.066717483 0.070825926 0.073209688 0.077242009 0.078894401 0.079357646 0.080125854 0.084450798 0.084904682 0.092798097 0.096521123 0.099211166 0.104706023 0.106186763 0.109556670 0.111903157 0.114337022 0.116697412 0.117768531 0.120303603 0.131428115 0.137207497 0.140971323 0.145175425 0.147940235 0.154863934 0.155324552 0.167796821 0.173575414 0.175606492 0.181462727 0.192117153 0.198232288 0.204509711 0.212427461 0.217346182 0.225476664 0.241142629 0.257429590 0.268092028 0.316944345 0.325114474 0.357918526 0.364058254 0.423115125 0.458123728 0.511471924 0.548774450 0.567703192 0.615604617 0.634879516 0.645028350 0.690233583 0.744311759 0.749103497 0.749641008 0.760736756 0.761889629 0.771730818 0.773902785 0.785969961 0.792326715 0.799933584 0.804304647 0.815290119 0.817533335 0.822631322 0.832284008 0.838008216 0.860550704 0.872630547 0.878082734 0.879857548 0.895129806 0.901132633 0.910268645 0.917117754 0.922429319 0.926275856 0.981135160 1.301372461 1.492561553</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">105</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.81623653" y3="0.90351399" z3="3.8535425">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.10527504" y3="1.24355749" z3="2.84105897">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.25997593" y3="1.11781149" z3="3.98769302">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.3762786" y3="1.51761112" z3="4.57985037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10944672" y3="-0.58547641" z3="4.03387959">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81187533" y3="-0.89415699" z3="5.05149914">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.482356" y3="-1.16853259" z3="3.33051564">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57822411" y3="-0.96019113" z3="3.80864795">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68675552" y3="-2.05714074" z3="3.90475229">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.84493926" y3="-0.71033428" z3="2.76116394">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59042989" y3="-0.29641778" z3="4.75501481">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.6036769" y3="-0.55725201" z3="4.40333878">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.49950893" y3="0.80435038" z3="4.72508862">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.4920287" y3="-0.79849329" z3="6.2024834">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31855613" y3="-0.64959208" z3="8.42927342">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.2082902" y3="-1.21751076" z3="8.76034963">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.17394179" y3="0.18157494" z3="9.15519525">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08726296" y3="-1.56993444" z3="8.52200712">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88970613" y3="-1.83735974" z3="9.58220345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.2027764" y3="-1.00075247" z3="8.17445427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.2325825" y3="-2.8531256" z3="7.70458753">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.47065391" y3="-2.5843283" z3="6.65973361">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.11945622" y3="-3.40350254" z3="8.06665537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.01054365" y3="-3.77616059" z3="7.72872617">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27360954" y3="-4.7263501" z3="7.22595042">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.2357102" y3="-4.04261902" z3="8.77590009">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.22958372" y3="-3.19110449" z3="7.05050839">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.59848122" y3="-2.29425932" z3="7.57776449">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05743763" y3="-3.9231885" z3="7.01768381">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="0.99849275" y3="-2.8896231" z3="6.01166734">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.2351002" y3="-1.74868442" z3="6.54340276">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.60032874" y3="-0.11818294" z3="7.05497877">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84815256" y3="0.53938974" z3="6.60490402">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.46976087" y3="0.87594568" z3="7.69021885">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.41030384" y3="0.07515093" z3="8.44912617">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.24227239" y3="0.58089166" z3="6.95663903">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.82236181" y3="1.79318486" z3="8.20085487">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11763197" y3="1.09300582" z3="7.01614672">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.81271316" y3="0.16391362" z3="6.50818625">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19423643" y3="1.87893065" z3="6.24472235">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.02058868" y3="1.4848496" z3="7.99869943">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.78013351" y3="0.64654004" z3="8.67605511">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37913979" y3="2.32130655" z3="8.64147579">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.74234676" y3="1.9916482" z3="7.34403351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73349653" y3="2.59461972" z3="6.27712152">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.90067207" y3="2.11693337" z3="8.07013373">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8162,.9035,3.8535;-1.1053,1.2436,2.8411;.26,1.1178,3.9877;-1.3763,1.5176,4.5799;-1.1094,-.5855,4.0339;-.8119,-.8942,5.0515;-.4824,-1.1685,3.3305;-2.5782,-.9602,3.8086;-2.6868,-2.0571,3.9048;-2.8449,-.7103,2.7612;-3.5904,-.2964,4.755;-4.6037,-.5573,4.4033;-3.4995,.8044,4.7251;-3.492,-.7985,6.2025;-2.3186,-.6496,8.4293;-3.2083,-1.2175,8.7603;-2.1739,.1816,9.1552;-1.0873,-1.5699,8.522;-.8897,-1.8374,9.5822;-.2028,-1.0008,8.1745;-1.2326,-2.8531,7.7046;-1.4707,-2.5843,6.6597;-2.1195,-3.4035,8.0667;-.0105,-3.7762,7.7287;-.2736,-4.7264,7.226;.2357,-4.0426,8.7759;1.2296,-3.1911,7.0505;1.5985,-2.2943,7.5778;2.0574,-3.9232,7.0177;.9985,-2.8896,6.0117;-4.2351,-1.7487,6.5434;-2.6003,-.1182,7.055;-1.8482,.5394,6.6049;-7.4698,.8759,7.6902;-7.4103,.0752,8.4491;-8.2423,.5809,6.9566;-7.8224,1.7932,8.2009;-6.1176,1.093,7.0161;-5.8127,.1639,6.5082;-6.1942,1.8789,6.2447;-5.0206,1.4848,7.9987;-4.7801,.6465,8.6761;-5.3791,2.3213,8.6415;-3.7423,1.9916,7.344;-3.7335,2.5946,6.2771;-2.9007,2.1169,8.0701;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724153921250</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002341305176 0.000332357060 0.037793859436 0.008510812917</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.014780954 -0.000124812 0.000154576 0.000226627 0.000508279 0.000930282 0.001242303 0.001710124 0.002425615 0.003033480 0.003481075 0.004243145 0.004300910 0.004995018 0.005585095 0.006241041 0.006497836 0.007940540 0.008410666 0.009683393 0.010443073 0.011775246 0.013965504 0.015303039 0.020067239 0.021700408 0.024733583 0.025864617 0.031281631 0.035094389 0.036143894 0.039178394 0.043903698 0.044325037 0.045035965 0.048459798 0.049635038 0.050340296 0.050773532 0.052211485 0.052273455 0.052577762 0.053312066 0.055199921 0.056718259 0.057928804 0.059527088 0.061145572 0.062889607 0.063133821 0.066751327 0.070822617 0.073209444 0.077242784 0.078897954 0.079362454 0.080127581 0.084450861 0.084907219 0.092797626 0.096523314 0.099211720 0.104705661 0.106192422 0.109556186 0.111903457 0.114367595 0.116698210 0.117768142 0.120303937 0.131428417 0.137208574 0.140971750 0.145179722 0.147938438 0.154865939 0.155326352 0.167814556 0.173575922 0.175605655 0.181462329 0.192138614 0.198233102 0.204512464 0.212445771 0.217344386 0.225492010 0.241148558 0.257426660 0.268084613 0.316940911 0.325115300 0.357920033 0.364073358 0.423119429 0.458124340 0.511497601 0.548776935 0.567706009 0.615612295 0.634879799 0.645028173 0.690236303 0.744314419 0.749111802 0.749643216 0.760737985 0.761905398 0.771732621 0.773905902 0.785970056 0.792331684 0.799939733 0.804304193 0.815290889 0.817554826 0.822682060 0.832288469 0.838180145 0.860554429 0.872643458 0.878076559 0.879859317 0.895132929 0.901134247 0.910269822 0.917131368 0.922430146 0.926277111 0.981174004 1.301687031 1.492561608</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">106</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.82715595" y3="0.91374159" z3="3.84501965">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.1205653" y3="1.25475201" z3="2.83395447">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.24862019" y3="1.13195136" z3="3.97611754">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.38721468" y3="1.52437325" z3="4.57417384">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11419162" y3="-0.57672852" z3="4.0234575">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.81249797" y3="-0.88635053" z3="5.03960589">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48705326" y3="-1.15580135" z3="3.31711006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58244541" y3="-0.95617109" z3="3.80171941">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.68726741" y3="-2.05374954" z3="3.89621474">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.85313012" y3="-0.70535379" z3="2.75541555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59405768" y3="-0.29676523" z3="4.75171204">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60772085" y3="-0.55902703" z3="4.40163502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.50562991" y3="0.80429751" z3="4.72329322">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49249902" y3="-0.80070161" z3="6.19849468">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31887361" y3="-0.65261197" z3="8.42489517">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20927694" y3="-1.22014571" z3="8.75478735">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.17506557" y3="0.17876074" z3="9.15083461">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08821953" y3="-1.57349613" z3="8.52061981">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89563743" y3="-1.84332848" z3="9.5811741">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.20177267" y3="-1.00403025" z3="8.17826119">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23021261" y3="-2.85476153" z3="7.69952286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.45546048" y3="-2.58291937" z3="6.65277078">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.12319935" y3="-3.40193761" z3="8.05043798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.01248353" y3="-3.78287734" z3="7.7352868">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.27231546" y3="-4.72931372" z3="7.22409755">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.21841961" y3="-4.05560902" z3="8.78416129">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.23901776" y3="-3.19961113" z3="7.07743818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.60538627" y3="-2.30816295" z3="7.61555834">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06365154" y3="-3.93552493" z3="7.05012099">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.02313984" y3="-2.88997198" z3="6.03804771">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23588349" y3="-1.75074752" z3="6.53975471">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59918164" y3="-0.12184748" z3="7.05005114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84729693" y3="0.53530265" z3="6.60007736">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.46478357" y3="0.87421587" z3="7.69708623">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.39964177" y3="0.07481996" z3="8.45767508">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23878786" y3="0.57491021" z3="6.9670868">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.81879139" y3="1.79158951" z3="8.20621133">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11512674" y3="1.09324287" z3="7.01853865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80996545" y3="0.16396235" z3="6.51140751">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19523649" y3="1.87780847" z3="6.24618451">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.01643078" y3="1.48824966" z3="7.99797246">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.77472862" y3="0.65254872" z3="8.67738123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.37393871" y3="2.32632328" z3="8.63921391">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73986696" y3="1.99424641" z3="7.33938357">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73341294" y3="2.59463774" z3="6.27168163">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.89518433" y3="2.11826787" z3="8.06224381">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8272,.9137,3.845;-1.1206,1.2548,2.834;.2486,1.132,3.9761;-1.3872,1.5244,4.5742;-1.1142,-.5767,4.0235;-.8125,-.8864,5.0396;-.4871,-1.1558,3.3171;-2.5824,-.9562,3.8017;-2.6873,-2.0537,3.8962;-2.8531,-.7054,2.7554;-3.5941,-.2968,4.7517;-4.6077,-.559,4.4016;-3.5056,.8043,4.7233;-3.4925,-.8007,6.1985;-2.3189,-.6526,8.4249;-3.2093,-1.2201,8.7548;-2.1751,.1788,9.1508;-1.0882,-1.5735,8.5206;-.8956,-1.8433,9.5812;-.2018,-1.004,8.1783;-1.2302,-2.8548,7.6995;-1.4555,-2.5829,6.6528;-2.1232,-3.4019,8.0504;-.0125,-3.7829,7.7353;-.2723,-4.7293,7.2241;.2184,-4.0556,8.7842;1.239,-3.1996,7.0774;1.6054,-2.3082,7.6156;2.0637,-3.9355,7.0501;1.0231,-2.89,6.038;-4.2359,-1.7507,6.5398;-2.5992,-.1218,7.0501;-1.8473,.5353,6.6001;-7.4648,.8742,7.6971;-7.3996,.0748,8.4577;-8.2388,.5749,6.9671;-7.8188,1.7916,8.2062;-6.1151,1.0932,7.0185;-5.81,.164,6.5114;-6.1952,1.8778,6.2462;-5.0164,1.4882,7.998;-4.7747,.6525,8.6774;-5.3739,2.3263,8.6392;-3.7399,1.9942,7.3394;-3.7334,2.5946,6.2717;-2.8952,2.1183,8.0622;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724160770698</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000776339211 0.000135542651 0.024102499097 0.008506000132</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.011981645 -0.001629279 0.000023698 0.000169900 0.000230861 0.000513488 0.001243336 0.001511975 0.002410657 0.003053231 0.003481404 0.004033907 0.004244536 0.004994476 0.005567521 0.006241143 0.006503631 0.007937487 0.008321059 0.009649555 0.010441754 0.011775118 0.013981539 0.015332121 0.020044036 0.021628366 0.024825963 0.025869985 0.031339186 0.035126252 0.036192964 0.039255068 0.043992936 0.044365940 0.045083570 0.048535211 0.049670585 0.050394134 0.050773917 0.052210489 0.052275512 0.052574094 0.053319191 0.055175151 0.056647696 0.057876123 0.059391919 0.061128581 0.062865050 0.063191233 0.067032932 0.070830764 0.073224751 0.077250423 0.078923335 0.079423535 0.080154822 0.084445146 0.084951171 0.092798757 0.096540949 0.099215152 0.104687853 0.106207782 0.109547854 0.111904657 0.114535598 0.116701147 0.117766483 0.120305945 0.131428715 0.137256557 0.140977121 0.145194732 0.147938366 0.154852227 0.155326590 0.167999120 0.173604096 0.175606948 0.181448745 0.192337162 0.198246040 0.204521410 0.212647954 0.217338447 0.225568141 0.241138517 0.257371959 0.268186541 0.316885852 0.325120589 0.357923040 0.364188003 0.423127842 0.458120705 0.511621738 0.548799253 0.567740572 0.615701485 0.634889464 0.645006416 0.690236305 0.744267599 0.749153162 0.749647117 0.760744439 0.762090621 0.771717448 0.773928826 0.785973126 0.792340305 0.799997723 0.804310315 0.815293159 0.817762003 0.822927070 0.832291565 0.839010935 0.860579900 0.872723863 0.878038979 0.879873004 0.895159695 0.901148350 0.910284373 0.917175235 0.922429706 0.926287751 0.981350405 1.303215073 1.492564190</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">107</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.83667093" y3="0.92737075" z3="3.84904914">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.13637193" y3="1.26569012" z3="2.83847257">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.23727105" y3="1.15600099" z3="3.97615427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.40030995" y3="1.53268112" z3="4.58005828">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10748869" y3="-0.56610917" z3="4.02879495">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80179233" y3="-0.87229988" z3="5.04494391">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47457472" y3="-1.13792598" z3="3.32223195">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57183568" y3="-0.96108606" z3="3.80760378">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.66661007" y3="-2.05958003" z3="3.90758599">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.84363846" y3="-0.71836922" z3="2.75955953">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.5917753" y3="-0.30614548" z3="4.75216331">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60277845" y3="-0.57826799" z3="4.40025733">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.51228687" y3="0.79564958" z3="4.71906025">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49112501" y3="-0.80178845" z3="6.20205562">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31488787" y3="-0.64614448" z3="8.42601963">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20600808" y3="-1.20968677" z3="8.76063331">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.16586438" y3="0.18720641" z3="9.14859647">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08749474" y3="-1.5716323" z3="8.52118823">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.893671" y3="-1.83967734" z3="9.5820667">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19920234" y3="-1.00673037" z3="8.17531715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23686453" y3="-2.85474561" z3="7.70386998">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.46509812" y3="-2.5853241" z3="6.65725382">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13012804" y3="-3.39786324" z3="8.05958443">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02188642" y3="-3.78640306" z3="7.73706634">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.28683403" y3="-4.73367107" z3="7.23032551">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.21457313" y3="-4.05548833" z3="8.78613968">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.22835642" y3="-3.2094508" z3="7.07106307">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.59817574" y3="-2.31434634" z3="7.60187839">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05218494" y3="-3.94643553" z3="7.04608859">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.01104101" y3="-2.90605074" z3="6.03107502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23616069" y3="-1.74843795" z3="6.54894784">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59683971" y3="-0.11941977" z3="7.04982859">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84363639" y3="0.53126929" z3="6.59649879">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45952484" y3="0.86530277" z3="7.69793395">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.38562427" y3="0.05071746" z3="8.44391998">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2377998" y3="0.5771081" z3="6.96846385">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.81204793" y3="1.77307329" z3="8.22457493">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11443722" y3="1.09910153" z3="7.014097">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.8083065" y3="0.17661592" z3="6.49594931">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20202702" y3="1.8914144" z3="6.25040695">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.01281598" y3="1.48898309" z3="7.99238724">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.77335216" y3="0.65313536" z3="8.67031767">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36681899" y3="2.3268358" z3="8.63614326">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73655348" y3="1.99376602" z3="7.32987338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.732638" y3="2.58853977" z3="6.26011623">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.8917902" y3="2.12307453" z3="8.05227206">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8367,.9274,3.849;-1.1364,1.2657,2.8385;.2373,1.156,3.9762;-1.4003,1.5327,4.5801;-1.1075,-.5661,4.0288;-.8018,-.8723,5.0449;-.4746,-1.1379,3.3222;-2.5718,-.9611,3.8076;-2.6666,-2.0596,3.9076;-2.8436,-.7184,2.7596;-3.5918,-.3061,4.7522;-4.6028,-.5783,4.4003;-3.5123,.7956,4.7191;-3.4911,-.8018,6.2021;-2.3149,-.6461,8.426;-3.206,-1.2097,8.7606;-2.1659,.1872,9.1486;-1.0875,-1.5716,8.5212;-.8937,-1.8397,9.5821;-.1992,-1.0067,8.1753;-1.2369,-2.8547,7.7039;-1.4651,-2.5853,6.6573;-2.1301,-3.3979,8.0596;-.0219,-3.7864,7.7371;-.2868,-4.7337,7.2303;.2146,-4.0555,8.7861;1.2284,-3.2095,7.0711;1.5982,-2.3143,7.6019;2.0522,-3.9464,7.0461;1.011,-2.9061,6.0311;-4.2362,-1.7484,6.5489;-2.5968,-.1194,7.0498;-1.8436,.5313,6.5965;-7.4595,.8653,7.6979;-7.3856,.0507,8.4439;-8.2378,.5771,6.9685;-7.812,1.7731,8.2246;-6.1144,1.0991,7.0141;-5.8083,.1766,6.4959;-6.202,1.8914,6.2504;-5.0128,1.489,7.9924;-4.7734,.6531,8.6703;-5.3668,2.3268,8.6361;-3.7366,1.9938,7.3299;-3.7326,2.5885,6.2601;-2.8918,2.1231,8.0523;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724150177481</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.004306696042 0.000570258503 0.026371820226 0.008497325071</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.011954656 -0.000077366 0.000086639 0.000196362 0.000246677 0.000515915 0.001246387 0.001509325 0.002407474 0.003053747 0.003481165 0.004051902 0.004249315 0.004999290 0.005568097 0.006241812 0.006503650 0.007937432 0.008320647 0.009652637 0.010441821 0.011775347 0.013981584 0.015332196 0.020043697 0.021635485 0.024835971 0.025873008 0.031346807 0.035125834 0.036197175 0.039267313 0.043992956 0.044366467 0.045101820 0.048539893 0.049672970 0.050408212 0.050776113 0.052209817 0.052276373 0.052575072 0.053321532 0.055184889 0.056648416 0.057875507 0.059391294 0.061130545 0.062865046 0.063194312 0.067066134 0.070829237 0.073227461 0.077255260 0.078925790 0.079427481 0.080161233 0.084451429 0.084949141 0.092799555 0.096543268 0.099215791 0.104690622 0.106222649 0.109547546 0.111905153 0.114585768 0.116711710 0.117767115 0.120307321 0.131429288 0.137263723 0.140979176 0.145212525 0.147939101 0.154860376 0.155330306 0.168016245 0.173605109 0.175614913 0.181448226 0.192391967 0.198250763 0.204519747 0.212699223 0.217344517 0.225602142 0.241137102 0.257378913 0.268175149 0.316894228 0.325122714 0.357925018 0.364223386 0.423129397 0.458128639 0.511697899 0.548804156 0.567748155 0.615708654 0.634891434 0.645015447 0.690255095 0.744311105 0.749156976 0.749648238 0.760744923 0.762111248 0.771757806 0.773939798 0.785978079 0.792358519 0.800010376 0.804310000 0.815294953 0.817804070 0.822992302 0.832300554 0.839693767 0.860595440 0.872736055 0.878077532 0.879874347 0.895164254 0.901152087 0.910289815 0.917219756 0.922433642 0.926299880 0.981497614 1.304393521 1.492588531</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">108</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.84705189" y3="0.94388728" z3="3.84216273">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.15286878" y3="1.28258817" z3="2.83384156">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.22618026" y3="1.17845038" z3="3.96622018">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.4117647" y3="1.54419014" z3="4.57622991">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.10986614" y3="-0.55151482" z3="4.01923602">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79847217" y3="-0.85867274" z3="5.03315672">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.47699865" y3="-1.1198078" z3="3.30892035">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57337168" y3="-0.95347167" z3="3.80261272">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.66129541" y3="-2.0523885" z3="3.89961337">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.8501916" y3="-0.70944949" z3="2.75623266">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59371257" y3="-0.30572825" z3="4.75133087">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60365413" y3="-0.5825716" z3="4.40155158">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.51933676" y3="0.7964887" z3="4.71967321">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.4880073" y3="-0.80243084" z3="6.2003345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30855843" y3="-0.64354146" z3="8.42315126">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20055674" y3="-1.20396739" z3="8.76092113">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15675527" y3="0.19179787" z3="9.14284992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08325122" y3="-1.57151204" z3="8.51980199">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88979206" y3="-1.83740034" z3="9.58144387">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19387577" y3="-1.00931482" z3="8.17236448">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23600216" y3="-2.85571596" z3="7.70486178">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.45539222" y3="-2.58685194" z3="6.65611105">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13573637" y3="-3.39167935" z3="8.05579033">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02775775" y3="-3.79593006" z3="7.7483437">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29630193" y3="-4.7426453" z3="7.24176394">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.19861628" y3="-4.06491165" z3="8.79943797">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.23125419" y3="-3.22909172" z3="7.08961028">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6026406" y3="-2.33565999" z3="7.62117495">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.04956285" y3="-3.97227753" z3="7.07246041">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.02169671" y3="-2.92779065" z3="6.04614348">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23202244" y3="-1.749067" z3="6.54966657">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59193506" y3="-0.11972807" z3="7.04616399">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84102854" y3="0.53585711" z3="6.59175303">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45560564" y3="0.85823019" z3="7.70130368">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.3769266" y3="0.05029699" z3="8.45123211">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23434141" y3="0.56164726" z3="6.97516508">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.81264646" y3="1.76661193" z3="8.22494878">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11339719" y3="1.0949986" z3="7.01374141">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80499059" y3="0.17219428" z3="6.49706142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20606547" y3="1.88483433" z3="6.24804803">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.01090208" y3="1.49032165" z3="7.98861546">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.76699262" y3="0.65411927" z3="8.66712153">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36565001" y3="2.32858046" z3="8.63095686">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73675148" y3="1.99452525" z3="7.32532016">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73303271" y3="2.5886115" z3="6.25340217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.89105969" y3="2.12534584" z3="8.04604105">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8471,.9439,3.8422;-1.1529,1.2826,2.8338;.2262,1.1785,3.9662;-1.4118,1.5442,4.5762;-1.1099,-.5515,4.0192;-.7985,-.8587,5.0332;-.477,-1.1198,3.3089;-2.5734,-.9535,3.8026;-2.6613,-2.0524,3.8996;-2.8502,-.7094,2.7562;-3.5937,-.3057,4.7513;-4.6037,-.5826,4.4016;-3.5193,.7965,4.7197;-3.488,-.8024,6.2003;-2.3086,-.6435,8.4232;-3.2006,-1.204,8.7609;-2.1568,.1918,9.1428;-1.0833,-1.5715,8.5198;-.8898,-1.8374,9.5814;-.1939,-1.0093,8.1724;-1.236,-2.8557,7.7049;-1.4554,-2.5869,6.6561;-2.1357,-3.3917,8.0558;-.0278,-3.7959,7.7483;-.2963,-4.7426,7.2418;.1986,-4.0649,8.7994;1.2313,-3.2291,7.0896;1.6026,-2.3357,7.6212;2.0496,-3.9723,7.0725;1.0217,-2.9278,6.0461;-4.232,-1.7491,6.5497;-2.5919,-.1197,7.0462;-1.841,.5359,6.5918;-7.4556,.8582,7.7013;-7.3769,.0503,8.4512;-8.2343,.5616,6.9752;-7.8126,1.7666,8.2249;-6.1134,1.095,7.0137;-5.805,.1722,6.4971;-6.2061,1.8848,6.248;-5.0109,1.4903,7.9886;-4.767,.6541,8.6671;-5.3657,2.3286,8.631;-3.7368,1.9945,7.3253;-3.733,2.5886,6.2534;-2.8911,2.1253,8.046;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724157987997</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002258791886 0.000293071468 0.038273974898 0.008525769606</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.011940166 -0.000232915 0.000110099 0.000202522 0.000251557 0.000517249 0.001254169 0.001506849 0.002404618 0.003053321 0.003482171 0.004060054 0.004263601 0.005000628 0.005566367 0.006241980 0.006508787 0.007938620 0.008323638 0.009651371 0.010441422 0.011775456 0.013981615 0.015331932 0.020043528 0.021634931 0.024839003 0.025875168 0.031354423 0.035126925 0.036201097 0.039275525 0.043993380 0.044366887 0.045112269 0.048538787 0.049673919 0.050413560 0.050778843 0.052209216 0.052277833 0.052575868 0.053322552 0.055184922 0.056651362 0.057875912 0.059390796 0.061132955 0.062863772 0.063196160 0.067079967 0.070827909 0.073229593 0.077258383 0.078930498 0.079427855 0.080166194 0.084459056 0.084954604 0.092799683 0.096543420 0.099216153 0.104691923 0.106234413 0.109547761 0.111905595 0.114594754 0.116720072 0.117767752 0.120308053 0.131430864 0.137267602 0.140980102 0.145210795 0.147940275 0.154864132 0.155330351 0.168020886 0.173606006 0.175620508 0.181447815 0.192420083 0.198253113 0.204524286 0.212698117 0.217349276 0.225668743 0.241158575 0.257380040 0.268178311 0.316895208 0.325124286 0.357925306 0.364225177 0.423134848 0.458128289 0.511718685 0.548807872 0.567756152 0.615712744 0.634891468 0.645018799 0.690259281 0.744329809 0.749159428 0.749648225 0.760745548 0.762120031 0.771763438 0.773947182 0.785983664 0.792364315 0.800021556 0.804310088 0.815301572 0.817820946 0.823017104 0.832300359 0.839821163 0.860615318 0.872743158 0.878077232 0.879876976 0.895173266 0.901153610 0.910294460 0.917244137 0.922432878 0.926299370 0.981523204 1.304753096 1.492595489</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">109</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.85830614" y3="0.95187131" z3="3.8328722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.16547251" y3="1.2920269" z3="2.8254015">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.21455037" y3="1.18842002" z3="3.95608578">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.42327691" y3="1.54990771" z3="4.56889481">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11725648" y3="-0.54430727" z3="4.00696282">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80251508" y3="-0.85337852" z3="5.01944322">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48532788" y3="-1.10845722" z3="3.29333629">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58024265" y3="-0.94828273" z3="3.79396201">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.66670552" y3="-2.04775348" z3="3.88891011">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86066647" y3="-0.70207951" z3="2.74906338">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59807705" y3="-0.30399739" z3="4.74800754">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60924586" y3="-0.58053718" z3="4.40102212">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.52519567" y3="0.79818586" z3="4.71876829">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48789252" y3="-0.80389609" z3="6.19583142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30926759" y3="-0.64639619" z3="8.41844819">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20165587" y3="-1.20704087" z3="8.7546044">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15858559" y3="0.18847498" z3="9.13890917">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08425894" y3="-1.57444367" z3="8.51734818">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89537492" y3="-1.84293912" z3="9.57883523">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19346813" y3="-1.01167641" z3="8.1750741">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.2328524" y3="-2.856953" z3="7.6993375">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.43981712" y3="-2.58610881" z3="6.64834264">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13818204" y3="-3.39030323" z3="8.03954136">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02838995" y3="-3.80124255" z3="7.75591803">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29236526" y3="-4.74488712" z3="7.242293">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.18215798" y3="-4.07502689" z3="8.80901596">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24116021" y3="-3.2357799" z3="7.11750844">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61035093" y3="-2.34738618" z3="7.65944893">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.0571497" y3="-3.98195784" z3="7.10503161">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.04688232" y3="-2.92528405" z3="6.07445842">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23028708" y3="-1.75209817" z3="6.54451724">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59123487" y3="-0.12190737" z3="7.04152507">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83970418" y3="0.53119266" z3="6.58726851">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.45176861" y3="0.85922459" z3="7.70532981">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37309384" y3="0.0538326" z3="8.45885265">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22946637" y3="0.55914164" z3="6.97939271">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80783068" y3="1.77001926" z3="8.22383189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10936259" y3="1.09253423" z3="7.01742724">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80165678" y3="0.16801151" z3="6.50339719">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20087228" y3="1.88007287" z3="6.2497366">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.005941" y3="1.48993325" z3="7.99062747">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.76226302" y3="0.65706309" z3="8.6714343">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.36070028" y3="2.32957247" z3="8.63151098">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73206727" y3="1.99408356" z3="7.32393442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73078433" y3="2.58789824" z3="6.25326059">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.8847886" y3="2.12311019" z3="8.04316487">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8583,.9519,3.8329;-1.1655,1.292,2.8254;.2146,1.1884,3.9561;-1.4233,1.5499,4.5689;-1.1173,-.5443,4.007;-.8025,-.8534,5.0194;-.4853,-1.1085,3.2933;-2.5802,-.9483,3.794;-2.6667,-2.0478,3.8889;-2.8607,-.7021,2.7491;-3.5981,-.304,4.748;-4.6092,-.5805,4.401;-3.5252,.7982,4.7188;-3.4879,-.8039,6.1958;-2.3093,-.6464,8.4184;-3.2017,-1.207,8.7546;-2.1586,.1885,9.1389;-1.0843,-1.5744,8.5173;-.8954,-1.8429,9.5788;-.1935,-1.0117,8.1751;-1.2329,-2.857,7.6993;-1.4398,-2.5861,6.6483;-2.1382,-3.3903,8.0395;-.0284,-3.8012,7.7559;-.2924,-4.7449,7.2423;.1822,-4.075,8.809;1.2412,-3.2358,7.1175;1.6104,-2.3474,7.6594;2.0571,-3.982,7.105;1.0469,-2.9253,6.0745;-4.2303,-1.7521,6.5445;-2.5912,-.1219,7.0415;-1.8397,.5312,6.5873;-7.4518,.8592,7.7053;-7.3731,.0538,8.4589;-8.2295,.5591,6.9794;-7.8078,1.77,8.2238;-6.1094,1.0925,7.0174;-5.8017,.168,6.5034;-6.2009,1.8801,6.2497;-5.0059,1.4899,7.9906;-4.7623,.6571,8.6714;-5.3607,2.3296,8.6315;-3.7321,1.9941,7.3239;-3.7308,2.5879,6.2533;-2.8848,2.1231,8.0432;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724159367521</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002704260024 0.000327121614 0.042662962350 0.008541391551</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.011902371 -0.000078469 0.000103342 0.000209722 0.000261601 0.000527143 0.001260644 0.001506116 0.002401959 0.003052129 0.003481289 0.004063397 0.004269939 0.005000919 0.005565379 0.006242111 0.006514997 0.007941950 0.008332058 0.009651591 0.010442184 0.011776362 0.013984461 0.015332065 0.020043689 0.021636213 0.024838985 0.025874604 0.031364253 0.035128464 0.036204087 0.039279603 0.043995845 0.044368596 0.045123721 0.048538713 0.049674222 0.050418331 0.050780044 0.052209256 0.052279102 0.052576717 0.053323562 0.055187969 0.056651286 0.057879515 0.059395736 0.061132895 0.062864159 0.063196798 0.067087883 0.070830970 0.073233759 0.077261406 0.078935183 0.079428183 0.080166478 0.084466990 0.084965316 0.092800201 0.096543626 0.099216219 0.104693902 0.106245958 0.109547946 0.111907051 0.114596590 0.116722970 0.117768165 0.120309624 0.131431816 0.137269567 0.140980539 0.145213037 0.147942877 0.154866127 0.155330668 0.168023288 0.173606931 0.175621344 0.181449176 0.192446844 0.198253460 0.204531735 0.212709411 0.217352353 0.225683448 0.241163977 0.257381210 0.268186909 0.316897122 0.325124499 0.357926129 0.364224845 0.423134864 0.458128834 0.511753155 0.548815606 0.567761208 0.615716970 0.634893240 0.645048890 0.690278034 0.744344555 0.749164333 0.749648577 0.760746422 0.762121766 0.771777433 0.773951233 0.785988266 0.792368476 0.800028009 0.804311282 0.815325232 0.817831393 0.823023936 0.832300834 0.839923699 0.860618029 0.872748223 0.878096020 0.879885288 0.895174691 0.901154193 0.910304487 0.917255578 0.922441673 0.926300286 0.981552882 1.305196428 1.492602748</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">110</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.87074013" y3="0.96038924" z3="3.82969658">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.18194126" y3="1.30087646" z3="2.82376545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.20131004" y3="1.2018086" z3="3.95111101">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.43742066" y3="1.55411701" z3="4.56798079">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12277088" y3="-0.53760167" z3="4.00085991">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.80367428" y3="-0.84810697" z3="5.01146847">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.4903562" y3="-1.09825295" z3="3.28408579">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58477585" y3="-0.94773477" z3="3.79030858">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.66535081" y3="-2.04750812" z3="3.88286372">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86839536" y3="-0.70078401" z3="2.74639139">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60433842" y3="-0.30977345" z3="4.74622665">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61427876" y3="-0.59082264" z3="4.39974328">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.53599994" y3="0.79303251" z3="4.71799035">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49183004" y3="-0.80942909" z3="6.19384185">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.31037879" y3="-0.65139185" z3="8.41529388">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20235097" y3="-1.21299515" z3="8.75094667">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.16109132" y3="0.18379657" z3="9.13570359">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08430906" y3="-1.5777824" z3="8.51518916">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89789918" y3="-1.84832168" z3="9.57695081">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19315481" y3="-1.01304628" z3="8.17646229">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22903847" y3="-2.85808532" z3="7.69289273">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.42555684" y3="-2.58352279" z3="6.6410293">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13894915" y3="-3.38974182" z3="8.02313577">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02750788" y3="-3.80576655" z3="7.75706058">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.2870508" y3="-4.74369594" z3="7.23047919">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.16773651" y3="-4.09051189" z3="8.81016367">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25297051" y3="-3.23780855" z3="7.14310115">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61819325" y3="-2.35909168" z3="7.70211189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.0651295" y3="-3.98794289" z3="7.1318433">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.07385518" y3="-2.9132201" z3="6.10149204">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.2352189" y3="-1.75565182" z3="6.54511944">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59325703" y3="-0.1272798" z3="7.03821451">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.84030833" y3="0.52489053" z3="6.58207319">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44725006" y3="0.86353053" z3="7.7097385">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36514445" y3="0.05638317" z3="8.46058213">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22867457" y3="0.56603656" z3="6.98710853">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80252141" y3="1.77257046" z3="8.2332573">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10774243" y3="1.09907749" z3="7.0168715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80270325" y3="0.17613702" z3="6.4988037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20255659" y3="1.88928082" z3="6.25179427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00083925" y3="1.49266766" z3="7.98745773">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75823987" y3="0.65749043" z3="8.66759423">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35041377" y3="2.33388965" z3="8.62821863">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72645265" y3="1.98932748" z3="7.31864864">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72458024" y3="2.58267374" z3="6.24595525">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87810114" y3="2.11835049" z3="8.03626086">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8707,.9604,3.8297;-1.1819,1.3009,2.8238;.2013,1.2018,3.9511;-1.4374,1.5541,4.568;-1.1228,-.5376,4.0009;-.8037,-.8481,5.0115;-.4904,-1.0983,3.2841;-2.5848,-.9477,3.7903;-2.6654,-2.0475,3.8829;-2.8684,-.7008,2.7464;-3.6043,-.3098,4.7462;-4.6143,-.5908,4.3997;-3.536,.793,4.718;-3.4918,-.8094,6.1938;-2.3104,-.6514,8.4153;-3.2024,-1.213,8.7509;-2.1611,.1838,9.1357;-1.0843,-1.5778,8.5152;-.8979,-1.8483,9.577;-.1932,-1.013,8.1765;-1.229,-2.8581,7.6929;-1.4256,-2.5835,6.641;-2.1389,-3.3897,8.0231;-.0275,-3.8058,7.7571;-.2871,-4.7437,7.2305;.1677,-4.0905,8.8102;1.253,-3.2378,7.1431;1.6182,-2.3591,7.7021;2.0651,-3.9879,7.1318;1.0739,-2.9132,6.1015;-4.2352,-1.7557,6.5451;-2.5933,-.1273,7.0382;-1.8403,.5249,6.5821;-7.4473,.8635,7.7097;-7.3651,.0564,8.4606;-8.2287,.566,6.9871;-7.8025,1.7726,8.2333;-6.1077,1.0991,7.0169;-5.8027,.1761,6.4988;-6.2026,1.8893,6.2518;-5.0008,1.4927,7.9875;-4.7582,.6575,8.6676;-5.3504,2.3339,8.6282;-3.7265,1.9893,7.3186;-3.7246,2.5827,6.246;-2.8781,2.1184,8.0363;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724160200071</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002376401461 0.000280151438 0.032131029721 0.008465639215</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.011882038 -0.000118012 0.000120273 0.000208326 0.000260450 0.000521632 0.001265785 0.001507719 0.002402834 0.003053234 0.003481764 0.004082738 0.004275673 0.005004720 0.005565443 0.006242196 0.006523401 0.007944869 0.008334279 0.009651629 0.010443119 0.011777293 0.013986322 0.015331804 0.020044230 0.021636386 0.024838796 0.025874400 0.031368222 0.035129807 0.036203977 0.039285319 0.044000813 0.044370895 0.045133810 0.048538659 0.049674241 0.050423786 0.050782576 0.052209313 0.052279585 0.052576875 0.053325130 0.055189797 0.056654916 0.057883434 0.059394274 0.061134592 0.062864781 0.063198286 0.067091072 0.070834690 0.073233714 0.077264562 0.078937683 0.079428177 0.080167941 0.084472157 0.084982867 0.092801112 0.096543840 0.099216257 0.104694889 0.106253814 0.109548235 0.111909075 0.114596701 0.116723852 0.117768970 0.120310275 0.131431948 0.137270978 0.140980939 0.145215010 0.147944351 0.154868307 0.155332196 0.168024613 0.173609008 0.175624682 0.181449354 0.192466003 0.198255231 0.204537112 0.212715818 0.217356905 0.225700349 0.241171669 0.257383097 0.268194243 0.316900033 0.325127107 0.357928326 0.364224833 0.423136783 0.458130564 0.511772518 0.548824101 0.567768749 0.615717139 0.634894415 0.645055236 0.690287871 0.744344383 0.749170748 0.749648657 0.760747559 0.762124639 0.771794591 0.773955258 0.785989195 0.792369718 0.800028693 0.804311906 0.815346083 0.817842523 0.823031332 0.832302964 0.839960378 0.860620105 0.872754494 0.878114332 0.879886634 0.895175555 0.901154399 0.910306892 0.917275218 0.922455134 0.926301729 0.981582075 1.305518349 1.492612170</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">111</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.88755452" y3="0.9745971" z3="3.8248445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.20522251" y3="1.31443526" z3="2.82053575">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.18281627" y3="1.22496111" z3="3.9426123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.45643245" y3="1.56194735" z3="4.56636984">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12529902" y3="-0.52579132" z3="3.99412773">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79954411" y3="-0.83516758" z3="5.00293541">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49060175" y3="-1.07867312" z3="3.27390968">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58409752" y3="-0.94870892" z3="3.78827929">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65584941" y3="-2.04922562" z3="3.88363419">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87176074" y3="-0.70678426" z3="2.74440909">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60752327" y3="-0.31637942" z3="4.74449306">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61589325" y3="-0.6047709" z3="4.39902234">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54686212" y3="0.78668092" z3="4.71467743">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.4923798" y3="-0.81254374" z3="6.19320038">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30882099" y3="-0.65181042" z3="8.41225573">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20152901" y3="-1.21142858" z3="8.74935525">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.1572116" y3="0.18388995" z3="9.1317122">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08449538" y3="-1.58071019" z3="8.512591">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90226319" y3="-1.85468239" z3="9.57382694">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19116754" y3="-1.01690937" z3="8.1787073">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22813693" y3="-2.85884867" z3="7.68684914">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.414047" y3="-2.58189264" z3="6.633547">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14344874" y3="-3.38666404" z3="8.00812986">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03185691" y3="-3.81217748" z3="7.76085341">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.28879131" y3="-4.746936" z3="7.22711548">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14998823" y3="-4.10217498" z3="8.81528835">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25832046" y3="-3.24638587" z3="7.16523118">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62101029" y3="-2.37266953" z3="7.73424292">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06704939" y3="-4.00020075" z3="7.15930852">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.09380713" y3="-2.91417599" z3="6.12368933">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23609561" y3="-1.75706732" z3="6.5481693">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59216135" y3="-0.12889582" z3="7.03486692">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83793459" y3="0.51814072" z3="6.57648673">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44241681" y3="0.86373749" z3="7.71351999">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.3593302" y3="0.05265909" z3="8.45987358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22523573" y3="0.56992238" z3="6.99042824">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79470093" y3="1.77044557" z3="8.24204432">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10470433" y3="1.10183218" z3="7.01803813">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80042293" y3="0.18041023" z3="6.49632796">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20196971" y3="1.89342091" z3="6.2551968">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99453243" y3="1.49398372" z3="7.98549875">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75297519" y3="0.66023577" z3="8.66624475">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34183542" y3="2.33649678" z3="8.62688442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72034118" y3="1.98787171" z3="7.31190511">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72079553" y3="2.57789114" z3="6.23842946">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87071958" y3="2.11857176" z3="8.02821917">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8876,.9746,3.8248;-1.2052,1.3144,2.8205;.1828,1.225,3.9426;-1.4564,1.5619,4.5664;-1.1253,-.5258,3.9941;-.7995,-.8352,5.0029;-.4906,-1.0787,3.2739;-2.5841,-.9487,3.7883;-2.6558,-2.0492,3.8836;-2.8718,-.7068,2.7444;-3.6075,-.3164,4.7445;-4.6159,-.6048,4.399;-3.5469,.7867,4.7147;-3.4924,-.8125,6.1932;-2.3088,-.6518,8.4123;-3.2015,-1.2114,8.7494;-2.1572,.1839,9.1317;-1.0845,-1.5807,8.5126;-.9023,-1.8547,9.5738;-.1912,-1.0169,8.1787;-1.2281,-2.8588,7.6868;-1.414,-2.5819,6.6335;-2.1434,-3.3867,8.0081;-.0319,-3.8122,7.7609;-.2888,-4.7469,7.2271;.15,-4.1022,8.8153;1.2583,-3.2464,7.1652;1.621,-2.3727,7.7342;2.067,-4.0002,7.1593;1.0938,-2.9142,6.1237;-4.2361,-1.7571,6.5482;-2.5922,-.1289,7.0349;-1.8379,.5181,6.5765;-7.4424,.8637,7.7135;-7.3593,.0527,8.4599;-8.2252,.5699,6.9904;-7.7947,1.7704,8.242;-6.1047,1.1018,7.018;-5.8004,.1804,6.4963;-6.202,1.8934,6.2552;-4.9945,1.494,7.9855;-4.753,.6602,8.6662;-5.3418,2.3365,8.6269;-3.7203,1.9879,7.3119;-3.7208,2.5779,6.2384;-2.8707,2.1186,8.0282;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724160608610</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002164276905 0.000255930998 0.027673225245 0.008500810134</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.011884826 -0.000105301 0.000128989 0.000209641 0.000260509 0.000526806 0.001265637 0.001508726 0.002404328 0.003052517 0.003481912 0.004091850 0.004282593 0.005011071 0.005565508 0.006243302 0.006527453 0.007951953 0.008335902 0.009652288 0.010442631 0.011779013 0.013987571 0.015331399 0.020044915 0.021636387 0.024838433 0.025874311 0.031370927 0.035130583 0.036203988 0.039291795 0.044005957 0.044374899 0.045142197 0.048538451 0.049674435 0.050429216 0.050785342 0.052209123 0.052279764 0.052576947 0.053327348 0.055193482 0.056666501 0.057885519 0.059394746 0.061136478 0.062865037 0.063200661 0.067091499 0.070837055 0.073234122 0.077267380 0.078938314 0.079428849 0.080168136 0.084479321 0.084996641 0.092802054 0.096543986 0.099216283 0.104695704 0.106261967 0.109548376 0.111911946 0.114596678 0.116723843 0.117769331 0.120310743 0.131432424 0.137272286 0.140981703 0.145217795 0.147946012 0.154868957 0.155334478 0.168025985 0.173611832 0.175628848 0.181449625 0.192483647 0.198260076 0.204541069 0.212729212 0.217361155 0.225703146 0.241172353 0.257385717 0.268199027 0.316906118 0.325127948 0.357931341 0.364225296 0.423136979 0.458131625 0.511785214 0.548833769 0.567778839 0.615720722 0.634895032 0.645065559 0.690298954 0.744344781 0.749175191 0.749649173 0.760749480 0.762127285 0.771810333 0.773958145 0.785990090 0.792369626 0.800029564 0.804312454 0.815373788 0.817847351 0.823033967 0.832304980 0.839979887 0.860620081 0.872756384 0.878131237 0.879887592 0.895176484 0.901156653 0.910318740 0.917279555 0.922479359 0.926301978 0.981613577 1.305809264 1.492616867</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">112</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.90140659" y3="0.9924708" z3="3.818191">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.2274717" y3="1.32981713" z3="2.81580754">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.16724098" y3="1.25263434" z3="3.9303678">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.47200245" y3="1.57434384" z3="4.56301742">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12487511" y3="-0.51034928" z3="3.98778207">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79268013" y3="-0.81753358" z3="4.99516576">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48758249" y3="-1.05791804" z3="3.26509567">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58049851" y3="-0.94687181" z3="3.78610701">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.64123549" y3="-2.04766877" z3="3.8828764">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87239047" y3="-0.70927891" z3="2.74234633">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60855376" y3="-0.32233368" z3="4.74206769">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61455785" y3="-0.61852844" z3="4.39649345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.55550194" y3="0.78138892" z3="4.71150527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49130158" y3="-0.81554366" z3="6.19152705">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30542038" y3="-0.65007356" z3="8.40938241">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19867452" y3="-1.20731374" z3="8.74873655">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15204919" y3="0.18741818" z3="9.12618163">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08305291" y3="-1.58104804" z3="8.51195349">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90257337" y3="-1.85415818" z3="9.57404471">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18798282" y3="-1.01955611" z3="8.17824067">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.2292116" y3="-2.85938007" z3="7.68685816">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.40706283" y3="-2.58203259" z3="6.63237423">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.1497842" y3="-3.3811186" z3="8.00279337">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03889377" y3="-3.81964786" z3="7.76851294">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29737601" y3="-4.75224039" z3="7.23197861">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.13340345" y3="-4.11177615" z3="8.82370322">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25913035" y3="-3.26127212" z3="7.1834564">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6224658" y3="-2.39071791" z3="7.75637769">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06319694" y3="-4.02011235" z3="7.18258587">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.10472136" y3="-2.92702825" z3="6.14124689">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23561877" y3="-1.7579175" z3="6.55050555">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58967118" y3="-0.13033788" z3="7.03082386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83558491" y3="0.51726391" z3="6.57023926">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43661577" y3="0.85981078" z3="7.71935726">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.34570272" y3="0.04583301" z3="8.46208908">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22386509" y3="0.5670679" z3="7.00099255">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.78873177" y3="1.76346748" z3="8.2538712">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10362949" y3="1.10368159" z3="7.01689611">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80102693" y3="0.18495822" z3="6.4902076">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20662254" y3="1.89853076" z3="6.25766569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99008509" y3="1.49343862" z3="7.98136525">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74723222" y3="0.65747218" z3="8.66030528">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.33327965" y3="2.3359203" z3="8.62408895">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71742689" y3="1.98473438" z3="7.30468912">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.7199069" y3="2.57348142" z3="6.22906215">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.86698807" y3="2.11847992" z3="8.01895202">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9014,.9925,3.8182;-1.2275,1.3298,2.8158;.1672,1.2526,3.9304;-1.472,1.5743,4.563;-1.1249,-.5103,3.9878;-.7927,-.8175,4.9952;-.4876,-1.0579,3.2651;-2.5805,-.9469,3.7861;-2.6412,-2.0477,3.8829;-2.8724,-.7093,2.7423;-3.6086,-.3223,4.7421;-4.6146,-.6185,4.3965;-3.5555,.7814,4.7115;-3.4913,-.8155,6.1915;-2.3054,-.6501,8.4094;-3.1987,-1.2073,8.7487;-2.152,.1874,9.1262;-1.0831,-1.581,8.512;-.9026,-1.8542,9.574;-.188,-1.0196,8.1782;-1.2292,-2.8594,7.6869;-1.4071,-2.582,6.6324;-2.1498,-3.3811,8.0028;-.0389,-3.8196,7.7685;-.2974,-4.7522,7.232;.1334,-4.1118,8.8237;1.2591,-3.2613,7.1835;1.6225,-2.3907,7.7564;2.0632,-4.0201,7.1826;1.1047,-2.927,6.1412;-4.2356,-1.7579,6.5505;-2.5897,-.1303,7.0308;-1.8356,.5173,6.5702;-7.4366,.8598,7.7194;-7.3457,.0458,8.4621;-8.2239,.5671,7.001;-7.7887,1.7635,8.2539;-6.1036,1.1037,7.0169;-5.801,.185,6.4902;-6.2066,1.8985,6.2577;-4.9901,1.4934,7.9814;-4.7472,.6575,8.6603;-5.3333,2.3359,8.6241;-3.7174,1.9847,7.3047;-3.7199,2.5735,6.2291;-2.867,2.1185,8.019;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724160484431</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002048031512 0.000248208100 0.030459003919 0.008415342635</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.011890126 -0.000074395 0.000132870 0.000209540 0.000269375 0.000526555 0.001265581 0.001507502 0.002412951 0.003053367 0.003481998 0.004104654 0.004286228 0.005014930 0.005568047 0.006244336 0.006528626 0.007959601 0.008338116 0.009652360 0.010442476 0.011782207 0.013989859 0.015331374 0.020044840 0.021637353 0.024839240 0.025874444 0.031376925 0.035132552 0.036204183 0.039294985 0.044014563 0.044379248 0.045150280 0.048538952 0.049674730 0.050434409 0.050787041 0.052208951 0.052279758 0.052577181 0.053328247 0.055196646 0.056674115 0.057889228 0.059395100 0.061139284 0.062865446 0.063202910 0.067091243 0.070837501 0.073234204 0.077267801 0.078938562 0.079429973 0.080168326 0.084482549 0.085011658 0.092803522 0.096544211 0.099216262 0.104695919 0.106265892 0.109548335 0.111912693 0.114597131 0.116723968 0.117769719 0.120311310 0.131432743 0.137272441 0.140982095 0.145218206 0.147947077 0.154870308 0.155341060 0.168026519 0.173613169 0.175629315 0.181449859 0.192498520 0.198264214 0.204546211 0.212732344 0.217368446 0.225702863 0.241180417 0.257387875 0.268200297 0.316906613 0.325131025 0.357934071 0.364225370 0.423138513 0.458133473 0.511798721 0.548847003 0.567784357 0.615720820 0.634895630 0.645070429 0.690311612 0.744346152 0.749186090 0.749649001 0.760749638 0.762128193 0.771824528 0.773958631 0.785990107 0.792370149 0.800029564 0.804312631 0.815387859 0.817847909 0.823041923 0.832305797 0.839984681 0.860620796 0.872760231 0.878146515 0.879886600 0.895177438 0.901157459 0.910324027 0.917295189 0.922513602 0.926301940 0.981653484 1.306074580 1.492626300</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">113</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.91522698" y3="1.00676041" z3="3.8099007">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.24919027" y3="1.34322541" z3="2.80980351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.15225952" y3="1.27389375" z3="3.91653304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.48543498" y3="1.58377406" z3="4.55843063">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12739951" y3="-0.49744862" z3="3.97819181">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78820696" y3="-0.80387983" z3="4.98339422">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48994079" y3="-1.0388262" z3="3.25179045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58076228" y3="-0.94350506" z3="3.78213857">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.63459743" y3="-2.04473051" z3="3.8801611">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87757598" y3="-0.70880253" z3="2.73912599">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60985902" y3="-0.32417541" z3="4.74067444">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61500207" y3="-0.62560604" z3="4.39743092">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.56280082" y3="0.77949085" z3="4.70943548">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48820305" y3="-0.81589569" z3="6.1904264">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30016899" y3="-0.64750503" z3="8.40606718">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19455969" y3="-1.20156432" z3="8.74796737">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14297089" y3="0.1908104" z3="9.12126121">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08059138" y3="-1.58233277" z3="8.50899089">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90332422" y3="-1.85725248" z3="9.57096066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.1828969" y3="-1.02347398" z3="8.17795438">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.2282716" y3="-2.8596617" z3="7.68250714">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.39441666" y3="-2.58130264" z3="6.62610035">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15546315" y3="-3.3749987" z3="7.9897653">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.04518618" y3="-3.82772826" z3="7.7760925">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.30396277" y3="-4.7585386" z3="7.2360839">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.11427738" y3="-4.1217263" z3="8.83329465">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.2627877" y3="-3.27643759" z3="7.20571491">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62526438" y3="-2.40896351" z3="7.784071">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06213743" y3="-4.04016531" z3="7.21304487">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.12155709" y3="-2.93982676" z3="6.16194678">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23113799" y3="-1.75848317" z3="6.55187386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58540512" y3="-0.12929185" z3="7.02718832">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8324884" y3="0.51644338" z3="6.56537214">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43381332" y3="0.85578804" z3="7.72229674">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.3437101" y3="0.04299141" z3="8.4653879">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22021388" y3="0.56167188" z3="7.00341774">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.78582391" y3="1.75963633" z3="8.2561074">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10126183" y3="1.10078275" z3="7.01913375">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79739649" y3="0.18189302" z3="6.49273599">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20619464" y3="1.89422099" z3="6.25920973">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.98640428" y3="1.49365081" z3="7.98087179">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74152819" y3="0.65984661" z3="8.6605516">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.33078423" y3="2.3361081" z3="8.62388239">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71561864" y3="1.98674062" z3="7.30114185">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72111095" y3="2.57363732" z3="6.2256935">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.86334776" y3="2.12121298" z3="8.01376314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9152,1.0068,3.8099;-1.2492,1.3432,2.8098;.1523,1.2739,3.9165;-1.4854,1.5838,4.5584;-1.1274,-.4974,3.9782;-.7882,-.8039,4.9834;-.4899,-1.0388,3.2518;-2.5808,-.9435,3.7821;-2.6346,-2.0447,3.8802;-2.8776,-.7088,2.7391;-3.6099,-.3242,4.7407;-4.615,-.6256,4.3974;-3.5628,.7795,4.7094;-3.4882,-.8159,6.1904;-2.3002,-.6475,8.4061;-3.1946,-1.2016,8.748;-2.143,.1908,9.1213;-1.0806,-1.5823,8.509;-.9033,-1.8573,9.571;-.1829,-1.0235,8.178;-1.2283,-2.8597,7.6825;-1.3944,-2.5813,6.6261;-2.1555,-3.375,7.9898;-.0452,-3.8277,7.7761;-.304,-4.7585,7.2361;.1143,-4.1217,8.8333;1.2628,-3.2764,7.2057;1.6253,-2.409,7.7841;2.0621,-4.0402,7.213;1.1216,-2.9398,6.1619;-4.2311,-1.7585,6.5519;-2.5854,-.1293,7.0272;-1.8325,.5164,6.5654;-7.4338,.8558,7.7223;-7.3437,.043,8.4654;-8.2202,.5617,7.0034;-7.7858,1.7596,8.2561;-6.1013,1.1008,7.0191;-5.7974,.1819,6.4927;-6.2062,1.8942,6.2592;-4.9864,1.4937,7.9809;-4.7415,.6598,8.6606;-5.3308,2.3361,8.6239;-3.7156,1.9867,7.3011;-3.7211,2.5736,6.2257;-2.8633,2.1212,8.0138;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724158535696</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001711120265 0.000248127197 0.029645015820 0.008607605805</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.011881285 -0.000070396 0.000133563 0.000209272 0.000282242 0.000526487 0.001266672 0.001507147 0.002418673 0.003052333 0.003482373 0.004117363 0.004289177 0.005020070 0.005570676 0.006247504 0.006528335 0.007969663 0.008340606 0.009653198 0.010442397 0.011785371 0.013990955 0.015331854 0.020044849 0.021640491 0.024840509 0.025874619 0.031380126 0.035134307 0.036204124 0.039298780 0.044022302 0.044385107 0.045158644 0.048540768 0.049676190 0.050439411 0.050788343 0.052207996 0.052279619 0.052577033 0.053328800 0.055208031 0.056683346 0.057888611 0.059396419 0.061143332 0.062864960 0.063204486 0.067092024 0.070839269 0.073234031 0.077268355 0.078940179 0.079431157 0.080168457 0.084487569 0.085030689 0.092808251 0.096546462 0.099216579 0.104696119 0.106267590 0.109548969 0.111913013 0.114599349 0.116724621 0.117769810 0.120311260 0.131433117 0.137272780 0.140983725 0.145218244 0.147948384 0.154870473 0.155350566 0.168026837 0.173615237 0.175631404 0.181451942 0.192506889 0.198267391 0.204553470 0.212742401 0.217377372 0.225714935 0.241180562 0.257395913 0.268214821 0.316914550 0.325131827 0.357936259 0.364226609 0.423139588 0.458134968 0.511803792 0.548861444 0.567798732 0.615728626 0.634895658 0.645071727 0.690326253 0.744358212 0.749192720 0.749648738 0.760749783 0.762134496 0.771837242 0.773958737 0.785990119 0.792373042 0.800029567 0.804316061 0.815396074 0.817847981 0.823045095 0.832305891 0.839985035 0.860626494 0.872761474 0.878165511 0.879886790 0.895178237 0.901160343 0.910361381 0.917297096 0.922556248 0.926302572 0.981702549 1.306272561 1.492639253</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">114</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.90034736" y3="0.99095645" z3="3.81748209">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.22647942" y3="1.32859071" z3="2.81526017">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.16853958" y3="1.24991551" z3="3.92931589">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.4698124" y3="1.5734041" z3="4.56241495">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12521304" y3="-0.51130132" z3="3.98694154">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79293081" y3="-0.8187363" z3="4.99413595">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48890939" y3="-1.05894497" z3="3.26405099">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58118747" y3="-0.94612481" z3="3.78571728">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.6435404" y3="-2.04688163" z3="3.88257702">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87320567" y3="-0.70814904" z3="2.74212189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60788897" y3="-0.32040155" z3="4.74250267">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61439532" y3="-0.61549537" z3="4.39771248">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.55402098" y3="0.7830136" z3="4.71187349">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48998882" y3="-0.81407982" z3="6.19181698">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30431317" y3="-0.64903031" z3="8.40942326">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19783852" y3="-1.20576398" z3="8.7490838">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14996863" y3="0.18820507" z3="9.12642777">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.0824386" y3="-1.58087631" z3="8.51132218">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90216237" y3="-1.85451417" z3="9.57314941">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18702316" y3="-1.01985218" z3="8.1779197">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22891126" y3="-2.85908796" z3="7.68606473">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.4061322" y3="-2.58191725" z3="6.63139029">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.1497689" y3="-3.38046211" z3="8.0015859">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03912387" y3="-3.81971007" z3="7.76874863">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.2978808" y3="-4.75292371" z3="7.23321932">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.13319795" y3="-4.11068961" z3="8.82435052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25886245" y3="-3.26202549" z3="7.18304947">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62215213" y3="-2.39068321" z3="7.75489251">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06291398" y3="-4.02076121" z3="7.18339986">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.10429452" y3="-2.92919482" z3="6.14031789">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23348774" y3="-1.7574257" z3="6.55013061">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58862104" y3="-0.12884955" z3="7.03111693">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83519126" y3="0.51835439" z3="6.5710102">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43805442" y3="0.85896459" z3="7.71824593">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35021315" y3="0.0467483" z3="8.46264427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22332889" y3="0.56501784" z3="6.9981054">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79045647" y3="1.76386531" z3="8.25012293">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10351332" y3="1.10131315" z3="7.01810324">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79967411" y3="0.18155685" z3="6.49342745">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20522846" y3="1.89443274" z3="6.25726575">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99090241" y3="1.49330096" z3="7.98277549">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7473857" y3="0.65874353" z3="8.66238687">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.33631937" y3="2.33545569" z3="8.62531492">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71862419" y3="1.98689348" z3="7.30640745">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72157797" y3="2.57567563" z3="6.23171161">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.86786939" y3="2.11993076" z3="8.02085055">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9003,.991,3.8175;-1.2265,1.3286,2.8153;.1685,1.2499,3.9293;-1.4698,1.5734,4.5624;-1.1252,-.5113,3.9869;-.7929,-.8187,4.9941;-.4889,-1.0589,3.2641;-2.5812,-.9461,3.7857;-2.6435,-2.0469,3.8826;-2.8732,-.7081,2.7421;-3.6079,-.3204,4.7425;-4.6144,-.6155,4.3977;-3.554,.783,4.7119;-3.49,-.8141,6.1918;-2.3043,-.649,8.4094;-3.1978,-1.2058,8.7491;-2.15,.1882,9.1264;-1.0824,-1.5809,8.5113;-.9022,-1.8545,9.5731;-.187,-1.0199,8.1779;-1.2289,-2.8591,7.6861;-1.4061,-2.5819,6.6314;-2.1498,-3.3805,8.0016;-.0391,-3.8197,7.7687;-.2979,-4.7529,7.2332;.1332,-4.1107,8.8244;1.2589,-3.262,7.183;1.6222,-2.3907,7.7549;2.0629,-4.0208,7.1834;1.1043,-2.9292,6.1403;-4.2335,-1.7574,6.5501;-2.5886,-.1288,7.0311;-1.8352,.5184,6.571;-7.4381,.859,7.7182;-7.3502,.0467,8.4626;-8.2233,.565,6.9981;-7.7905,1.7639,8.2501;-6.1035,1.1013,7.0181;-5.7997,.1816,6.4934;-6.2052,1.8944,6.2573;-4.9909,1.4933,7.9828;-4.7474,.6587,8.6624;-5.3363,2.3355,8.6253;-3.7186,1.9869,7.3064;-3.7216,2.5757,6.2317;-2.8679,2.1199,8.0209;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724162057357</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000560563432 0.000083126769 0.028577995383 0.008476260304</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.011589536 -0.001185701 0.000040241 0.000144978 0.000217009 0.000504840 0.001273257 0.001503185 0.002309947 0.002984985 0.003484044 0.004065439 0.004295620 0.005055942 0.005565409 0.006264262 0.006525762 0.008069041 0.008356233 0.009662441 0.010442076 0.011825806 0.013997340 0.015337221 0.020046914 0.021662758 0.024856037 0.025874657 0.031384523 0.035143503 0.036202405 0.039325813 0.044050137 0.044449999 0.045231286 0.048547439 0.049686098 0.050469849 0.050802529 0.052205002 0.052280494 0.052576975 0.053327899 0.055245474 0.056769238 0.057897852 0.059402285 0.061189008 0.062880742 0.063202006 0.067098327 0.070861634 0.073238969 0.077269160 0.078946147 0.079451729 0.080170395 0.084522288 0.085211459 0.092837742 0.096561539 0.099219010 0.104697235 0.106289550 0.109549815 0.111913319 0.114621571 0.116728737 0.117773033 0.120311510 0.131435794 0.137272815 0.140985273 0.145217736 0.147947012 0.154868988 0.155419224 0.168026868 0.173622384 0.175641327 0.181462997 0.192542159 0.198286647 0.204649988 0.212767503 0.217431338 0.225719731 0.241246751 0.257417801 0.268273989 0.316925783 0.325136108 0.357941343 0.364239211 0.423163570 0.458134668 0.511824356 0.548965816 0.567889621 0.615793757 0.634895497 0.645075994 0.690394467 0.744423168 0.749237374 0.749649519 0.760750040 0.762176257 0.771917167 0.773960739 0.785990826 0.792391785 0.800029703 0.804333553 0.815463536 0.817848228 0.823086046 0.832306509 0.839985066 0.860647571 0.872767230 0.878216594 0.879887198 0.895184747 0.901170311 0.910547398 0.917316243 0.922798970 0.926303523 0.981988361 1.307380428 1.492715331</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">115</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.89537129" y3="0.98777013" z3="3.80923374">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.22195992" y3="1.32745658" z3="2.80783343">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.17522211" y3="1.23992459" z3="3.91860562">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.45890421" y3="1.57412406" z3="4.55552591">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.13006018" y3="-0.51291676" z3="3.98007242">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79849485" y3="-0.82176602" z3="4.98722667">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49870734" y3="-1.06597464" z3="3.25638096">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58927963" y3="-0.93807331" z3="3.78206215">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65826596" y3="-2.03838823" z3="3.87671509">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88330648" y3="-0.69561216" z3="2.74005143">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60732928" y3="-0.3086466" z3="4.74516009">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61764437" y3="-0.59607137" z3="4.40476669">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54646557" y3="0.79470041" z3="4.71744415">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48324287" y3="-0.80923269" z3="6.19159755">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29622441" y3="-0.64568069" z3="8.40911899">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.18969771" y3="-1.20147121" z3="8.75038677">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14009504" y3="0.19141373" z3="9.12571327">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07564856" y3="-1.57886066" z3="8.50968016">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89487633" y3="-1.85299054" z3="9.57148288">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.17986139" y3="-1.01890062" z3="8.1754442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22504473" y3="-2.85662617" z3="7.6842773">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.39705489" y3="-2.57929877" z3="6.6286911">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14997162" y3="-3.37319842" z3="7.99636427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03970034" y3="-3.82228668" z3="7.77302082">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.30136741" y3="-4.7565891" z3="7.2408431">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.12805817" y3="-4.10944282" z3="8.83010012">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26212334" y3="-3.27262689" z3="7.18736618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62692707" y3="-2.3988057" z3="7.7549541">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06396529" y3="-4.03392931" z3="7.19383529">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.11114013" y3="-2.94542941" z3="6.14201148">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22139911" y3="-1.75859431" z3="6.54642923">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58281408" y3="-0.12516697" z3="7.03161623">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83611615" y3="0.53467439" z3="6.57340037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4443026" y3="0.85924934" z3="7.7111098">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36302981" y3="0.06028308" z3="8.47224046">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22362254" y3="0.5525748" z3="6.98999206">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.8010915" y3="1.77484377" z3="8.22154493">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10286395" y3="1.08622351" z3="7.01943468">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.7975243" y3="0.15815801" z3="6.51145021">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19511255" y3="1.86959322" z3="6.24721694">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99813894" y3="1.48840887" z3="7.98937488">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74878153" y3="0.65556734" z3="8.67011471">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35178034" y3="2.32825689" z3="8.62937123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72791531" y3="1.99331126" z3="7.31890613">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73090322" y3="2.5877604" z3="6.24671917">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87743462" y3="2.1227419" z3="8.03300128">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8954,.9878,3.8092;-1.222,1.3275,2.8078;.1752,1.2399,3.9186;-1.4589,1.5741,4.5555;-1.1301,-.5129,3.9801;-.7985,-.8218,4.9872;-.4987,-1.066,3.2564;-2.5893,-.9381,3.7821;-2.6583,-2.0384,3.8767;-2.8833,-.6956,2.7401;-3.6073,-.3086,4.7452;-4.6176,-.5961,4.4048;-3.5465,.7947,4.7174;-3.4832,-.8092,6.1916;-2.2962,-.6457,8.4091;-3.1897,-1.2015,8.7504;-2.1401,.1914,9.1257;-1.0756,-1.5789,8.5097;-.8949,-1.853,9.5715;-.1799,-1.0189,8.1754;-1.225,-2.8566,7.6843;-1.3971,-2.5793,6.6287;-2.15,-3.3732,7.9964;-.0397,-3.8223,7.773;-.3014,-4.7566,7.2408;.1281,-4.1094,8.8301;1.2621,-3.2726,7.1874;1.6269,-2.3988,7.755;2.064,-4.0339,7.1938;1.1111,-2.9454,6.142;-4.2214,-1.7586,6.5464;-2.5828,-.1252,7.0316;-1.8361,.5347,6.5734;-7.4443,.8592,7.7111;-7.363,.0603,8.4722;-8.2236,.5526,6.99;-7.8011,1.7748,8.2215;-6.1029,1.0862,7.0194;-5.7975,.1582,6.5115;-6.1951,1.8696,6.2472;-4.9981,1.4884,7.9894;-4.7488,.6556,8.6701;-5.3518,2.3283,8.6294;-3.7279,1.9933,7.3189;-3.7309,2.5878,6.2467;-2.8774,2.1227,8.033;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724153132799</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.004188293284 0.000545863716 0.025800766851 0.008526428244</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.008520490 -0.000575341 -0.000089684 0.000097122 0.000227029 0.000382374 0.001213793 0.001423177 0.002099097 0.002962551 0.003433727 0.004034704 0.004296013 0.005064791 0.005513594 0.006266596 0.006505151 0.008092224 0.008362873 0.009645193 0.010417662 0.011833292 0.013991948 0.015335877 0.020052343 0.021662032 0.024864086 0.025868379 0.031375845 0.035141828 0.036204235 0.039333306 0.044053617 0.044476109 0.045248257 0.048542264 0.049695170 0.050488432 0.050805440 0.052204579 0.052279671 0.052576024 0.053325473 0.055242154 0.056826764 0.057806093 0.059402239 0.061197102 0.062885701 0.063200810 0.067121126 0.070892059 0.073232869 0.077265038 0.078975091 0.079462036 0.080153798 0.084536155 0.085278147 0.092847143 0.096562185 0.099216569 0.104697295 0.106300812 0.109548931 0.111913324 0.114637619 0.116726734 0.117768758 0.120309836 0.131444078 0.137272835 0.140984607 0.145226300 0.147951878 0.154868373 0.155434912 0.168026264 0.173635129 0.175628191 0.181464987 0.192534818 0.198284219 0.204691360 0.212788123 0.217436414 0.225742695 0.241273493 0.257421415 0.268291853 0.316928145 0.325135208 0.357942025 0.364245545 0.423186224 0.458138555 0.511841189 0.549032544 0.567965641 0.615984636 0.634910944 0.645142764 0.690421831 0.744490610 0.749258453 0.749657045 0.760751120 0.762404768 0.771981148 0.773974601 0.785998983 0.792422070 0.800053884 0.804343533 0.815533442 0.817900692 0.823209829 0.832344304 0.839993351 0.860677320 0.872782010 0.878245645 0.879905757 0.895226697 0.901202933 0.910642287 0.917355347 0.922951632 0.926305127 0.982294506 1.308393023 1.492762589</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">116</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.90551716" y3="0.99623365" z3="3.8186003">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.23660641" y3="1.33522379" z3="2.81857158">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.16428146" y3="1.25436541" z3="3.9250291">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.47092381" y3="1.57830243" z3="4.56719193">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.13059262" y3="-0.50629669" z3="3.98668465">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79488989" y3="-0.8155164" z3="4.99225671">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49708315" y3="-1.05292685" z3="3.26082551">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58772039" y3="-0.93944714" z3="3.78963599">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65115774" y3="-2.04059646" z3="3.88331983">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88391113" y3="-0.69754115" z3="2.7481264">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60949323" y3="-0.31568309" z3="4.75282715">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61784784" y3="-0.60999122" z3="4.41263431">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.55598074" y3="0.78777409" z3="4.72490151">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48295899" y3="-0.81293112" z3="6.20000502">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29178066" y3="-0.64263643" z3="8.41482728">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.18300572" y3="-1.19850334" z3="8.76180545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.13139491" y3="0.194695" z3="9.13018051">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07011293" y3="-1.57559635" z3="8.50857829">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.8818118" y3="-1.84659678" z3="9.56983248">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.17649929" y3="-1.01649548" z3="8.16667111">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22431794" y3="-2.8562619" z3="7.68815596">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.4022463" y3="-2.5826147" z3="6.63280642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14688557" y3="-3.37202706" z3="8.00721388">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03878139" y3="-3.82213786" z3="7.77204576">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.30592415" y3="-4.75928003" z3="7.24716609">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.13924828" y3="-4.10385064" z3="8.82935428">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25816161" y3="-3.27641413" z3="7.17222604">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62760881" y3="-2.39936291" z3="7.73134769">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05963379" y3="-4.03799491" z3="7.17755663">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.09849399" y3="-2.95632169" z3="6.12592348">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.2170263" y3="-1.76357375" z3="6.55786549">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58529447" y3="-0.12088513" z3="7.0386798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83461786" y3="0.52536257" z3="6.57616455">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44800876" y3="0.8691583" z3="7.69530049">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.38290348" y3="0.07775715" z3="8.46360702">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22191067" y3="0.56233752" z3="6.96819583">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80294096" y3="1.79105769" z3="8.19574417">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.09893954" y3="1.08214705" z3="7.01306809">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.7961529" y3="0.14878114" z3="6.5117414">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.17989186" y3="1.86070415" z3="6.23468681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99640523" y3="1.48248824" z3="7.98602171">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75726694" y3="0.65335691" z3="8.67333258">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35116069" y3="2.32745973" z3="8.62013475">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71907388" y3="1.9782982" z3="7.31855794">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71764342" y3="2.57331361" z3="6.24746734">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87471604" y3="2.11312284" z3="8.04101897">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9055,.9962,3.8186;-1.2366,1.3352,2.8186;.1643,1.2544,3.925;-1.4709,1.5783,4.5672;-1.1306,-.5063,3.9867;-.7949,-.8155,4.9923;-.4971,-1.0529,3.2608;-2.5877,-.9394,3.7896;-2.6512,-2.0406,3.8833;-2.8839,-.6975,2.7481;-3.6095,-.3157,4.7528;-4.6178,-.61,4.4126;-3.556,.7878,4.7249;-3.483,-.8129,6.2;-2.2918,-.6426,8.4148;-3.183,-1.1985,8.7618;-2.1314,.1947,9.1302;-1.0701,-1.5756,8.5086;-.8818,-1.8466,9.5698;-.1765,-1.0165,8.1667;-1.2243,-2.8563,7.6882;-1.4022,-2.5826,6.6328;-2.1469,-3.372,8.0072;-.0388,-3.8221,7.772;-.3059,-4.7593,7.2472;.1392,-4.1039,8.8294;1.2582,-3.2764,7.1722;1.6276,-2.3994,7.7313;2.0596,-4.038,7.1776;1.0985,-2.9563,6.1259;-4.217,-1.7636,6.5579;-2.5853,-.1209,7.0387;-1.8346,.5254,6.5762;-7.448,.8692,7.6953;-7.3829,.0778,8.4636;-8.2219,.5623,6.9682;-7.8029,1.7911,8.1957;-6.0989,1.0821,7.0131;-5.7962,.1488,6.5117;-6.1799,1.8607,6.2347;-4.9964,1.4825,7.986;-4.7573,.6534,8.6733;-5.3512,2.3275,8.6201;-3.7191,1.9783,7.3186;-3.7176,2.5733,6.2475;-2.8747,2.1131,8.041;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724149916686</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.003529904414 0.000476730594 0.026326889276 0.008519628665</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.008523995 -0.000663087 -0.000000871 0.000222863 0.000250010 0.000423478 0.001209811 0.001423710 0.002100680 0.002968520 0.003434628 0.004035542 0.004295988 0.005065990 0.005515408 0.006266960 0.006509829 0.008114640 0.008359093 0.009647901 0.010422743 0.011833640 0.013997195 0.015339839 0.020053315 0.021674930 0.024873753 0.025871198 0.031397636 0.035142291 0.036205600 0.039336655 0.044058253 0.044489731 0.045291693 0.048555084 0.049710749 0.050507907 0.050814846 0.052204887 0.052280195 0.052576054 0.053326842 0.055257990 0.056879659 0.057809196 0.059400336 0.061198961 0.062891744 0.063205636 0.067138515 0.070895306 0.073233703 0.077267186 0.078998050 0.079482758 0.080158044 0.084542515 0.085296461 0.092863337 0.096563258 0.099216883 0.104698937 0.106307527 0.109552587 0.111913849 0.114646536 0.116728273 0.117768828 0.120314051 0.131448924 0.137272696 0.140985893 0.145237562 0.147952998 0.154871478 0.155455212 0.168026967 0.173636351 0.175628306 0.181468956 0.192539026 0.198287325 0.204707270 0.212837121 0.217440869 0.225743489 0.241277433 0.257431952 0.268322007 0.316932729 0.325142584 0.357944541 0.364245282 0.423188417 0.458143203 0.511871567 0.549050609 0.567983978 0.616010624 0.634914582 0.645143268 0.690446254 0.744513069 0.749267271 0.749673091 0.760751265 0.762418669 0.772056876 0.773974974 0.785999935 0.792463358 0.800056683 0.804343817 0.815564955 0.817909081 0.823283385 0.832344968 0.839993627 0.860686159 0.872784444 0.878287050 0.879923603 0.895239362 0.901231724 0.910709490 0.917391846 0.923056907 0.926306358 0.982669443 1.309210518 1.492783555</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">117</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.91972312" y3="1.00650657" z3="3.82911675">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.25307031" y3="1.34455938" z3="2.82935537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.14703761" y3="1.27525643" z3="3.9374951">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.49202348" y3="1.58080438" z3="4.5782686">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12914602" y3="-0.49862844" z3="3.99372107">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78902298" y3="-0.80738081" z3="4.99797546">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.4908162" y3="-1.03773003" z3="3.26584476">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58159217" y3="-0.94695134" z3="3.79657281">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.63311944" y3="-2.04828914" z3="3.89200211">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.8786933" y3="-0.71057496" z3="2.75412111">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.61213505" y3="-0.33123968" z3="4.75566092">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61655031" y3="-0.63631811" z3="4.41322161">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.56835825" y3="0.77289225" z3="4.72564909">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48685959" y3="-0.82169144" z3="6.20486798">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29437374" y3="-0.6458521" z3="8.41890159">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.18506728" y3="-1.20150105" z3="8.76748384">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.13344129" y3="0.19236812" z3="9.13296458">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.071968" y3="-1.57800386" z3="8.51095793">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88183" y3="-1.84884841" z3="9.57173121">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.17943855" y3="-1.01827632" z3="8.16780846">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22651637" y3="-2.85888254" z3="7.69121921">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.4112554" y3="-2.58606814" z3="6.63671886">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14567308" y3="-3.37757999" z3="8.01579873">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03737179" y3="-3.82056482" z3="7.7682345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.30356677" y3="-4.75787572" z3="7.24381445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14718861" y3="-4.10254268" z3="8.82444101">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25444942" y3="-3.26992788" z3="7.16285559">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62490498" y3="-2.3935912" z3="7.72230824">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05754232" y3="-4.02949197" z3="7.16166685">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.08967385" y3="-2.94667468" z3="6.11919714">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22161023" y3="-1.76868484" z3="6.56812875">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.5900925" y3="-0.12514337" z3="7.04285149">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83389056" y3="0.51707675" z3="6.5757947">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44415388" y3="0.88136399" z3="7.68903694">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37901999" y3="0.0844634" z3="8.4530962">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22225689" y3="0.58218485" z3="6.96344184">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79172297" y3="1.80261135" z3="8.1938562">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.09549314" y3="1.08920271" z3="7.00578682">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79999073" y3="0.15615926" z3="6.50144418">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.17225454" y3="1.87068911" z3="6.2303765">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99026662" y3="1.48096851" z3="7.97943791">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75937503" y3="0.64959934" z3="8.66853881">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.33666991" y3="2.33089958" z3="8.61022168">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.70689844" y3="1.96140877" z3="7.31151527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70175659" y3="2.55614836" z3="6.23703104">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.86770111" y3="2.10360664" z3="8.03735499">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9197,1.0065,3.8291;-1.2531,1.3446,2.8294;.147,1.2753,3.9375;-1.492,1.5808,4.5783;-1.1291,-.4986,3.9937;-.789,-.8074,4.998;-.4908,-1.0377,3.2658;-2.5816,-.947,3.7966;-2.6331,-2.0483,3.892;-2.8787,-.7106,2.7541;-3.6121,-.3312,4.7557;-4.6166,-.6363,4.4132;-3.5684,.7729,4.7256;-3.4869,-.8217,6.2049;-2.2944,-.6459,8.4189;-3.1851,-1.2015,8.7675;-2.1334,.1924,9.133;-1.072,-1.578,8.511;-.8818,-1.8488,9.5717;-.1794,-1.0183,8.1678;-1.2265,-2.8589,7.6912;-1.4113,-2.5861,6.6367;-2.1457,-3.3776,8.0158;-.0374,-3.8206,7.7682;-.3036,-4.7579,7.2438;.1472,-4.1025,8.8244;1.2544,-3.2699,7.1629;1.6249,-2.3936,7.7223;2.0575,-4.0295,7.1617;1.0897,-2.9467,6.1192;-4.2216,-1.7687,6.5681;-2.5901,-.1251,7.0429;-1.8339,.5171,6.5758;-7.4442,.8814,7.689;-7.379,.0845,8.4531;-8.2223,.5822,6.9634;-7.7917,1.8026,8.1939;-6.0955,1.0892,7.0058;-5.8,.1562,6.5014;-6.1723,1.8707,6.2304;-4.9903,1.481,7.9794;-4.7594,.6496,8.6685;-5.3367,2.3309,8.6102;-3.7069,1.9614,7.3115;-3.7018,2.5561,6.237;-2.8677,2.1036,8.0374;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724163630860</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002574633304 0.000432621339 0.030399947705 0.008507430148</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.008760316 -0.000599256 0.000060307 0.000205043 0.000232870 0.000477313 0.001210948 0.001434732 0.002106501 0.002972317 0.003440500 0.004037322 0.004302250 0.005066820 0.005520715 0.006267455 0.006511041 0.008126964 0.008360616 0.009661546 0.010427243 0.011836170 0.013996791 0.015342412 0.020053388 0.021680484 0.024881886 0.025874895 0.031407982 0.035143320 0.036207178 0.039339327 0.044060531 0.044493242 0.045338451 0.048570175 0.049733910 0.050521940 0.050823680 0.052205776 0.052280314 0.052576368 0.053329489 0.055282268 0.056902901 0.057819285 0.059400015 0.061200809 0.062904440 0.063209747 0.067151015 0.070904774 0.073235420 0.077270280 0.079013872 0.079508835 0.080174225 0.084553019 0.085305464 0.092902205 0.096567096 0.099216796 0.104705788 0.106311116 0.109558062 0.111914258 0.114651195 0.116729368 0.117769601 0.120322015 0.131453896 0.137277464 0.140986645 0.145253712 0.147955064 0.154877229 0.155489210 0.168030003 0.173639826 0.175637443 0.181477652 0.192546063 0.198287994 0.204706690 0.212857589 0.217445383 0.225744152 0.241277687 0.257446133 0.268323842 0.316943369 0.325145023 0.357948528 0.364254163 0.423189569 0.458150020 0.511887311 0.549050382 0.567985762 0.616010538 0.634916532 0.645151392 0.690475594 0.744533391 0.749274255 0.749698922 0.760751444 0.762418502 0.772098347 0.773975947 0.786002091 0.792540828 0.800056735 0.804347146 0.815571889 0.817930285 0.823340276 0.832345141 0.839996327 0.860693353 0.872784670 0.878326161 0.879951138 0.895246962 0.901248054 0.910752917 0.917443881 0.923147312 0.926306576 0.983042025 1.309615383 1.492802957</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">118</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.93903707" y3="1.01897779" z3="3.83000346">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.28347026" y3="1.35311232" z3="2.83262166">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.12588056" y3="1.29924184" z3="3.92985725">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.51233658" y3="1.58747242" z3="4.58348351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.13069775" y3="-0.4886681" z3="3.99542975">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78215254" y3="-0.79409471" z3="4.99788308">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48975893" y3="-1.0205702" z3="3.2645421">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5788678" y3="-0.95339206" z3="3.80393706">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.61881916" y3="-2.05507493" z3="3.90432298">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88018133" y3="-0.72506783" z3="2.76081228">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.61549011" y3="-0.34383607" z3="4.76044336">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61661371" y3="-0.65832554" z3="4.41741327">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.58025675" y3="0.76040148" z3="4.72718945">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49012547" y3="-0.82755196" z3="6.21188219">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29383064" y3="-0.65022526" z3="8.4228569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.18432929" y3="-1.20558037" z3="8.77178228">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.13184494" y3="0.18766873" z3="9.13686542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07173948" y3="-1.58339987" z3="8.51512309">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88345402" y3="-1.85562138" z3="9.57603858">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.17807881" y3="-1.02387587" z3="8.17433821">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22512515" y3="-2.86330087" z3="7.69337387">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.41061477" y3="-2.58849257" z3="6.63992703">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14279037" y3="-3.38400581" z3="8.01741469">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03452674" y3="-3.82369542" z3="7.7656113">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29962953" y3="-4.75872875" z3="7.23602321">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.15206964" y3="-4.11095756" z3="8.82072059">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25743371" y3="-3.26869395" z3="7.16448785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62809192" y3="-2.39802178" z3="7.73203432">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05920592" y3="-4.0294062" z3="7.15791131">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.09448712" y3="-2.93656179" z3="6.12395484">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22807108" y3="-1.76940366" z3="6.5809656">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59035244" y3="-0.12880322" z3="7.04652392">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.82963345" y3="0.50093474" z3="6.57667107">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44148655" y3="0.89011619" z3="7.68072133">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37943741" y3="0.08680608" z3="8.43724794">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22044809" y3="0.59964386" z3="6.95182971">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.78801602" y3="1.80763777" z3="8.19587778">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.0927878" y3="1.10183731" z3="6.99751761">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80016045" y3="0.17204527" z3="6.48412537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.16981641" y3="1.8901985" z3="6.22822195">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.98466461" y3="1.48213606" z3="7.97246147">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.76122128" y3="0.64691495" z3="8.65895423">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.32678763" y3="2.33234402" z3="8.6067812">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.69690429" y3="1.95399234" z3="7.30574532">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.6877158" y3="2.54671249" z3="6.23058608">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.85986319" y3="2.09761779" z3="8.03537278">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.939,1.019,3.83;-1.2835,1.3531,2.8326;.1259,1.2992,3.9299;-1.5123,1.5875,4.5835;-1.1307,-.4887,3.9954;-.7822,-.7941,4.9979;-.4898,-1.0206,3.2645;-2.5789,-.9534,3.8039;-2.6188,-2.0551,3.9043;-2.8802,-.7251,2.7608;-3.6155,-.3438,4.7604;-4.6166,-.6583,4.4174;-3.5803,.7604,4.7272;-3.4901,-.8276,6.2119;-2.2938,-.6502,8.4229;-3.1843,-1.2056,8.7718;-2.1318,.1877,9.1369;-1.0717,-1.5834,8.5151;-.8835,-1.8556,9.576;-.1781,-1.0239,8.1743;-1.2251,-2.8633,7.6934;-1.4106,-2.5885,6.6399;-2.1428,-3.384,8.0174;-.0345,-3.8237,7.7656;-.2996,-4.7587,7.236;.1521,-4.111,8.8207;1.2574,-3.2687,7.1645;1.6281,-2.398,7.732;2.0592,-4.0294,7.1579;1.0945,-2.9366,6.124;-4.2281,-1.7694,6.581;-2.5904,-.1288,7.0465;-1.8296,.5009,6.5767;-7.4415,.8901,7.6807;-7.3794,.0868,8.4372;-8.2204,.5996,6.9518;-7.788,1.8076,8.1959;-6.0928,1.1018,6.9975;-5.8002,.172,6.4841;-6.1698,1.8902,6.2282;-4.9847,1.4821,7.9725;-4.7612,.6469,8.659;-5.3268,2.3323,8.6068;-3.6969,1.954,7.3057;-3.6877,2.5467,6.2306;-2.8599,2.0976,8.0354;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724171673879</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001689194615 0.000387943705 0.028493750792 0.008486662977</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.008615007 -0.000160466 0.000073835 0.000209052 0.000253924 0.000583389 0.001212455 0.001432469 0.002106808 0.002977666 0.003441774 0.004034666 0.004300211 0.005067025 0.005519481 0.006267801 0.006512559 0.008129041 0.008361616 0.009664712 0.010431038 0.011835863 0.013997549 0.015345402 0.020055907 0.021703382 0.024883128 0.025874353 0.031408209 0.035143070 0.036206945 0.039343150 0.044060198 0.044494747 0.045343142 0.048575731 0.049745087 0.050526876 0.050829737 0.052206416 0.052281867 0.052576252 0.053331114 0.055279088 0.056972110 0.057819988 0.059412445 0.061202475 0.062908945 0.063213999 0.067157772 0.070910192 0.073235885 0.077271836 0.079025937 0.079521837 0.080177222 0.084559177 0.085305462 0.092924535 0.096567158 0.099216827 0.104706768 0.106311148 0.109559674 0.111914511 0.114662221 0.116730286 0.117773640 0.120322165 0.131456807 0.137279792 0.140987838 0.145267717 0.147963388 0.154883836 0.155515265 0.168030356 0.173640416 0.175650958 0.181479444 0.192546988 0.198288077 0.204705445 0.212870894 0.217452742 0.225790742 0.241278564 0.257449378 0.268332230 0.316949138 0.325148853 0.357966967 0.364255114 0.423195701 0.458150460 0.511887267 0.549054375 0.568004461 0.616155950 0.634917458 0.645208076 0.690478605 0.744585944 0.749276918 0.749698969 0.760753700 0.762553940 0.772103574 0.773982166 0.786008509 0.792623718 0.800057781 0.804350536 0.815580761 0.817954362 0.823441719 0.832379854 0.840027216 0.860714171 0.872787164 0.878327821 0.879999829 0.895270083 0.901269875 0.910781006 0.917476999 0.923169785 0.926315899 0.983319194 1.309836251 1.492817414</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">119</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.95561222" y3="1.03137012" z3="3.81881828">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.31196401" y3="1.36241773" z3="2.82440352">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.10827307" y3="1.31903468" z3="3.90840473">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.52548921" y3="1.59651278" z3="4.5770639">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.1351711" y3="-0.47729125" z3="3.98766451">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.77746068" y3="-0.77891933" z3="4.98806045">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49557285" y3="-1.00521393" z3="3.25294025">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58125113" y3="-0.95270121" z3="3.80654114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.61299304" y3="-2.05409033" z3="3.9114389">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88991603" y3="-0.7306038" z3="2.76413662">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.6167757" y3="-0.34611032" z3="4.76603613">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61782499" y3="-0.66474503" z3="4.42665362">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.58592476" y3="0.75822406" z3="4.73061326">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48611255" y3="-0.82739081" z3="6.21810849">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.28242459" y3="-0.64880441" z3="8.4248302">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.17455766" y3="-1.19948227" z3="8.77775915">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.11555263" y3="0.19100502" z3="9.13573888">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.06406102" y3="-1.58669796" z3="8.51759866">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.87796552" y3="-1.86039689" z3="9.57849367">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.16781403" y3="-1.03055609" z3="8.17792027">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22203775" y3="-2.86522097" z3="7.6945996">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.4018422" y3="-2.58841223" z3="6.64066277">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14425882" y3="-3.38046732" z3="8.01469708">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03735351" y3="-3.83228692" z3="7.77090957">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.304523" y3="-4.76477781" z3="7.23793785">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14237751" y3="-4.12274698" z3="8.82624295">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.26055788" y3="-3.28245458" z3="7.1782483">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6352002" y3="-2.41783419" z3="7.75279559">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05710354" y3="-4.04845533" z3="7.16997593">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.10449132" y3="-2.94224477" z3="6.13959327">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22638628" y3="-1.76595473" z3="6.5921918">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58053002" y3="-0.13199681" z3="7.04755794">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.82474524" y3="0.50584665" z3="6.57555862">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4411805" y3="0.88939896" z3="7.67046383">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.3787634" y3="0.07832905" z3="8.4200513">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.21963526" y3="0.60603672" z3="6.93855444">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.78572774" y3="1.80260967" z3="8.19225765">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.09209833" y3="1.10610388" z3="6.9903917">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79885359" y3="0.18026016" z3="6.47082856">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.16730897" y3="1.89992315" z3="6.22689805">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.98564658" y3="1.47885451" z3="7.97033557">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7610998" y3="0.63710537" z3="8.64860032">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.32790334" y3="2.32253718" z3="8.61206281">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.69838206" y3="1.95883756" z3="7.30951769">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.68687676" y3="2.55254049" z3="6.234779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.86237544" y3="2.09936473" z3="8.03895144">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9556,1.0314,3.8188;-1.312,1.3624,2.8244;.1083,1.319,3.9084;-1.5255,1.5965,4.5771;-1.1352,-.4773,3.9877;-.7775,-.7789,4.9881;-.4956,-1.0052,3.2529;-2.5813,-.9527,3.8065;-2.613,-2.0541,3.9114;-2.8899,-.7306,2.7641;-3.6168,-.3461,4.766;-4.6178,-.6647,4.4267;-3.5859,.7582,4.7306;-3.4861,-.8274,6.2181;-2.2824,-.6488,8.4248;-3.1746,-1.1995,8.7778;-2.1156,.191,9.1357;-1.0641,-1.5867,8.5176;-.878,-1.8604,9.5785;-.1678,-1.0306,8.1779;-1.222,-2.8652,7.6946;-1.4018,-2.5884,6.6407;-2.1443,-3.3805,8.0147;-.0374,-3.8323,7.7709;-.3045,-4.7648,7.2379;.1424,-4.1227,8.8262;1.2606,-3.2825,7.1782;1.6352,-2.4178,7.7528;2.0571,-4.0485,7.17;1.1045,-2.9422,6.1396;-4.2264,-1.766,6.5922;-2.5805,-.132,7.0476;-1.8247,.5058,6.5756;-7.4412,.8894,7.6705;-7.3788,.0783,8.4201;-8.2196,.606,6.9386;-7.7857,1.8026,8.1923;-6.0921,1.1061,6.9904;-5.7989,.1803,6.4708;-6.1673,1.8999,6.2269;-4.9856,1.4789,7.9703;-4.7611,.6371,8.6486;-5.3279,2.3225,8.6121;-3.6984,1.9588,7.3095;-3.6869,2.5525,6.2348;-2.8624,2.0994,8.039;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724152502817</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001707409148 0.000394488154 0.032218237059 0.008507525518</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.007870489 -0.000208999 0.000204104 0.000214439 0.000256049 0.000535283 0.001232466 0.001418273 0.002102630 0.002981117 0.003442665 0.004031409 0.004299768 0.005068873 0.005515027 0.006268439 0.006523060 0.008130237 0.008358173 0.009668285 0.010433644 0.011835777 0.013998678 0.015349440 0.020057024 0.021700474 0.024883725 0.025873935 0.031416804 0.035143016 0.036206964 0.039344973 0.044060239 0.044494529 0.045350662 0.048581915 0.049753146 0.050526654 0.050829734 0.052207262 0.052280921 0.052576428 0.053332105 0.055283513 0.056963087 0.057822980 0.059409566 0.061203743 0.062918864 0.063214895 0.067163079 0.070916653 0.073236219 0.077273427 0.079026968 0.079528399 0.080182856 0.084562889 0.085302779 0.092936777 0.096567941 0.099216772 0.104706310 0.106310466 0.109560548 0.111914860 0.114664607 0.116730069 0.117772696 0.120326961 0.131458036 0.137282079 0.140990144 0.145269100 0.147963367 0.154911001 0.155531146 0.168035198 0.173651441 0.175659117 0.181484286 0.192546687 0.198290025 0.204715647 0.212886642 0.217457262 0.225782947 0.241280518 0.257458943 0.268332416 0.316951898 0.325150786 0.357966114 0.364257109 0.423196211 0.458160106 0.511893976 0.549060504 0.568008261 0.616161679 0.634917494 0.645280209 0.690488649 0.744624845 0.749279479 0.749707115 0.760753625 0.762602271 0.772142666 0.773985958 0.786014956 0.792683326 0.800060589 0.804356763 0.815582353 0.818040087 0.823448645 0.832388773 0.840041763 0.860742069 0.872795101 0.878368407 0.880006875 0.895276413 0.901282448 0.910809253 0.917483874 0.923207315 0.926315602 0.983499325 1.310030874 1.492828460</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">120</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.93523507" y3="1.01572712" z3="3.82381231">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.27974577" y3="1.34955384" z3="2.82637779">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.13030968" y3="1.2931029" z3="3.9225521">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.50577732" y3="1.58669989" z3="4.57696995">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.13113795" y3="-0.4907409" z3="3.99202447">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78335737" y3="-0.79491591" z3="4.99501157">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49212961" y3="-1.02554896" z3="3.26184432">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58059733" y3="-0.95159399" z3="3.80239613">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.62329681" y3="-2.05282043" z3="3.90375839">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.88264975" y3="-0.72321972" z3="2.75951314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.61360766" y3="-0.33876437" z3="4.76059118">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61638431" y3="-0.64940351" z3="4.41899183">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.57483966" y3="0.76525661" z3="4.72705254">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.4874655" y3="-0.82447574" z3="6.2115864">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29014832" y3="-0.65011805" z3="8.42224541">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.18200337" y3="-1.20379527" z3="8.7709452">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.12763442" y3="0.18841763" z3="9.13563148">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.06958796" y3="-1.58503854" z3="8.51650159">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88340994" y3="-1.85814456" z3="9.57750142">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.17468694" y3="-1.02655326" z3="8.17731184">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22387501" y3="-2.8639583" z3="7.69352703">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.40780796" y3="-2.58768673" z3="6.64009293">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.1429533" y3="-3.3834937" z3="8.01598596">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03481939" y3="-3.82605686" z3="7.76679476">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.30018388" y3="-4.76029203" z3="7.23610468">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14936294" y3="-4.11444994" z3="8.82175392">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25844226" y3="-3.27195682" z3="7.16783167">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62954498" y3="-2.40211447" z3="7.73650958">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.05955192" y3="-4.0333383" z3="7.16110892">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.09671898" y3="-2.93840234" z3="6.1274711">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22749204" y3="-1.76588776" z3="6.57960974">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58471478" y3="-0.13106768" z3="7.04511773">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.82941629" y3="0.50888687" z3="6.57735395">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44325701" y3="0.88559761" z3="7.68123413">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.37820436" y3="0.08108557" z3="8.43689075">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22152684" y3="0.59397003" z3="6.95245241">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.7910764" y3="1.80171595" z3="8.19658466">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.09518887" y3="1.10116427" z3="6.99841576">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79940081" y3="0.17254535" z3="6.48528698">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.1737988" y3="1.88950128" z3="6.22966638">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.98907005" y3="1.48404888" z3="7.97453709">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75954873" y3="0.64727775" z3="8.65693783">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.33442911" y3="2.32955999" z3="8.61260076">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.70521989" y3="1.96654892" z3="7.30999551">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.69678975" y3="2.55874053" z3="6.23530658">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.86543124" y3="2.10489337" z3="8.03609835">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9352,1.0157,3.8238;-1.2797,1.3496,2.8264;.1303,1.2931,3.9226;-1.5058,1.5867,4.577;-1.1311,-.4907,3.992;-.7834,-.7949,4.995;-.4921,-1.0255,3.2618;-2.5806,-.9516,3.8024;-2.6233,-2.0528,3.9038;-2.8826,-.7232,2.7595;-3.6136,-.3388,4.7606;-4.6164,-.6494,4.419;-3.5748,.7653,4.7271;-3.4875,-.8245,6.2116;-2.2901,-.6501,8.4222;-3.182,-1.2038,8.7709;-2.1276,.1884,9.1356;-1.0696,-1.585,8.5165;-.8834,-1.8581,9.5775;-.1747,-1.0266,8.1773;-1.2239,-2.864,7.6935;-1.4078,-2.5877,6.6401;-2.143,-3.3835,8.016;-.0348,-3.8261,7.7668;-.3002,-4.7603,7.2361;.1494,-4.1144,8.8218;1.2584,-3.272,7.1678;1.6295,-2.4021,7.7365;2.0596,-4.0333,7.1611;1.0967,-2.9384,6.1275;-4.2275,-1.7659,6.5796;-2.5847,-.1311,7.0451;-1.8294,.5089,6.5774;-7.4433,.8856,7.6812;-7.3782,.0811,8.4369;-8.2215,.594,6.9525;-7.7911,1.8017,8.1966;-6.0952,1.1012,6.9984;-5.7994,.1725,6.4853;-6.1738,1.8895,6.2297;-4.9891,1.484,7.9745;-4.7595,.6473,8.6569;-5.3344,2.3296,8.6126;-3.7052,1.9665,7.31;-3.6968,2.5587,6.2353;-2.8654,2.1049,8.0361;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724158095746</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000977852364 0.000213068657 0.026368309286 0.008518993304</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.003914657 -0.001087500 0.000047541 0.000214637 0.000248923 0.000370199 0.001236854 0.001367208 0.002082796 0.002976760 0.003442829 0.004002188 0.004294927 0.005072583 0.005482612 0.006269570 0.006526807 0.008132091 0.008344050 0.009673779 0.010433406 0.011841505 0.014000613 0.015354266 0.020052605 0.021669729 0.024885995 0.025866584 0.031427427 0.035141851 0.036206727 0.039343791 0.044059845 0.044493348 0.045361490 0.048589056 0.049761122 0.050526672 0.050827507 0.052206857 0.052276524 0.052576520 0.053332413 0.055282132 0.056877457 0.057797293 0.059378682 0.061218616 0.062930682 0.063214861 0.067169186 0.070921819 0.073237294 0.077273989 0.079031393 0.079534456 0.080189920 0.084566321 0.085303879 0.092949420 0.096569254 0.099216944 0.104708357 0.106309311 0.109561859 0.111914745 0.114663541 0.116728749 0.117769722 0.120331438 0.131458886 0.137273914 0.140990522 0.145268461 0.147957076 0.154954726 0.155542293 0.168037830 0.173653462 0.175675022 0.181490426 0.192543277 0.198293259 0.204720033 0.212955724 0.217454871 0.225757165 0.241293571 0.257465475 0.268341720 0.316957872 0.325160111 0.357960046 0.364258762 0.423200861 0.458173278 0.511921683 0.549063954 0.568028198 0.616296327 0.634916997 0.645443763 0.690503472 0.744644433 0.749284605 0.749724203 0.760753411 0.762837927 0.772169691 0.774003068 0.786018509 0.792726122 0.800061523 0.804389093 0.815583729 0.818186284 0.823472020 0.832429771 0.840048432 0.860812802 0.872801874 0.878429802 0.880012672 0.895281920 0.901293093 0.910827534 0.917488992 0.923247784 0.926323435 0.983615025 1.310211542 1.492844086</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">121</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.9377697" y3="1.01637516" z3="3.83777535">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.28015967" y3="1.35246173" z3="2.84020031">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.12649881" y3="1.2971579" z3="3.94113727">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.51298912" y3="1.58277203" z3="4.59067216">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12839726" y3="-0.49131" z3="4.00057056">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78084096" y3="-0.79762902" z3="5.00295048">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48631019" y3="-1.02128061" z3="3.26963821">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57578183" y3="-0.95743293" z3="3.8071991">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.6144286" y3="-2.05884888" z3="3.90808795">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87606292" y3="-0.72998433" z3="2.76351549">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.61404868" y3="-0.34862617" z3="4.76237542">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61453412" y3="-0.66381348" z3="4.41834218">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.57945393" y3="0.75546228" z3="4.72770656">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.4907106" y3="-0.83188073" z3="6.21443775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29548714" y3="-0.65749" z3="8.42628754">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.18736746" y3="-1.21243051" z3="8.77315033">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.13522399" y3="0.18110097" z3="9.14021556">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07320779" y3="-1.59056373" z3="8.52177382">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88682092" y3="-1.86311241" z3="9.58284588">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.17927906" y3="-1.03027304" z3="8.18295679">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22485753" y3="-2.86989867" z3="7.69886186">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.41975026" y3="-2.59389874" z3="6.64750058">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13699197" y3="-3.39670597" z3="8.02893119">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02790142" y3="-3.82294681" z3="7.75953495">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29173544" y3="-4.75951448" z3="7.23196201">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.17129392" y3="-4.10933886" z3="8.81320145">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25472805" y3="-3.25953306" z3="7.14685945">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62370711" y3="-2.38557657" z3="7.71014127">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06128738" y3="-4.0146598" z3="7.13535286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.08281179" y3="-2.92936025" z3="6.10814015">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23280413" y3="-1.77143408" z3="6.58290756">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58826684" y3="-0.13856966" z3="7.04870151">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83116453" y3="0.50043466" z3="6.5813423">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44409162" y3="0.89904126" z3="7.67630714">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.38444756" y3="0.10168678" z3="8.4408928">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22090121" y3="0.60266093" z3="6.94780717">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.78979482" y3="1.82217697" z3="8.1803343">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.09259399" y3="1.10187896" z3="6.99559212">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79923267" y3="0.1666836" z3="6.4932374">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.16548813" y3="1.8827573" z3="6.21850478">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.98779094" y3="1.49033702" z3="7.97117902">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7597626" y3="0.65779005" z3="8.65959952">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.33312784" y3="2.34087888" z3="8.60259187">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.70185624" y3="1.9659957" z3="7.30600112">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.69069168" y3="2.55470984" z3="6.22900834">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.86217049" y3="2.10420701" z3="8.03155681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9378,1.0164,3.8378;-1.2802,1.3525,2.8402;.1265,1.2972,3.9411;-1.513,1.5828,4.5907;-1.1284,-.4913,4.0006;-.7808,-.7976,5.003;-.4863,-1.0213,3.2696;-2.5758,-.9574,3.8072;-2.6144,-2.0588,3.9081;-2.8761,-.73,2.7635;-3.614,-.3486,4.7624;-4.6145,-.6638,4.4183;-3.5795,.7555,4.7277;-3.4907,-.8319,6.2144;-2.2955,-.6575,8.4263;-3.1874,-1.2124,8.7732;-2.1352,.1811,9.1402;-1.0732,-1.5906,8.5218;-.8868,-1.8631,9.5828;-.1793,-1.0303,8.183;-1.2249,-2.8699,7.6989;-1.4198,-2.5939,6.6475;-2.137,-3.3967,8.0289;-.0279,-3.8229,7.7595;-.2917,-4.7595,7.232;.1713,-4.1093,8.8132;1.2547,-3.2595,7.1469;1.6237,-2.3856,7.7101;2.0613,-4.0147,7.1354;1.0828,-2.9294,6.1081;-4.2328,-1.7714,6.5829;-2.5883,-.1386,7.0487;-1.8312,.5004,6.5813;-7.4441,.899,7.6763;-7.3844,.1017,8.4409;-8.2209,.6027,6.9478;-7.7898,1.8222,8.1803;-6.0926,1.1019,6.9956;-5.7992,.1667,6.4932;-6.1655,1.8828,6.2185;-4.9878,1.4903,7.9712;-4.7598,.6578,8.6596;-5.3331,2.3409,8.6026;-3.7019,1.966,7.306;-3.6907,2.5547,6.229;-2.8622,2.1042,8.0316;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724145775157</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.002203193276 0.000479328669 0.025529928743 0.008513080983</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002956981 -0.000317225 0.000148460 0.000193573 0.000269445 0.000459112 0.001237981 0.001366013 0.002080954 0.002979981 0.003441893 0.003992481 0.004295621 0.005091063 0.005474606 0.006274991 0.006528110 0.008138369 0.008339051 0.009674158 0.010432008 0.011844594 0.014004500 0.015355676 0.020050190 0.021657274 0.024888073 0.025865491 0.031455743 0.035141478 0.036208085 0.039343492 0.044062050 0.044494624 0.045371568 0.048591964 0.049773087 0.050527479 0.050827943 0.052209359 0.052275824 0.052577100 0.053333595 0.055288309 0.056839102 0.057815613 0.059385492 0.061233755 0.062939114 0.063215241 0.067174149 0.070926689 0.073237361 0.077277521 0.079046071 0.079543681 0.080192862 0.084565193 0.085307702 0.092947216 0.096569852 0.099217350 0.104710122 0.106314655 0.109562962 0.111914865 0.114670817 0.116732878 0.117776692 0.120335505 0.131459920 0.137284708 0.140990793 0.145266847 0.147957282 0.155011250 0.155554946 0.168039397 0.173666498 0.175746418 0.181494656 0.192546935 0.198303442 0.204734643 0.213039265 0.217455082 0.225752967 0.241294100 0.257471617 0.268407525 0.316959874 0.325175589 0.357959252 0.364262403 0.423202835 0.458194403 0.511966218 0.549064502 0.568052437 0.616383067 0.634916674 0.645620506 0.690513400 0.744663112 0.749284562 0.749752753 0.760753401 0.763038492 0.772202930 0.774034014 0.786023994 0.792822385 0.800062381 0.804441804 0.815593139 0.818402324 0.823469787 0.832471821 0.840067712 0.860910375 0.872818533 0.878515798 0.880017123 0.895293134 0.901311999 0.910839209 0.917503411 0.923329125 0.926327057 0.983723756 1.310684302 1.492844798</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">122</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.91765504" y3="1.00236194" z3="3.83119737">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.25462974" y3="1.3375012" z3="2.83166945">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.14947673" y3="1.27230436" z3="3.93553685">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.48805816" y3="1.57839627" z3="4.58075075">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12523464" y3="-0.50272753" z3="4.00047888">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78555522" y3="-0.80747202" z3="5.00607699">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48560451" y3="-1.04302562" z3="3.27468874">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57706269" y3="-0.95376495" z3="3.80398214">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.62751821" y3="-2.05493598" z3="3.90457622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87333357" y3="-0.72247407" z3="2.76005737">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60891164" y3="-0.33510895" z3="4.75983607">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61307765" y3="-0.63886889" z3="4.41557945">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.56327388" y3="0.76874056" z3="4.72655944">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48783743" y3="-0.82518425" z3="6.21032281">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29600689" y3="-0.65730676" z3="8.42426766">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.18892924" y3="-1.21237203" z3="8.76814749">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.13794482" y3="0.18093066" z3="9.13924225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07403759" y3="-1.58999229" z3="8.52261189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.88885786" y3="-1.86240189" z3="9.58398272">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18016543" y3="-1.02939846" z3="8.18437086">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22439914" y3="-2.86885055" z3="7.69907706">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.4204608" y3="-2.59198514" z3="6.64771329">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.13639558" y3="-3.39693788" z3="8.02895366">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.02662981" y3="-3.82151597" z3="7.76041259">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.2910278" y3="-4.758347" z3="7.23432949">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.17048386" y3="-4.107246" z3="8.81253354">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25461118" y3="-3.2585451" z3="7.14330765">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62623089" y3="-2.38278474" z3="7.7035651">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06304725" y3="-4.01267918" z3="7.12724035">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.07350028" y3="-2.93049258" z3="6.10266438">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23178042" y3="-1.76726975" z3="6.57252872">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58358729" y3="-0.14023261" z3="7.04551569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83347204" y3="0.50953244" z3="6.5840564">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44792616" y3="0.88850228" z3="7.68380778">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.38405967" y3="0.09540501" z3="8.45087567">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22383306" y3="0.58531003" z3="6.95731106">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79911437" y3="1.81122733" z3="8.18556883">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.0985696" y3="1.09718903" z3="7.00165665">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79789739" y3="0.16241354" z3="6.5016835">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.17713505" y3="1.8756864" z3="6.22286152">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99639319" y3="1.49528456" z3="7.97624436">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75868821" y3="0.66486438" z3="8.66288544">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34866999" y3="2.34114848" z3="8.61002954">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.71774819" y3="1.9874949" z3="7.31156156">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.70874601" y3="2.57266272" z3="6.23577432">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.871091" y3="2.1154203" z3="8.03179466">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9177,1.0024,3.8312;-1.2546,1.3375,2.8317;.1495,1.2723,3.9355;-1.4881,1.5784,4.5808;-1.1252,-.5027,4.0005;-.7856,-.8075,5.0061;-.4856,-1.043,3.2747;-2.5771,-.9538,3.804;-2.6275,-2.0549,3.9046;-2.8733,-.7225,2.7601;-3.6089,-.3351,4.7598;-4.6131,-.6389,4.4156;-3.5633,.7687,4.7266;-3.4878,-.8252,6.2103;-2.296,-.6573,8.4243;-3.1889,-1.2124,8.7681;-2.1379,.1809,9.1392;-1.074,-1.59,8.5226;-.8889,-1.8624,9.584;-.1802,-1.0294,8.1844;-1.2244,-2.8689,7.6991;-1.4205,-2.592,6.6477;-2.1364,-3.3969,8.029;-.0266,-3.8215,7.7604;-.291,-4.7583,7.2343;.1705,-4.1072,8.8125;1.2546,-3.2585,7.1433;1.6262,-2.3828,7.7036;2.063,-4.0127,7.1272;1.0735,-2.9305,6.1027;-4.2318,-1.7673,6.5725;-2.5836,-.1402,7.0455;-1.8335,.5095,6.5841;-7.4479,.8885,7.6838;-7.3841,.0954,8.4509;-8.2238,.5853,6.9573;-7.7991,1.8112,8.1856;-6.0986,1.0972,7.0017;-5.7979,.1624,6.5017;-6.1771,1.8757,6.2229;-4.9964,1.4953,7.9762;-4.7587,.6649,8.6629;-5.3487,2.3411,8.61;-3.7177,1.9875,7.3116;-3.7087,2.5727,6.2358;-2.8711,2.1154,8.0318;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724146809866</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001637247254 0.000221721800 0.028284814807 0.008519353442</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002908123 -0.000023937 0.000006053 0.000209614 0.000246978 0.000449625 0.001237976 0.001390716 0.002092476 0.002978848 0.003441857 0.003995729 0.004296648 0.005111751 0.005496848 0.006274372 0.006528277 0.008140024 0.008343672 0.009675283 0.010432251 0.011854250 0.014004269 0.015355556 0.020049709 0.021655255 0.024889405 0.025865704 0.031478587 0.035141649 0.036208867 0.039343559 0.044067444 0.044494236 0.045374559 0.048592435 0.049776874 0.050527221 0.050827833 0.052208653 0.052275143 0.052579957 0.053331697 0.055297326 0.056837342 0.057815728 0.059394097 0.061235381 0.062938337 0.063212854 0.067175646 0.070927811 0.073237770 0.077277435 0.079057437 0.079547408 0.080192151 0.084566745 0.085307223 0.092949713 0.096569813 0.099217347 0.104713144 0.106320268 0.109562940 0.111915467 0.114674360 0.116738728 0.117784116 0.120337073 0.131459638 0.137289120 0.140990394 0.145265917 0.147960511 0.155041373 0.155559924 0.168039059 0.173665129 0.175793328 0.181494634 0.192546498 0.198312628 0.204734889 0.213104763 0.217451196 0.225751516 0.241294043 0.257471188 0.268428308 0.316964336 0.325180464 0.357958630 0.364262458 0.423206106 0.458205866 0.511995781 0.549064276 0.568058399 0.616403157 0.634918406 0.645659922 0.690517842 0.744664110 0.749285002 0.749758312 0.760754480 0.763092690 0.772207088 0.774042621 0.786023874 0.792895728 0.800063511 0.804467901 0.815609293 0.818430542 0.823470456 0.832476793 0.840071264 0.860946906 0.872820135 0.878536416 0.880029958 0.895295215 0.901315689 0.910839959 0.917504347 0.923358121 0.926328117 0.983731020 1.311041264 1.492844164</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">123</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.90589449" y3="0.99510679" z3="3.82484926">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.2364884" y3="1.33227577" z3="2.82383694">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.16238117" y3="1.25823243" z3="3.93354239">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.47535944" y3="1.5751964" z3="4.57164464">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12436575" y3="-0.50829323" z3="3.9942242">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.78975007" y3="-0.81491321" z3="5.00094446">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48669226" y3="-1.0530478" z3="3.27040556">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57919699" y3="-0.94877401" z3="3.7947606">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.63754613" y3="-2.04985471" z3="3.89288374">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87328652" y3="-0.71299506" z3="2.75117435">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60720715" y3="-0.32547088" z3="4.75182768">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61314312" y3="-0.62374026" z3="4.40786024">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.55635973" y3="0.77816056" z3="4.7198656">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.4873252" y3="-0.81778083" z3="6.20164436">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29669122" y3="-0.65233853" z3="8.41703491">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19014136" y3="-1.20758666" z3="8.75938884">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14002995" y3="0.18587475" z3="9.13231085">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07534261" y3="-1.5852364" z3="8.51766168">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89151033" y3="-1.85669843" z3="9.57949945">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18075462" y3="-1.02554318" z3="8.17983351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22629314" y3="-2.86507614" z3="7.69555374">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.41575224" y3="-2.58971569" z3="6.64262026">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14177331" y3="-3.38936123" z3="8.02199537">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03259156" y3="-3.82160027" z3="7.76583984">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29597946" y3="-4.7579339" z3="7.23812123">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.15510805" y3="-4.10726313" z3="8.82013935">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25434233" y3="-3.26235512" z3="7.1581314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62180819" y3="-2.38527988" z3="7.71840367">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06209938" y3="-4.01718842" z3="7.15171582">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.0838371" y3="-2.93678985" z3="6.116173">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23229947" y3="-1.75980477" z3="6.56205143">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58286246" y3="-0.13449984" z3="7.03828757">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83386836" y3="0.51892435" z3="6.57804254">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44549" y3="0.87282153" z3="7.69912446">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.3692213" y3="0.07046264" z3="8.45602201">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22510387" y3="0.57274013" z3="6.97539079">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79774867" y3="1.78730575" z3="8.21385365">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10264785" y3="1.0979365" z3="7.00913114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79955494" y3="0.17016784" z3="6.49873104">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.19186582" y3="1.8826618" z3="6.23834497">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99676849" y3="1.49411384" z3="7.97994427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75316338" y3="0.66022172" z3="8.66100107">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34775781" y3="2.33574086" z3="8.62027569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72256386" y3="1.99162573" z3="7.310921">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.71942231" y3="2.57903457" z3="6.23561722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.8737314" y3="2.12099365" z3="8.02726242">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.9059,.9951,3.8248;-1.2365,1.3323,2.8238;.1624,1.2582,3.9335;-1.4754,1.5752,4.5716;-1.1244,-.5083,3.9942;-.7898,-.8149,5.0009;-.4867,-1.053,3.2704;-2.5792,-.9488,3.7948;-2.6375,-2.0499,3.8929;-2.8733,-.713,2.7512;-3.6072,-.3255,4.7518;-4.6131,-.6237,4.4079;-3.5564,.7782,4.7199;-3.4873,-.8178,6.2016;-2.2967,-.6523,8.417;-3.1901,-1.2076,8.7594;-2.14,.1859,9.1323;-1.0753,-1.5852,8.5177;-.8915,-1.8567,9.5795;-.1808,-1.0255,8.1798;-1.2263,-2.8651,7.6956;-1.4158,-2.5897,6.6426;-2.1418,-3.3894,8.022;-.0326,-3.8216,7.7658;-.296,-4.7579,7.2381;.1551,-4.1073,8.8201;1.2543,-3.2624,7.1581;1.6218,-2.3853,7.7184;2.0621,-4.0172,7.1517;1.0838,-2.9368,6.1162;-4.2323,-1.7598,6.5621;-2.5829,-.1345,7.0383;-1.8339,.5189,6.578;-7.4455,.8728,7.6991;-7.3692,.0705,8.456;-8.2251,.5727,6.9754;-7.7977,1.7873,8.2139;-6.1026,1.0979,7.0091;-5.7996,.1702,6.4987;-6.1919,1.8827,6.2383;-4.9968,1.4941,7.9799;-4.7532,.6602,8.661;-5.3478,2.3357,8.6203;-3.7226,1.9916,7.3109;-3.7194,2.579,6.2356;-2.8737,2.121,8.0273;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724155975234</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001405074751 0.000204037214 0.023712081409 0.008515527966</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002857888 -0.000012007 0.000067059 0.000209454 0.000251262 0.000445889 0.001238863 0.001397582 0.002096271 0.002978429 0.003442737 0.003996205 0.004297236 0.005120295 0.005501905 0.006274453 0.006528454 0.008140545 0.008345894 0.009674860 0.010433494 0.011855772 0.014004359 0.015356329 0.020049874 0.021660075 0.024889642 0.025865426 0.031486997 0.035141740 0.036208819 0.039344174 0.044069197 0.044494080 0.045376748 0.048593799 0.049782952 0.050527388 0.050827774 0.052207734 0.052277328 0.052581288 0.053330676 0.055301925 0.056837574 0.057815065 0.059394792 0.061236267 0.062937914 0.063212224 0.067177115 0.070935178 0.073238178 0.077279197 0.079067202 0.079553854 0.080191925 0.084566696 0.085307154 0.092949398 0.096571102 0.099217402 0.104713670 0.106321864 0.109562998 0.111916193 0.114676985 0.116740070 0.117788935 0.120338635 0.131459501 0.137289755 0.140990481 0.145273992 0.147961234 0.155050674 0.155571097 0.168040552 0.173665616 0.175797627 0.181494655 0.192547309 0.198318408 0.204733920 0.213119685 0.217453433 0.225750460 0.241293033 0.257476847 0.268433359 0.316970411 0.325179311 0.357960816 0.364263556 0.423207045 0.458213242 0.512002296 0.549063543 0.568058955 0.616404026 0.634930273 0.645666738 0.690517980 0.744664854 0.749284930 0.749758380 0.760755344 0.763095715 0.772209085 0.774045359 0.786023978 0.792961866 0.800067735 0.804473913 0.815610458 0.818437318 0.823476798 0.832476952 0.840072194 0.860969072 0.872823488 0.878544987 0.880039814 0.895308815 0.901314900 0.910846315 0.917504655 0.923371888 0.926341764 0.983742107 1.311219255 1.492854090</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">124</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.88977456" y3="0.98252765" z3="3.8159072">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.21495206" y3="1.32027276" z3="2.81339085">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.18076299" y3="1.23553525" z3="3.92631361">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.45495139" y3="1.56978053" z3="4.56038025">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12388673" y3="-0.51813758" z3="3.98894191">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79487645" y3="-0.82487986" z3="4.99750291">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49010032" y3="-1.07170778" z3="3.26794135">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.5824691" y3="-0.94449033" z3="3.78786603">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65119651" y3="-2.04482224" z3="3.88495891">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87351937" y3="-0.70474548" z3="2.74435054">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60435714" y3="-0.31304181" z3="4.74599258">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61310659" y3="-0.6021207" z3="4.40238522">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54438756" y3="0.79012585" z3="4.71519954">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48598284" y3="-0.80954472" z3="6.19458934">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29972328" y3="-0.64748377" z3="8.41216179">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19369738" y3="-1.20345813" z3="8.75205549">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14474505" y3="0.18990209" z3="9.12890766">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07859338" y3="-1.58039712" z3="8.51448596">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89667588" y3="-1.85223165" z3="9.57651538">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18338785" y3="-1.02075169" z3="8.1783426">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22814847" y3="-2.85974835" z3="7.69180358">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.41295461" y3="-2.58396462" z3="6.63798124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14617503" y3="-3.38216024" z3="8.01399436">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03645029" y3="-3.81869482" z3="7.76808993">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29867695" y3="-4.75379786" z3="7.23778621">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14456236" y3="-4.10612381" z3="8.82299525">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25565317" y3="-3.26182735" z3="7.16845405">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62179933" y3="-2.38547723" z3="7.73102846">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06180871" y3="-4.0185655" z3="7.16648698">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.09012099" y3="-2.93682594" z3="6.12438865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22970968" y3="-1.75431855" z3="6.55060784">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.5831705" y3="-0.12834578" z3="7.0334873">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83480718" y3="0.52666988" z3="6.57610414">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44446381" y3="0.85742747" z3="7.71157797">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35940948" y3="0.04883313" z3="8.46053981">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22627145" y3="0.55944917" z3="6.98936528">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.80064887" y3="1.7648291" z3="8.23756573">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10674716" y3="1.09758906" z3="7.01636722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.79956928" y3="0.17599358" z3="6.49641422">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20554452" y3="1.88869014" z3="6.25258382">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99882907" y3="1.49281935" z3="7.98524982">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75117855" y3="0.65714108" z3="8.66191422">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35005662" y3="2.33045539" z3="8.63031088">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72857974" y3="1.99754889" z3="7.31441871">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72993355" y3="2.58730811" z3="6.24143217">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87696809" y3="2.12522065" z3="8.02875129">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8898,.9825,3.8159;-1.215,1.3203,2.8134;.1808,1.2355,3.9263;-1.455,1.5698,4.5604;-1.1239,-.5181,3.9889;-.7949,-.8249,4.9975;-.4901,-1.0717,3.2679;-2.5825,-.9445,3.7879;-2.6512,-2.0448,3.885;-2.8735,-.7047,2.7444;-3.6044,-.313,4.746;-4.6131,-.6021,4.4024;-3.5444,.7901,4.7152;-3.486,-.8095,6.1946;-2.2997,-.6475,8.4122;-3.1937,-1.2035,8.7521;-2.1447,.1899,9.1289;-1.0786,-1.5804,8.5145;-.8967,-1.8522,9.5765;-.1834,-1.0208,8.1783;-1.2281,-2.8597,7.6918;-1.413,-2.584,6.638;-2.1462,-3.3822,8.014;-.0365,-3.8187,7.7681;-.2987,-4.7538,7.2378;.1446,-4.1061,8.823;1.2557,-3.2618,7.1685;1.6218,-2.3855,7.731;2.0618,-4.0186,7.1665;1.0901,-2.9368,6.1244;-4.2297,-1.7543,6.5506;-2.5832,-.1283,7.0335;-1.8348,.5267,6.5761;-7.4445,.8574,7.7116;-7.3594,.0488,8.4605;-8.2263,.5594,6.9894;-7.8006,1.7648,8.2376;-6.1067,1.0976,7.0164;-5.7996,.176,6.4964;-6.2055,1.8887,6.2526;-4.9988,1.4928,7.9852;-4.7512,.6571,8.6619;-5.3501,2.3305,8.6303;-3.7286,1.9975,7.3144;-3.7299,2.5873,6.2414;-2.877,2.1252,8.0288;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724161937947</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000881360597 0.000155653704 0.034356214646 0.008485594786</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002013700 -0.000121645 0.000025308 0.000178911 0.000208449 0.000373760 0.001226871 0.001345821 0.002060497 0.002973049 0.003435847 0.003994418 0.004268510 0.005127615 0.005505073 0.006273118 0.006538834 0.008142042 0.008346494 0.009669370 0.010431471 0.011853099 0.014003717 0.015356902 0.020043675 0.021655950 0.024890814 0.025861337 0.031494407 0.035142937 0.036209352 0.039342256 0.044070899 0.044495788 0.045379463 0.048580376 0.049794400 0.050529936 0.050819397 0.052203767 0.052276127 0.052581694 0.053328281 0.055305068 0.056802466 0.057781217 0.059374629 0.061216399 0.062933970 0.063208629 0.067182564 0.070941729 0.073238759 0.077278508 0.079079711 0.079564076 0.080191398 0.084564809 0.085327881 0.092949905 0.096571007 0.099217015 0.104714183 0.106328388 0.109562566 0.111915915 0.114679414 0.116740715 0.117789766 0.120343027 0.131458960 0.137282979 0.140986916 0.145278715 0.147961238 0.155064902 0.155580747 0.168039016 0.173662681 0.175782226 0.181494564 0.192544895 0.198321734 0.204731805 0.213143521 0.217444492 0.225757831 0.241293615 0.257478038 0.268424147 0.316978803 0.325174355 0.357971124 0.364258343 0.423209746 0.458220357 0.512011141 0.549075806 0.568060938 0.616414402 0.634939249 0.645683224 0.690527131 0.744666773 0.749285227 0.749760490 0.760755727 0.763105947 0.772216410 0.774046658 0.786023713 0.793004890 0.800068754 0.804475593 0.815616913 0.818446644 0.823491413 0.832481851 0.840077668 0.860993327 0.872825943 0.878559974 0.880061649 0.895326043 0.901318506 0.910859027 0.917512057 0.923393604 0.926348671 0.983767284 1.311394851 1.492856951</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">125</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.87285865" y3="0.97226523" z3="3.81695717">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.19062587" y3="1.30929295" z3="2.81164286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.19888871" y3="1.21814462" z3="3.93173546">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.43748872" y3="1.5656934" z3="4.55687618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.11803705" y3="-0.5261563" z3="3.99377595">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79484428" y3="-0.83201934" z3="5.00449127">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48546168" y3="-1.08558863" z3="3.27673976">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.57902826" y3="-0.94260003" z3="3.78902009">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65581708" y3="-2.04256088" z3="3.88657791">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86629245" y3="-0.70115827" z3="2.74484393">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.59847271" y3="-0.30427627" z3="4.74533769">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.60851586" y3="-0.58813044" z3="4.40105019">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.53291279" y3="0.79853992" z3="4.71418149">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48289998" y3="-0.80099457" z3="6.19392673">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.29719305" y3="-0.63962401" z3="8.41259323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.1911383" y3="-1.19507898" z3="8.75337206">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14098189" y3="0.19747424" z3="9.12925115">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.07685847" y3="-1.57353283" z3="8.51335677">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89024879" y3="-1.84086597" z3="9.57573306">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18266461" y3="-1.0164098" z3="8.17048731">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23225744" y3="-2.85677969" z3="7.69756929">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.42592236" y3="-2.58652886" z3="6.64385837">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14733686" y3="-3.37826483" z3="8.03028303">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03960801" y3="-3.81499862" z3="7.76940851">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.30726584" y3="-4.75480045" z3="7.25007813">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.15179075" y3="-4.09321486" z3="8.82480904">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.24569387" y3="-3.26351858" z3="7.15024245">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61532728" y3="-2.37798907" z3="7.69667225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.0537775" y3="-4.01835319" z3="7.15127">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.07003823" y3="-2.95314611" z3="6.10351289">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22656322" y3="-1.74641001" z3="6.54844953">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58144442" y3="-0.1193624" z3="7.03454401">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83443025" y3="0.53894589" z3="6.57805477">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44829533" y3="0.84669928" z3="7.71322339">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35916741" y3="0.03316119" z3="8.45678445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.23038132" y3="0.5510835" z3="6.99032113">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.8049378" y3="1.74964226" z3="8.24508693">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.11253845" y3="1.09477497" z3="7.01758371">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80334741" y3="0.17707359" z3="6.49247489">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.21405784" y3="1.88912521" z3="6.25815371">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-5.00498749" y3="1.48828308" z3="7.98754613">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7550227" y3="0.64998599" z3="8.66020898">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35787188" y3="2.32197695" z3="8.63685129">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.73607349" y3="1.99888465" z3="7.31856533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73913663" y3="2.59156682" z3="6.24648952">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.88649852" y3="2.13020547" z3="8.03389629">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8729,.9723,3.817;-1.1906,1.3093,2.8116;.1989,1.2181,3.9317;-1.4375,1.5657,4.5569;-1.118,-.5262,3.9938;-.7948,-.832,5.0045;-.4855,-1.0856,3.2767;-2.579,-.9426,3.789;-2.6558,-2.0426,3.8866;-2.8663,-.7012,2.7448;-3.5985,-.3043,4.7453;-4.6085,-.5881,4.4011;-3.5329,.7985,4.7142;-3.4829,-.801,6.1939;-2.2972,-.6396,8.4126;-3.1911,-1.1951,8.7534;-2.141,.1975,9.1293;-1.0769,-1.5735,8.5134;-.8902,-1.8409,9.5757;-.1827,-1.0164,8.1705;-1.2323,-2.8568,7.6976;-1.4259,-2.5865,6.6439;-2.1473,-3.3783,8.0303;-.0396,-3.815,7.7694;-.3073,-4.7548,7.2501;.1518,-4.0932,8.8248;1.2457,-3.2635,7.1502;1.6153,-2.378,7.6967;2.0538,-4.0184,7.1513;1.07,-2.9531,6.1035;-4.2266,-1.7464,6.5484;-2.5814,-.1194,7.0345;-1.8344,.5389,6.5781;-7.4483,.8467,7.7132;-7.3592,.0332,8.4568;-8.2304,.5511,6.9903;-7.8049,1.7496,8.2451;-6.1125,1.0948,7.0176;-5.8033,.1771,6.4925;-6.2141,1.8891,6.2582;-5.005,1.4883,7.9875;-4.755,.65,8.6602;-5.3579,2.322,8.6369;-3.7361,1.9989,7.3186;-3.7391,2.5916,6.2465;-2.8865,2.1302,8.0339;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724161078155</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.001403367775 0.000211275462 0.036775425418 0.008531975828</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.002076820 0.000003315 0.000074916 0.000184908 0.000256093 0.000389991 0.001232465 0.001348318 0.002063873 0.002972610 0.003436786 0.003995500 0.004267283 0.005128435 0.005504162 0.006273259 0.006543256 0.008142059 0.008346080 0.009669023 0.010431514 0.011858518 0.014003672 0.015357212 0.020045902 0.021664156 0.024891498 0.025861299 0.031496203 0.035143510 0.036209697 0.039342825 0.044070844 0.044495673 0.045378559 0.048579766 0.049799538 0.050529601 0.050818722 0.052203356 0.052276048 0.052581815 0.053327132 0.055303386 0.056806705 0.057778592 0.059378321 0.061216012 0.062933917 0.063206976 0.067184659 0.070941516 0.073238526 0.077279089 0.079081396 0.079566439 0.080191088 0.084564169 0.085329968 0.092949412 0.096572803 0.099217319 0.104715662 0.106328404 0.109562511 0.111916423 0.114681456 0.116741399 0.117789936 0.120344361 0.131458740 0.137282468 0.140987090 0.145282111 0.147959458 0.155069962 0.155589198 0.168038452 0.173661819 0.175781237 0.181495524 0.192548068 0.198321564 0.204732364 0.213144205 0.217443272 0.225775829 0.241297409 0.257476852 0.268410696 0.316977776 0.325174545 0.357978442 0.364260845 0.423214433 0.458221051 0.512010858 0.549076353 0.568060996 0.616446775 0.634942023 0.645685483 0.690527557 0.744673011 0.749284980 0.749760398 0.760755638 0.763121052 0.772221146 0.774046583 0.786023919 0.793028450 0.800069082 0.804475315 0.815617745 0.818446317 0.823504968 0.832484571 0.840087025 0.860993497 0.872827025 0.878557639 0.880068807 0.895348950 0.901318882 0.910863793 0.917512673 0.923395997 0.926351932 0.983767642 1.311530631 1.492862751</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">126</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.88696746" y3="0.98014685" z3="3.8181397">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.20803824" y3="1.31862258" z3="2.8145198">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.18352521" y3="1.23146854" z3="3.93235308">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.45394936" y3="1.56799891" z3="4.56073837">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12349381" y3="-0.52017012" z3="3.98980646">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79624165" y3="-0.82805901" z3="4.99856066">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48940259" y3="-1.0738057" z3="3.26948963">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58233847" y3="-0.94432508" z3="3.78617376">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65280613" y3="-2.04470424" z3="3.88211006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87173886" y3="-0.70313216" z3="2.74255977">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60478217" y3="-0.31254286" z3="4.74346689">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61335153" y3="-0.60119474" z3="4.39906125">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.5444042" y3="0.79059232" z3="4.71346005">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48764693" y3="-0.80898422" z3="6.19193345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30257228" y3="-0.64624762" z3="8.41044442">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19591839" y3="-1.20338418" z3="8.74993657">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14838114" y3="0.19059029" z3="9.1278971">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08054982" y3="-1.57789179" z3="8.51158108">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89781375" y3="-1.84970335" z3="9.57349578">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18603511" y3="-1.0173116" z3="8.17510425">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22918973" y3="-2.8575117" z3="7.68891724">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.41212305" y3="-2.58231023" z3="6.63474608">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14773419" y3="-3.37965505" z3="8.0099175">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03784766" y3="-3.8165662" z3="7.76748351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29913453" y3="-4.75206409" z3="7.23735582">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14124517" y3="-4.10321721" z3="8.82287222">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25535338" y3="-3.26016214" z3="7.17028891">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62028691" y3="-2.38373399" z3="7.73344767">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.061285" y3="-4.01701429" z3="7.17068772">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.09327615" y3="-2.93509102" z3="6.12623985">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23043328" y3="-1.75427895" z3="6.54746443">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58688846" y3="-0.1253779" z3="7.03250263">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.8362437" y3="0.52702825" z3="6.57435262">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44307451" y3="0.85607011" z3="7.71620481">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35658159" y3="0.04639921" z3="8.46381985">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22626287" y3="0.55915738" z3="6.99506371">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79745595" y3="1.76264052" z3="8.24376821">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10676854" y3="1.09672622" z3="7.01897248">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80099882" y3="0.17570074" z3="6.49780273">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20655461" y3="1.88791982" z3="6.2559071">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99713443" y3="1.49155845" z3="7.9859563">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75073533" y3="0.65671377" z3="8.66429006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34644444" y3="2.33116505" z3="8.62952592">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72618083" y3="1.99202619" z3="7.31271265">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72905891" y3="2.5829056" z3="6.23937722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87566333" y3="2.12346485" z3="8.0273789">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.887,.9801,3.8181;-1.208,1.3186,2.8145;.1835,1.2315,3.9324;-1.4539,1.568,4.5607;-1.1235,-.5202,3.9898;-.7962,-.8281,4.9986;-.4894,-1.0738,3.2695;-2.5823,-.9443,3.7862;-2.6528,-2.0447,3.8821;-2.8717,-.7031,2.7426;-3.6048,-.3125,4.7435;-4.6134,-.6012,4.3991;-3.5444,.7906,4.7135;-3.4876,-.809,6.1919;-2.3026,-.6462,8.4104;-3.1959,-1.2034,8.7499;-2.1484,.1906,9.1279;-1.0805,-1.5779,8.5116;-.8978,-1.8497,9.5735;-.186,-1.0173,8.1751;-1.2292,-2.8575,7.6889;-1.4121,-2.5823,6.6347;-2.1477,-3.3797,8.0099;-.0378,-3.8166,7.7675;-.2991,-4.7521,7.2374;.1412,-4.1032,8.8229;1.2554,-3.2602,7.1703;1.6203,-2.3837,7.7334;2.0613,-4.017,7.1707;1.0933,-2.9351,6.1262;-4.2304,-1.7543,6.5475;-2.5869,-.1254,7.0325;-1.8362,.527,6.5744;-7.4431,.8561,7.7162;-7.3566,.0464,8.4638;-8.2263,.5592,6.9951;-7.7975,1.7626,8.2438;-6.1068,1.0967,7.019;-5.801,.1757,6.4978;-6.2066,1.8879,6.2559;-4.9971,1.4916,7.986;-4.7507,.6567,8.6643;-5.3464,2.3312,8.6295;-3.7262,1.992,7.3127;-3.7291,2.5829,6.2394;-2.8757,2.1235,8.0274;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724162774193</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000357306713 0.000052496822 0.016511542000 0.003836068332</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.001080267 0.000009617 0.000066251 0.000116448 0.000207175 0.000353335 0.001170033 0.001304923 0.002074168 0.002976123 0.003430563 0.003985060 0.004233437 0.005132219 0.005464367 0.006272568 0.006551371 0.008142599 0.008332207 0.009651945 0.010429234 0.011869362 0.014003878 0.015359083 0.020048273 0.021675122 0.024891758 0.025859289 0.031502488 0.035145474 0.036210632 0.039345583 0.044071141 0.044497877 0.045379183 0.048575684 0.049803924 0.050529523 0.050815798 0.052204048 0.052275988 0.052582492 0.053328817 0.055295275 0.056806353 0.057759484 0.059375423 0.061207132 0.062939028 0.063207805 0.067195421 0.070941620 0.073240640 0.077282354 0.079088378 0.079575068 0.080191360 0.084560310 0.085340650 0.092948676 0.096575979 0.099217537 0.104721308 0.106332059 0.109563886 0.111916651 0.114687909 0.116741565 0.117792505 0.120347279 0.131459092 0.137278531 0.140989866 0.145295894 0.147960729 0.155088895 0.155610570 0.168038467 0.173662169 0.175775879 0.181496198 0.192550341 0.198325391 0.204745749 0.213171622 0.217462949 0.225819600 0.241331770 0.257490007 0.268427006 0.316988410 0.325178694 0.357990205 0.364273923 0.423219736 0.458230796 0.512013798 0.549084485 0.568062483 0.616496648 0.634951453 0.645705924 0.690536862 0.744740640 0.749286426 0.749763525 0.760757245 0.763157662 0.772232714 0.774049305 0.786025834 0.793068404 0.800071200 0.804480427 0.815623430 0.818453764 0.823526384 0.832495518 0.840120428 0.861005855 0.872830181 0.878569580 0.880118275 0.895375525 0.901322942 0.910877571 0.917519148 0.923417569 0.926367377 0.983795275 1.311807492 1.492875978</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">127</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.89053537" y3="0.98242209" z3="3.8191649">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.21128413" y3="1.32142385" z3="2.81568344">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.17940007" y3="1.23538887" z3="3.93472037">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.4592786" y3="1.56844621" z3="4.56188106">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12447587" y3="-0.51848608" z3="3.98871924">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79670506" y3="-0.82715106" z3="4.99705339">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48931513" y3="-1.0702605" z3="3.26783499">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58240251" y3="-0.94517505" z3="3.78415461">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65082394" y3="-2.04568127" z3="3.87947879">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87153628" y3="-0.70408855" z3="2.74045697">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.6067696" y3="-0.3155638" z3="4.74082646">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61451633" y3="-0.606296" z3="4.39578983">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54843089" y3="0.78767808" z3="4.71101157">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48980693" y3="-0.81130738" z3="6.1894734">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30591443" y3="-0.64710223" z3="8.40830378">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19904814" y3="-1.20485594" z3="8.7473319">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15254058" y3="0.1897245" z3="9.12597967">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.0833199" y3="-1.57793446" z3="8.50955803">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90219759" y3="-1.85157604" z3="9.57127025">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18857728" y3="-1.01611489" z3="8.17562761">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22957592" y3="-2.85611982" z3="7.68421286">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.40709778" y3="-2.57910342" z3="6.62955812">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15041431" y3="-3.37753139" z3="7.9998011">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03959838" y3="-3.81645193" z3="7.76681454">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29854361" y3="-4.75006446" z3="7.23210312">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.13333507" y3="-4.10649353" z3="8.8225119">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25799617" y3="-3.25907868" z3="7.17983032">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62093986" y3="-2.38631469" z3="7.74995922">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06251001" y3="-4.01732499" z3="7.18138279">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.10307162" y3="-2.92832752" z3="6.13645172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23191605" y3="-1.75668539" z3="6.54539728">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59010358" y3="-0.12612618" z3="7.03035385">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83722543" y3="0.5230533" z3="6.57132939">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.43935914" y3="0.85581376" z3="7.7218828">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35016552" y3="0.04474151" z3="8.46774654">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22479999" y3="0.55995533" z3="7.00271859">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79263534" y3="1.76131424" z3="8.252453">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10517947" y3="1.09819929" z3="7.02087285">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80041402" y3="0.1778554" z3="6.49769471">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20782735" y3="1.89021261" z3="6.25882675">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99304681" y3="1.49288363" z3="7.98501731">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74779309" y3="0.65920292" z3="8.66526584">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.33967222" y3="2.33499784" z3="8.62684626">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72178913" y3="1.98853904" z3="7.30825291">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72587328" y3="2.57826173" z3="6.23406468">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87071263" y3="2.12155726" z3="8.02221955">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8905,.9824,3.8192;-1.2113,1.3214,2.8157;.1794,1.2354,3.9347;-1.4593,1.5684,4.5619;-1.1245,-.5185,3.9887;-.7967,-.8272,4.9971;-.4893,-1.0703,3.2678;-2.5824,-.9452,3.7842;-2.6508,-2.0457,3.8795;-2.8715,-.7041,2.7405;-3.6068,-.3156,4.7408;-4.6145,-.6063,4.3958;-3.5484,.7877,4.711;-3.4898,-.8113,6.1895;-2.3059,-.6471,8.4083;-3.199,-1.2049,8.7473;-2.1525,.1897,9.126;-1.0833,-1.5779,8.5096;-.9022,-1.8516,9.5713;-.1886,-1.0161,8.1756;-1.2296,-2.8561,7.6842;-1.4071,-2.5791,6.6296;-2.1504,-3.3775,7.9998;-.0396,-3.8165,7.7668;-.2985,-4.7501,7.2321;.1333,-4.1065,8.8225;1.258,-3.2591,7.1798;1.6209,-2.3863,7.75;2.0625,-4.0173,7.1814;1.1031,-2.9283,6.1365;-4.2319,-1.7567,6.5454;-2.5901,-.1261,7.0304;-1.8372,.5231,6.5713;-7.4394,.8558,7.7219;-7.3502,.0447,8.4677;-8.2248,.56,7.0027;-7.7926,1.7613,8.2525;-6.1052,1.0982,7.0209;-5.8004,.1779,6.4977;-6.2078,1.8902,6.2588;-4.993,1.4929,7.985;-4.7478,.6592,8.6653;-5.3397,2.335,8.6268;-3.7218,1.9885,7.3083;-3.7259,2.5783,6.2341;-2.8707,2.1216,8.0222;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724162633023</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000193081441 0.000040509056 0.008157223110 0.002511408494</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.002330622758 0.001553748505</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000968096 0.000009183 0.000118748 0.000182325 0.000226497 0.000402352 0.001137373 0.001303870 0.002041187 0.002966121 0.003429318 0.003976650 0.004221211 0.005132200 0.005455787 0.006273513 0.006552452 0.008139437 0.008332890 0.009645081 0.010428185 0.011870620 0.014003060 0.015358514 0.020050704 0.021687021 0.024893039 0.025859156 0.031502072 0.035146142 0.036210951 0.039351043 0.044070558 0.044499302 0.045388266 0.048575229 0.049805392 0.050530997 0.050812119 0.052204919 0.052276341 0.052582675 0.053329495 0.055296148 0.056810822 0.057761135 0.059374075 0.061210436 0.062941623 0.063207468 0.067200775 0.070942166 0.073241184 0.077284007 0.079091621 0.079579883 0.080191309 0.084558486 0.085349078 0.092952285 0.096579383 0.099217543 0.104722273 0.106336012 0.109564016 0.111916965 0.114692370 0.116742693 0.117793328 0.120349182 0.131459487 0.137278483 0.140989723 0.145300736 0.147961154 0.155091183 0.155625218 0.168038552 0.173663407 0.175775092 0.181497064 0.192550158 0.198327556 0.204754835 0.213178270 0.217472260 0.225828446 0.241343779 0.257491972 0.268434859 0.316987697 0.325181059 0.357995075 0.364275485 0.423226604 0.458230734 0.512017392 0.549091396 0.568067109 0.616518590 0.634952422 0.645715252 0.690544960 0.744757076 0.749288344 0.749765177 0.760757549 0.763168673 0.772253166 0.774050583 0.786026964 0.793084100 0.800071376 0.804481142 0.815627380 0.818456407 0.823538714 0.832499439 0.840129518 0.861013509 0.872832637 0.878578829 0.880126812 0.895386979 0.901325298 0.910890392 0.917524196 0.923446639 0.926369458 0.983830904 1.312081674 1.492893020</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">128</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.88771533" y3="0.97923462" z3="3.81937944">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.20784615" y3="1.31813515" z3="2.81565138">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.18266546" y3="1.2303647" z3="3.93468404">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.45533458" y3="1.56675827" z3="4.56176444">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12444165" y3="-0.5211299" z3="3.99005983">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79764051" y3="-0.82955377" z3="4.99878942">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.49004061" y3="-1.07453177" z3="3.26977417">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58312032" y3="-0.94519414" z3="3.78549364">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65356324" y3="-2.04556352" z3="3.88081888">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.8719547" y3="-0.70350179" z3="2.74185909">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60606084" y3="-0.31388682" z3="4.74253332">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61444286" y3="-0.60266506" z3="4.39773392">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54581073" y3="0.78925432" z3="4.71296425">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48927835" y3="-0.81052896" z3="6.19087744">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30525019" y3="-0.64767853" z3="8.40981389">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19825883" y3="-1.20577854" z3="8.74857747">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15199546" y3="0.18876865" z3="9.12793368">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08240351" y3="-1.57828708" z3="8.51055143">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90056074" y3="-1.85174296" z3="9.5721852">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18803561" y3="-1.01627031" z3="8.1760351">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.2287502" y3="-2.85661635" z3="7.68547644">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.4090125" y3="-2.57975945" z3="6.63129156">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14804206" y3="-3.37940321" z3="8.00316027">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03734737" y3="-3.81544462" z3="7.76532402">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29667323" y3="-4.74968966" z3="7.23200544">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.13881524" y3="-4.10465122" z3="8.82059304">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25770097" y3="-3.25700647" z3="7.17398571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62109522" y3="-2.38296661" z3="7.74180199">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06333937" y3="-4.01408714" z3="7.17401504">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.09901301" y3="-2.92785435" z3="6.13066821">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23136316" y3="-1.75635937" z3="6.54596346">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58959258" y3="-0.12596462" z3="7.03215569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83751719" y3="0.52449591" z3="6.57375134">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44206171" y3="0.85834991" z3="7.71832623">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35607214" y3="0.04993297" z3="8.46730828">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.2257791" y3="0.56085747" z3="6.99798131">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79565131" y3="1.76610479" z3="8.2445427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10574616" y3="1.09671951" z3="7.02025877">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80101806" y3="0.17460695" z3="6.50034064">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20515254" y3="1.88682772" z3="6.25596611">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99540479" y3="1.49227607" z3="7.98612954">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.7501669" y3="0.6587825" z3="8.66655969">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34361753" y3="2.33394884" z3="8.62759459">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.7237842" y3="1.98946388" z3="7.31137939">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72685" y3="2.58010646" z3="6.23775345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87324114" y3="2.12158375" z3="8.02607531">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8877,.9792,3.8194;-1.2078,1.3181,2.8157;.1827,1.2304,3.9347;-1.4553,1.5668,4.5618;-1.1244,-.5211,3.9901;-.7976,-.8296,4.9988;-.49,-1.0745,3.2698;-2.5831,-.9452,3.7855;-2.6536,-2.0456,3.8808;-2.872,-.7035,2.7419;-3.6061,-.3139,4.7425;-4.6144,-.6027,4.3977;-3.5458,.7893,4.713;-3.4893,-.8105,6.1909;-2.3053,-.6477,8.4098;-3.1983,-1.2058,8.7486;-2.152,.1888,9.1279;-1.0824,-1.5783,8.5106;-.9006,-1.8517,9.5722;-.188,-1.0163,8.176;-1.2288,-2.8566,7.6855;-1.409,-2.5798,6.6313;-2.148,-3.3794,8.0032;-.0373,-3.8154,7.7653;-.2967,-4.7497,7.232;.1388,-4.1047,8.8206;1.2577,-3.257,7.174;1.6211,-2.383,7.7418;2.0633,-4.0141,7.174;1.099,-2.9279,6.1307;-4.2314,-1.7564,6.546;-2.5896,-.126,7.0322;-1.8375,.5245,6.5738;-7.4421,.8583,7.7183;-7.3561,.0499,8.4673;-8.2258,.5609,6.998;-7.7957,1.7661,8.2445;-6.1057,1.0967,7.0203;-5.801,.1746,6.5003;-6.2052,1.8868,6.256;-4.9954,1.4923,7.9861;-4.7502,.6588,8.6666;-5.3436,2.3339,8.6276;-3.7238,1.9895,7.3114;-3.7269,2.5801,6.2378;-2.8732,2.1216,8.0261;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724162888613</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000071419502 0.000020495492 0.013272339809 0.003508120896</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.006300800042 0.004200533361</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000748969 -0.000005863 0.000123495 0.000179092 0.000234429 0.000444820 0.001101725 0.001266933 0.001996483 0.002938986 0.003423405 0.003962975 0.004209144 0.005120948 0.005445397 0.006271723 0.006554887 0.008133809 0.008327165 0.009635160 0.010427988 0.011874842 0.014001798 0.015358280 0.020051658 0.021691123 0.024893412 0.025858817 0.031500635 0.035147247 0.036211319 0.039352763 0.044070045 0.044501441 0.045392404 0.048574298 0.049807720 0.050532935 0.050811844 0.052205943 0.052276844 0.052583555 0.053329309 0.055295337 0.056807743 0.057755628 0.059375299 0.061207337 0.062942427 0.063205968 0.067204534 0.070941117 0.073242456 0.077286290 0.079093187 0.079583610 0.080192042 0.084552463 0.085363993 0.092955642 0.096581243 0.099217835 0.104722904 0.106338535 0.109564522 0.111917473 0.114695008 0.116742783 0.117794280 0.120350168 0.131459716 0.137276597 0.140989403 0.145304532 0.147961242 0.155096022 0.155632376 0.168038421 0.173663165 0.175772817 0.181497679 0.192551248 0.198328664 0.204762017 0.213183065 0.217477811 0.225824327 0.241370269 0.257496336 0.268441662 0.316992979 0.325182664 0.357999059 0.364280377 0.423228826 0.458230864 0.512019346 0.549098279 0.568068681 0.616527254 0.634954207 0.645716700 0.690548701 0.744770708 0.749287919 0.749767102 0.760757740 0.763173244 0.772258377 0.774051064 0.786028766 0.793094392 0.800071214 0.804482274 0.815630113 0.818453414 0.823545862 0.832501902 0.840138049 0.861011399 0.872834245 0.878585695 0.880143567 0.895391133 0.901326824 0.910892149 0.917525161 0.923460411 0.926370572 0.983869064 1.312189525 1.492898484</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">129</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.88420018" y3="0.97395126" z3="3.82341405">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.20224816" y3="1.31286698" z3="2.81902919">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.18639962" y3="1.22342071" z3="3.9403334">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.45205576" y3="1.56274429" z3="4.56458811">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12352692" y3="-0.52591526" z3="3.9944701">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79850322" y3="-0.83429304" z3="5.0037635">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48906001" y3="-1.08074293" z3="3.27534345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58258041" y3="-0.94785533" z3="3.788195">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65481147" y3="-2.04808946" z3="3.88388516">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86974969" y3="-0.70617603" z3="2.7440998">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.6057853" y3="-0.31473629" z3="4.74378209">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61412835" y3="-0.60252137" z3="4.39806618">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54416135" y3="0.78830313" z3="4.71389718">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.49077575" y3="-0.81095927" z3="6.19237144">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30761011" y3="-0.64894302" z3="8.41183852">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.20022991" y3="-1.20819616" z3="8.74967617">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15549577" y3="0.18703112" z3="9.1307445">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08373698" y3="-1.5782506" z3="8.51183892">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90082285" y3="-1.85174469" z3="9.57327554">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.19028964" y3="-1.01507734" z3="8.17682713">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22928886" y3="-2.8565427" z3="7.68656527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.41422189" y3="-2.57969119" z3="6.63316688">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14591593" y3="-3.38221127" z3="8.00745318">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03478593" y3="-3.81193959" z3="7.76130283">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.293639" y3="-4.7467386" z3="7.2287104">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.1466123" y3="-4.10096875" z3="8.81579315">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25614869" y3="-3.24954923" z3="7.16461146">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61959823" y3="-2.37481407" z3="7.73130187">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06391775" y3="-4.00436498" z3="7.1607427">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.09219842" y3="-2.92018521" z3="6.12225997">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23329824" y3="-1.75645051" z3="6.54702337">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.591596" y3="-0.12644934" z3="7.03441333">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83822062" y3="0.52291187" z3="6.57609648">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4430224" y3="0.86089757" z3="7.71595919">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35808353" y3="0.05081497" z3="8.46351359">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.226814" y3="0.56565317" z3="6.99472472">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79586124" y3="1.76812697" z3="8.2438323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10607155" y3="1.09910669" z3="7.01883572">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80195635" y3="0.17741681" z3="6.4976593">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20437924" y3="1.89052553" z3="6.25557831">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99587339" y3="1.49228276" z3="7.98587299">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75264127" y3="0.65787044" z3="8.66607435">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.3432781" y3="2.33425986" z3="8.62741977">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72270611" y3="1.98752403" z3="7.31234865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.7240764" y3="2.57854257" z3="6.23873544">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87334197" y3="2.11961173" z3="8.02845359">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8842,.974,3.8234;-1.2022,1.3129,2.819;.1864,1.2234,3.9403;-1.4521,1.5627,4.5646;-1.1235,-.5259,3.9945;-.7985,-.8343,5.0038;-.4891,-1.0807,3.2753;-2.5826,-.9479,3.7882;-2.6548,-2.0481,3.8839;-2.8697,-.7062,2.7441;-3.6058,-.3147,4.7438;-4.6141,-.6025,4.3981;-3.5442,.7883,4.7139;-3.4908,-.811,6.1924;-2.3076,-.6489,8.4118;-3.2002,-1.2082,8.7497;-2.1555,.187,9.1307;-1.0837,-1.5783,8.5118;-.9008,-1.8517,9.5733;-.1903,-1.0151,8.1768;-1.2293,-2.8565,7.6866;-1.4142,-2.5797,6.6332;-2.1459,-3.3822,8.0075;-.0348,-3.8119,7.7613;-.2936,-4.7467,7.2287;.1466,-4.101,8.8158;1.2561,-3.2495,7.1646;1.6196,-2.3748,7.7313;2.0639,-4.0044,7.1607;1.0922,-2.9202,6.1223;-4.2333,-1.7565,6.547;-2.5916,-.1264,7.0344;-1.8382,.5229,6.5761;-7.443,.8609,7.716;-7.3581,.0508,8.4635;-8.2268,.5657,6.9947;-7.7959,1.7681,8.2438;-6.1061,1.0991,7.0188;-5.802,.1774,6.4977;-6.2044,1.8905,6.2556;-4.9959,1.4923,7.9859;-4.7526,.6579,8.6661;-5.3433,2.3343,8.6274;-3.7227,1.9875,7.3123;-3.7241,2.5785,6.2387;-2.8733,2.1196,8.0285;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724162701541</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000324817084 0.000048814101 0.017192881190 0.005073576716</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000711580 -0.000022250 0.000062395 0.000107229 0.000286407 0.000374060 0.001084872 0.001155395 0.001954484 0.002879328 0.003418883 0.003947697 0.004205794 0.005096615 0.005443708 0.006264256 0.006567111 0.008064438 0.008298881 0.009628153 0.010423620 0.011869941 0.014002236 0.015354961 0.020049401 0.021694095 0.024893692 0.025859296 0.031508644 0.035149004 0.036211193 0.039347126 0.044073498 0.044496728 0.045400522 0.048575785 0.049805527 0.050542613 0.050818696 0.052206857 0.052276907 0.052584011 0.053328070 0.055298837 0.056818640 0.057743893 0.059366680 0.061203206 0.062931559 0.063202289 0.067203122 0.070912829 0.073240966 0.077291206 0.079094128 0.079584867 0.080193281 0.084511712 0.085409942 0.092964184 0.096582246 0.099215195 0.104724224 0.106343237 0.109564825 0.111919120 0.114693738 0.116739441 0.117791147 0.120351811 0.131458410 0.137272879 0.140990001 0.145300335 0.147960325 0.155096348 0.155636198 0.168038195 0.173660800 0.175774254 0.181499116 0.192569757 0.198326676 0.204746707 0.213183981 0.217476148 0.225772464 0.241344118 0.257495371 0.268401707 0.316989014 0.325166196 0.358001168 0.364265675 0.423227692 0.458231807 0.512030151 0.549091257 0.568070308 0.616521411 0.634955669 0.645693990 0.690555270 0.744770982 0.749287283 0.749764556 0.760757944 0.763168256 0.772267877 0.774050896 0.786028136 0.793096411 0.800070375 0.804481005 0.815630674 0.818426525 0.823544650 0.832497651 0.840146540 0.860995028 0.872819907 0.878588539 0.880104042 0.895387681 0.901326400 0.910883816 0.917516215 0.923481612 0.926369995 0.983897763 1.312298853 1.492900834</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">130</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.8741026" y3="0.96838521" z3="3.82372225">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.1878277" y3="1.30717666" z3="2.81788355">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.19732201" y3="1.21319701" z3="3.94323887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.44129716" y3="1.56086969" z3="4.56242628">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12052817" y3="-0.53016476" z3="3.99667853">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79965702" y3="-0.83811763" z3="5.00748581">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48645394" y3="-1.08880865" z3="3.28032212">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58098506" y3="-0.94592578" z3="3.78738833">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65816254" y3="-2.04600049" z3="3.88237569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.86563431" y3="-0.70217419" z3="2.74305562">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60250728" y3="-0.30939313" z3="4.74255739">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61185827" y3="-0.59372441" z3="4.39675902">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.53742788" y3="0.7934173" z3="4.71323339">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.4879276" y3="-0.80715395" z3="6.19051887">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30667481" y3="-0.64427883" z3="8.41106594">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19912919" y3="-1.20331935" z3="8.74983158">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15332555" y3="0.19135218" z3="9.13010117">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08325159" y3="-1.57447352" z3="8.50931566">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89948624" y3="-1.84840635" z3="9.57046331">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18970777" y3="-1.01182648" z3="8.1736095">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.23057267" y3="-2.85255163" z3="7.68393661">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.41439691" y3="-2.57555065" z3="6.63052514">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14828339" y3="-3.37642243" z3="8.00404681">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03784695" y3="-3.81004574" z3="7.7591983">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29910492" y3="-4.74548025" z3="7.22902015">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.14448868" y3="-4.09699485" z3="8.81399656">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25318795" y3="-3.25157512" z3="7.15934513">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.61727073" y3="-2.37385952" z3="7.72114957">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06049279" y3="-4.00687164" z3="7.15924465">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.08901191" y3="-2.92780364" z3="6.11528703">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22740824" y3="-1.75605378" z3="6.54268989">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.59182473" y3="-0.12055426" z3="7.03427649">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83986631" y3="0.53023957" z3="6.57700296">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44697422" y3="0.85908693" z3="7.72002534">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.36509624" y3="0.05752014" z3="8.4767415">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22938557" y3="0.5566735" z3="7.00025315">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79992089" y3="1.7723673" z3="8.23717732">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10827936" y3="1.08878667" z3="7.02339565">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80405268" y3="0.16208097" z3="6.51107634">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20389656" y3="1.87333265" z3="6.25296015">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99954241" y3="1.48968757" z3="7.98897517">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.75357362" y3="0.65932767" z3="8.67266927">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.35052012" y3="2.3327927" z3="8.6273359">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72815682" y3="1.98842396" z3="7.31415744">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.7323275" y3="2.58020276" z3="6.24126492">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87876807" y3="2.12306683" z3="8.03010396">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8741,.9684,3.8237;-1.1878,1.3072,2.8179;.1973,1.2132,3.9432;-1.4413,1.5609,4.5624;-1.1205,-.5302,3.9967;-.7997,-.8381,5.0075;-.4865,-1.0888,3.2803;-2.581,-.9459,3.7874;-2.6582,-2.046,3.8824;-2.8656,-.7022,2.7431;-3.6025,-.3094,4.7426;-4.6119,-.5937,4.3968;-3.5374,.7934,4.7132;-3.4879,-.8072,6.1905;-2.3067,-.6443,8.4111;-3.1991,-1.2033,8.7498;-2.1533,.1914,9.1301;-1.0833,-1.5745,8.5093;-.8995,-1.8484,9.5705;-.1897,-1.0118,8.1736;-1.2306,-2.8526,7.6839;-1.4144,-2.5756,6.6305;-2.1483,-3.3764,8.004;-.0378,-3.81,7.7592;-.2991,-4.7455,7.229;.1445,-4.097,8.814;1.2532,-3.2516,7.1593;1.6173,-2.3739,7.7211;2.0605,-4.0069,7.1592;1.089,-2.9278,6.1153;-4.2274,-1.7561,6.5427;-2.5918,-.1206,7.0343;-1.8399,.5302,6.577;-7.447,.8591,7.72;-7.3651,.0575,8.4767;-8.2294,.5567,7.0003;-7.7999,1.7724,8.2372;-6.1083,1.0888,7.0234;-5.8041,.1621,6.5111;-6.2039,1.8733,6.253;-4.9995,1.4897,7.989;-4.7536,.6593,8.6727;-5.3505,2.3328,8.6273;-3.7282,1.9884,7.3142;-3.7323,2.5802,6.2413;-2.8788,2.1231,8.0301;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724161330141</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000998241722 0.000129115391 0.023630885645 0.007306676318</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000671677 0.000015167 0.000053285 0.000161594 0.000288852 0.000447004 0.001039121 0.001120348 0.001929491 0.002859710 0.003419555 0.003940127 0.004205240 0.005089894 0.005444567 0.006266047 0.006569286 0.008060450 0.008293759 0.009625395 0.010424261 0.011870041 0.014002149 0.015353971 0.020047853 0.021694863 0.024893985 0.025859161 0.031511966 0.035149042 0.036211372 0.039350536 0.044073707 0.044497282 0.045410492 0.048577547 0.049806912 0.050548465 0.050822395 0.052206684 0.052277096 0.052584362 0.053327642 0.055299709 0.056822934 0.057745713 0.059368949 0.061202686 0.062931408 0.063201231 0.067203904 0.070911479 0.073241291 0.077290750 0.079094754 0.079584866 0.080192336 0.084509599 0.085417714 0.092962236 0.096582438 0.099215137 0.104725627 0.106347922 0.109565028 0.111919559 0.114693580 0.116738850 0.117791348 0.120353049 0.131458239 0.137271262 0.140990117 0.145300055 0.147961234 0.155098188 0.155637329 0.168038114 0.173659255 0.175774329 0.181498848 0.192575309 0.198329771 0.204756720 0.213185259 0.217473509 0.225771830 0.241360122 0.257495525 0.268408767 0.316988616 0.325165550 0.358002287 0.364264291 0.423229381 0.458230914 0.512042119 0.549098867 0.568075214 0.616522829 0.634956160 0.645695167 0.690560921 0.744768576 0.749288286 0.749766122 0.760758120 0.763169175 0.772281566 0.774050809 0.786028202 0.793097802 0.800070494 0.804482547 0.815645219 0.818421853 0.823565374 0.832497861 0.840160740 0.860994052 0.872818819 0.878594420 0.880104533 0.895387403 0.901327233 0.910887912 0.917531805 0.923515865 0.926372173 0.983976467 1.312506652 1.492903159</array>
            </module>
            <module cmlx:templateRef="geometry.cycle">
               <scalar cmlx:templateRef="iter" dataType="xsd:integer" dictRef="cc:cycleNumber">131</scalar>
               <module cmlx:templateRef="molecule">
                  <molecule cmlx:templateRef="atom" id="molecule">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.88864755" y3="0.98197337" z3="3.81815373">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.20994893" y3="1.32007425" z3="2.8145207">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.18147326" y3="1.23460003" z3="3.93266627">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.45653006" y3="1.56907683" z3="4.56064166">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12325311" y3="-0.51861925" z3="3.98962626">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.7957537" y3="-0.82608718" z3="4.99840362">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.48827052" y3="-1.07149571" z3="3.26948285">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.581426" y3="-0.94486422" z3="3.78557622">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65028854" y3="-2.04525635" z3="3.88189159">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87069145" y3="-0.70450321" z3="2.74173285">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60517707" y3="-0.31415358" z3="4.74215594">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61321652" y3="-0.60433084" z3="4.39754454">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54617751" y3="0.78903984" z3="4.71177022">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48776003" y3="-0.8098419" z3="6.19079085">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30285883" y3="-0.64565744" z3="8.409091">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19616801" y3="-1.20251723" z3="8.74916168">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.14799044" y3="0.19121935" z3="9.12635665">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08112938" y3="-1.57777674" z3="8.50951345">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.89974091" y3="-1.85190179" z3="9.57109114">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18597835" y3="-1.01677036" z3="8.17526604">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22921508" y3="-2.85551302" z3="7.68377642">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.40669476" y3="-2.57777761" z3="6.62933531">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.15062809" y3="-3.37587045" z3="7.99935327">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.04039073" y3="-3.81740184" z3="7.7655833">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.30106012" y3="-4.75082348" z3="7.23143126">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.13309265" y3="-4.10741264" z3="8.82115441">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25722869" y3="-3.26201297" z3="7.17686235">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.6209377" y3="-2.3881725" z3="7.74478046">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06138939" y3="-4.02069129" z3="7.17952131">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.10172338" y3="-2.93345823" z3="6.13290429">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.22950393" y3="-1.75580633" z3="6.54660963">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58782903" y3="-0.1249278" z3="7.03123147">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83719715" y3="0.52717459" z3="6.57267048">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.44247544" y3="0.85661307" z3="7.72042375">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.35597032" y3="0.04982585" z3="8.47115178">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22637368" y3="0.55729745" z3="7.0010545">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.79616267" y3="1.76542982" z3="8.24482405">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10645798" y3="1.09408801" z3="7.02130246">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80130876" y3="0.17095294" z3="6.50343419">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.20664517" y3="1.88250215" z3="6.25532727">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99606223" y3="1.49252417" z3="7.98597701">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74841655" y3="0.65986473" z3="8.66665153">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34524859" y3="2.33392921" z3="8.62724897">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72602075" y3="1.99183653" z3="7.31013809">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.73048067" y3="2.58141837" z3="6.23603503">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87466527" y3="2.1246596" z3="8.02366836">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8886,.982,3.8182;-1.2099,1.3201,2.8145;.1815,1.2346,3.9327;-1.4565,1.5691,4.5606;-1.1233,-.5186,3.9896;-.7958,-.8261,4.9984;-.4883,-1.0715,3.2695;-2.5814,-.9449,3.7856;-2.6503,-2.0453,3.8819;-2.8707,-.7045,2.7417;-3.6052,-.3142,4.7422;-4.6132,-.6043,4.3975;-3.5462,.789,4.7118;-3.4878,-.8098,6.1908;-2.3029,-.6457,8.4091;-3.1962,-1.2025,8.7492;-2.148,.1912,9.1264;-1.0811,-1.5778,8.5095;-.8997,-1.8519,9.5711;-.186,-1.0168,8.1753;-1.2292,-2.8555,7.6838;-1.4067,-2.5778,6.6293;-2.1506,-3.3759,7.9994;-.0404,-3.8174,7.7656;-.3011,-4.7508,7.2314;.1331,-4.1074,8.8212;1.2572,-3.262,7.1769;1.6209,-2.3882,7.7448;2.0614,-4.0207,7.1795;1.1017,-2.9335,6.1329;-4.2295,-1.7558,6.5466;-2.5878,-.1249,7.0312;-1.8372,.5272,6.5727;-7.4425,.8566,7.7204;-7.356,.0498,8.4712;-8.2264,.5573,7.0011;-7.7962,1.7654,8.2448;-6.1065,1.0941,7.0213;-5.8013,.171,6.5034;-6.2066,1.8825,6.2553;-4.9961,1.4925,7.986;-4.7484,.6599,8.6667;-5.3452,2.3339,8.6272;-3.726,1.9918,7.3101;-3.7305,2.5814,6.236;-2.8747,2.1247,8.0237;</scalar>
</formula>
</molecule>
               </module>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724162919571</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array dataType="xsd:string" delimiter="|" dictRef="g:item" size="4">Maximum Force|RMS Force|Maximum Displacement|RMS Displacement</array>
               <array dataType="xsd:double" dictRef="g:value" size="4">0.000312465492 0.000038356568 0.005567683827 0.001514012271</array>
               <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000300000000 0.000200000000 0.001500000000 0.001000000000</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000685573 0.000020768 0.000091507 0.000214264 0.000246962 0.000438183 0.000812695 0.001114169 0.001871514 0.002829471 0.003420552 0.003946104 0.004202190 0.005085505 0.005439889 0.006264910 0.006571152 0.008044090 0.008281775 0.009615330 0.010420988 0.011871846 0.014002409 0.015352199 0.020047667 0.021699332 0.024894615 0.025859140 0.031512436 0.035151366 0.036211213 0.039350592 0.044073430 0.044498408 0.045413198 0.048573358 0.049809341 0.050549907 0.050824748 0.052206783 0.052277386 0.052584881 0.053328054 0.055298924 0.056833897 0.057742515 0.059366829 0.061206155 0.062929339 0.063201082 0.067204588 0.070902007 0.073241632 0.077291685 0.079095508 0.079586056 0.080192106 0.084496635 0.085435519 0.092963322 0.096583246 0.099213874 0.104725890 0.106352368 0.109564270 0.111920260 0.114694825 0.116737824 0.117790884 0.120354744 0.131458460 0.137270997 0.140988772 0.145298006 0.147962253 0.155104494 0.155641819 0.168039399 0.173662117 0.175774672 0.181498260 0.192579810 0.198330347 0.204752412 0.213189724 0.217479562 0.225751131 0.241359010 0.257496410 0.268387384 0.316985892 0.325159525 0.358003140 0.364254887 0.423231690 0.458226961 0.512047760 0.549098281 0.568077845 0.616520858 0.634956461 0.645703583 0.690562590 0.744771846 0.749289800 0.749767263 0.760758375 0.763178247 0.772289960 0.774050756 0.786028706 0.793097633 0.800069057 0.804483431 0.815655117 0.818395825 0.823574358 0.832496216 0.840165490 0.860988151 0.872810992 0.878597962 0.880059696 0.895390993 0.901329025 0.910875994 0.917535774 0.923536102 0.926370388 0.984012698 1.312647183 1.492906839</array>
            </module>
            <module dictRef="cc:irc" id="irc">
               <module id="irc-center">
                  <molecule cmlx:templateRef="atom" id="irc-center.0">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="-0.88822271" y3="0.97980917" z3="3.81869987">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="-1.2088664" y3="1.31827429" z3="2.81499188">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="0.18209461" y3="1.23137418" z3="3.9335323">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-1.4557588" y3="1.56735753" z3="4.56109899">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="-1.12429145" y3="-0.52056523" z3="3.9899488">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="-0.79718796" y3="-0.82844968" z3="4.99872809">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="-0.4897786" y3="-1.07394477" z3="3.26979252">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="-2.58280433" y3="-0.94534183" z3="3.78571969">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="-2.65279584" y3="-2.04570028" z3="3.88157375">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="-2.87182894" y3="-0.70426703" z3="2.7419984">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-3.60591354" y3="-0.31405166" z3="4.74259269">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-4.61421984" y3="-0.60316883" z3="4.39790866">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-3.54594102" y3="0.78908014" z3="4.71277569">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-3.48887804" y3="-0.81040588" z3="6.19099189">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="-2.30452849" y3="-0.64716978" z3="8.4096683">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="-3.19755286" y3="-1.20499487" z3="8.74884317">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="-2.15073089" y3="0.18928098" z3="9.12765575">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="-1.08197544" y3="-1.57821909" z3="8.50998523">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="-0.90055441" y3="-1.85255881" z3="9.57147591">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="-0.18729916" y3="-1.01624524" z3="8.17617294">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="-1.22852447" y3="-2.85581519" z3="7.68378038">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="-1.40684228" y3="-2.57793545" z3="6.62955433">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="-2.14890797" y3="-3.37776023" z3="7.99956874">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="-0.03828198" y3="-3.81596775" z3="7.76455207">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="-0.29774215" y3="-4.74939867" z3="7.22987671">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="0.1359654" y3="-4.10640855" z3="8.81981571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="1.25827125" y3="-3.25826055" z3="7.17584595">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="1.62159724" y3="-2.38514878" z3="7.74514014">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="2.06313825" y3="-4.01614313" z3="7.17644733">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="1.10169383" y3="-2.92789054" z3="6.13263629">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-4.23063338" y3="-1.75645981" z3="6.54624314">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-2.58929231" y3="-0.12550165" z3="7.03207812">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="-1.83762727" y3="0.52530662" z3="6.57355386">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-7.4425461" y3="0.8588308" z3="7.71897064">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-7.3572105" y3="0.05183726" z3="8.46958948">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-8.22617201" y3="0.56029876" z3="6.99895812">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-7.7958335" y3="1.76779206" z3="8.24331491">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-6.10591767" y3="1.09532893" z3="7.02081749">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-5.80144174" y3="0.17219446" z3="6.50251688">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-6.2047641" y3="1.88422443" z3="6.25518512">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-4.99566105" y3="1.49207383" z3="7.98631571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-4.74986257" y3="0.65914966" z3="8.66723983">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-5.34427014" y3="2.3339526" z3="8.62733824">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-3.72440755" y3="1.98970317" z3="7.31120695">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-3.72791822" y3="2.58014267" z3="6.23749911">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-2.87374375" y3="2.12221795" z3="8.02568847">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8882,.9798,3.8187;-1.2089,1.3183,2.815;.1821,1.2314,3.9335;-1.4558,1.5674,4.5611;-1.1243,-.5206,3.9899;-.7972,-.8284,4.9987;-.4898,-1.0739,3.2698;-2.5828,-.9453,3.7857;-2.6528,-2.0457,3.8816;-2.8718,-.7043,2.742;-3.6059,-.3141,4.7426;-4.6142,-.6032,4.3979;-3.5459,.7891,4.7128;-3.4889,-.8104,6.191;-2.3045,-.6472,8.4097;-3.1976,-1.205,8.7488;-2.1507,.1893,9.1277;-1.082,-1.5782,8.51;-.9006,-1.8526,9.5715;-.1873,-1.0162,8.1762;-1.2285,-2.8558,7.6838;-1.4068,-2.5779,6.6296;-2.1489,-3.3778,7.9996;-.0383,-3.816,7.7646;-.2977,-4.7494,7.2299;.136,-4.1064,8.8198;1.2583,-3.2583,7.1758;1.6216,-2.3851,7.7451;2.0631,-4.0161,7.1764;1.1017,-2.9279,6.1326;-4.2306,-1.7565,6.5462;-2.5893,-.1255,7.0321;-1.8376,.5253,6.5736;-7.4425,.8588,7.719;-7.3572,.0518,8.4696;-8.2262,.5603,6.999;-7.7958,1.7678,8.2433;-6.1059,1.0953,7.0208;-5.8014,.1722,6.5025;-6.2048,1.8842,6.2552;-4.9957,1.4921,7.9863;-4.7499,.6591,8.6672;-5.3443,2.334,8.6273;-3.7244,1.9897,7.3112;-3.7279,2.5801,6.2375;-2.8737,2.1222,8.0257;</scalar>
</formula>
</molecule>
                  <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" id="irc-center.0" units="nonsi:hartree">-738.724162996131</scalar>
                  <scalar dictRef="cc:ircStep" id="step">0</scalar>
               </module>
               <module cmlx:templateRef="irc-path">
                  <scalar cmlx:templateRef="direction" dataType="xsd:string" dictRef="g:ircDirection">FORWARD</scalar>
               </module>
               <module cmlx:templateRef="irc-path">
                  <scalar cmlx:templateRef="direction" dataType="xsd:string" dictRef="g:ircDirection">BACKWARD</scalar>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:frequencies">
                  <module dictRef="cc:vibrations">
                     <array dataType="xsd:integer" dictRef="x:serial" size="132">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131</array>
                     <array dataType="xsd:double" dictRef="cc:frequency" size="132">-54.34766470 19.15062181 31.11989948 33.85042176 46.38359798 52.20600587 62.71664936 76.57065356 83.48444284 108.11420904 120.23579218 128.14926895 147.68177752 186.78409752 193.84189714 207.26169643 217.55845561 233.00563416 261.35549578 271.94511314 282.72213292 306.95159099 321.23195536 348.83268939 369.01192234 395.97675889 411.07921478 441.60138111 480.73253562 546.23666923 585.42157848 691.85818057 751.60715210 752.51769086 754.87621150 760.33687533 786.30716460 796.49505675 818.83781755 843.15410738 853.37122994 877.41792549 882.72233194 894.83002651 932.98330166 946.18424258 972.46720741 980.18282615 988.06164575 995.46699486 1022.72643448 1037.09504483 1078.11889374 1080.76550329 1102.65891662 1108.04310045 1118.19873991 1127.57191672 1139.41953136 1140.66954384 1151.87854757 1153.78454984 1197.61279554 1220.12447047 1249.32866266 1259.86628447 1261.00673546 1273.76949388 1308.37863431 1313.47478021 1325.91063689 1329.41908368 1343.51356476 1353.30933715 1361.82080378 1372.16341436 1384.50928130 1385.85089055 1397.48761533 1403.04546512 1407.94305735 1424.21872276 1426.16607095 1427.60123011 1429.86955365 1457.65578942 1463.71633700 1468.40992711 1473.48155651 1481.86819816 1484.81992222 1485.37049519 1487.20087300 1490.15867013 1493.04886395 1494.87552050 1497.54217256 1499.03723693 1505.11051584 1515.12628147 1523.27459212 1671.24028118 1754.08418074 2902.50283816 2946.67721858 2957.11890135 2980.29646069 2993.05145726 3006.81467697 3009.37259191 3011.74483103 3019.21105164 3021.65755266 3036.92293241 3043.30925890 3049.33152953 3056.09010907 3062.19579437 3064.02968653 3064.81698030 3084.81332561 3086.92884897 3097.89345735 3099.17653147 3103.96545969 3104.22301256 3104.29782213 3107.49162569 3122.66012645 3125.36224642 3140.82192708 3176.71064037</array>
                     <array dataType="xsd:double" dictRef="cc:redmass" size="132">5.96529092 2.99532548 2.99687591 3.44132712 3.23421689 2.29821615 3.25275743 3.24655727 2.98763860 3.91846345 2.82429173 2.47925671 2.31071981 1.79576142 3.15997660 3.48371625 2.58173272 2.20070582 1.16730838 2.03095170 1.48011454 1.71637436 2.11521133 2.16653227 2.93833263 2.89418563 2.70974965 2.41194155 1.97638512 2.37163035 3.15023078 3.41415377 1.33802302 2.23826832 1.15695741 1.35269630 1.67055178 1.33658774 1.42992496 2.13909759 1.57373308 1.58218931 1.69783074 2.06887664 1.47282856 1.93320259 1.70410666 1.34576504 1.49895497 1.70226321 1.74632434 1.70817404 1.79819627 2.15286107 1.82879011 1.70009993 1.75351869 1.53968580 1.89925294 1.84848492 2.17973895 2.02824181 1.52844939 1.37242180 1.42765557 1.36159415 1.34062656 1.31308631 1.32611928 1.19275855 1.16477221 1.23656401 1.19065861 1.22793124 1.35482675 1.47116463 1.38525176 1.37841204 1.23708666 1.49638150 1.28671933 1.36679211 1.60675930 1.35096936 1.53887187 1.10536601 1.13803946 1.11066999 1.07089291 1.11637744 1.09302408 1.08227005 1.06167141 1.07769746 1.06329981 1.05645980 1.07453134 1.08426374 1.05784296 1.05851841 2.85638617 7.46681618 8.70482493 1.08571154 1.07017387 1.07344083 1.06690039 1.06598054 1.03829123 1.06168332 1.04569923 1.06341688 1.04185285 1.09459807 1.06407337 1.07907672 1.09637047 1.08862521 1.09213958 1.06750662 1.09947376 1.10259052 1.09035531 1.10101843 1.10529066 1.10456278 1.10260173 1.10351719 1.10329115 1.10345473 1.10377161 1.08767302</array>
                     <array dataType="xsd:double" dictRef="cc:displacement" size="18216">0.1423566664 -0.0793419989 0.0589155930 0.1362570430 -0.0777453727 0.0563321396 0.1969123572 -0.0877502836 0.1091271716 0.1613227278 -0.1064834293 -0.0121333392 0.0542282234 -0.0284049981 0.0796630274 0.0331148323 -0.0191683878 0.0797610705 0.0544058733 0.0066869666 0.1380751298 -0.0211779536 -0.0244102818 0.0196631539 -0.0768813654 0.0019368246 0.0444073003 -0.0351587292 -0.0216144628 0.0167494513 -0.0020370766 -0.0338914458 -0.0794994470 -0.0737155570 -0.0310253200 -0.1299340591 0.0603849464 -0.0619679540 -0.1101890052 0.0297218330 -0.0270618933 -0.0545743379 0.0937014554 -0.0151178100 -0.0116090623 0.0502442475 -0.0334340098 -0.0147558889 0.0860983914 -0.0361156851 -0.0172644007 0.0888943096 0.0725736584 0.0013913280 0.0460851584 0.0871996793 0.0055468413 0.1315547957 0.0893086311 0.0078563025 0.0718598947 0.0975615689 0.0128303715 0.0357909568 0.1156822526 0.0345871232 0.0833239714 0.1310742137 -0.0108879811 0.0749690473 0.0566640100 0.0235373603 0.0624690827 0.0831066935 0.0302709002 0.1092064453 0.0360968558 -0.0097041210 0.0545496581 0.0045731579 0.0689142701 0.0756917408 -0.0240189704 0.0612279263 0.0554848320 -0.0277697465 0.0837434497 0.0153504699 0.0246032946 0.0980440796 -0.0394209648 -0.0370408455 -0.0271485926 0.1787121009 -0.0345791741 0.0097065493 -0.0302191383 -0.0147733619 -0.0842666856 0.0659188876 0.0506911157 0.1143949983 0.1278059081 0.0252659738 0.0698761757 0.1380585999 0.0666347486 0.1530599133 0.0133900373 0.0870207517 0.1897730849 -0.0302592538 0.0111840242 0.0320392399 0.0312099527 -0.0173005219 -0.0429029794 -0.0913633026 0.0367627173 0.0745365744 -0.1141498161 0.0031128518 -0.0122917045 0.0228879143 -0.1028228087 -0.0379052821 -0.1282726671 0.1464007808 0.0772128261 -0.3313500125 -0.0217007848 -0.1511438023 -0.2976580746 -0.0000288641 -0.1072868814 -0.1798429151 -0.0667231877 -0.0594762770 0.1432630924 0.0768775358 0.0030172181 0.1825626939 0.0505808244 -0.0183917977 0.1754286218 0.1221159196 0.0177605994 0.1239952279 0.0406194078 -0.0105607687 0.0772858222 0.0999273829 0.0281024040 0.0421751585 0.1235208587 0.0469772445 0.0963085587 0.1372272872 0.0457546584 0.0300902833 0.0483389914 0.0050681584 -0.0118948067 0.0586724598 0.0300265890 0.0503416083 0.0299526941 -0.0193210670 0.0109561010 0.0131061020 -0.0206512177 -0.0132526100 -0.0112030228 -0.0367003947 0.0440312522 0.0030845979 -0.0396411002 -0.0143054972 0.0230820164 -0.0017803338 -0.0194250563 0.0464452601 0.0161485254 -0.0005851701 0.0368688848 0.0352462189 -0.0336765140 0.0666372746 0.0280699659 -0.0181339764 0.0255165977 -0.0103446273 -0.0053110157 0.0096759909 -0.0446022810 -0.0437650712 -0.0033197483 0.0041220646 -0.0009593184 0.0562945565 -0.0128656891 -0.0901116459 0.1108949502 0.0703241173 0.0933861115 0.1567455929 -0.0500851015 0.0128053058 -0.0968158891 -0.0688000442 0.0313604171 -0.0066085839 -0.0672870389 0.1087367380 -0.1679249066 -0.2001081282 -0.1170807425 -0.2780612527 0.0415457976 -0.1380122208 -0.3938067114 0.0335640974 -0.1061789705 -0.3717262593 -0.0021415057 -0.2088028882 -0.2102517542 0.1825410719 -0.0200349330 0.0097522410 0.0086081415 -0.0212545139 0.0426639266 0.0000560026 -0.0049500596 0.0506628751 -0.0044373607 -0.0548678299 -0.0740962460 0.0147638625 -0.0814190517 -0.0648606436 0.0401063069 -0.0560774364 -0.1051426106 0.0025903402 -0.0535172621 -0.0808512767 0.0108541011 -0.0224822416 -0.0375545884 0.0027741488 -0.0253830760 -0.0338838668 0.0069959562 0.0033164783 -0.0467890505 -0.0235543033 -0.0196986689 0.0048788291 0.0193239033 -0.0369378217 0.0134326322 0.0450064770 -0.0210854495 0.0056873693 0.0214088433 0.0067779765 0.0343898888 0.0006981362 0.0243285520 0.0276073830 -0.0283884943 -0.0051284066 0.0657489235 0.0063249633 -0.1601204012 -0.0207988578 -0.0421179543 -0.1922263292 0.0110352665 0.0028767985 -0.2199779978 -0.0773661766 -0.0777609958 -0.1525405430 0.0149141743 -0.0074940411 -0.0524951502 -0.0370990843 -0.0968765258 -0.0247423485 -0.0660705516 -0.1363767871 -0.0623821421 -0.0753542750 -0.1371566795 0.0357627797 0.0271653106 -0.0452550339 0.1049991038 0.0291314961 -0.0980215613 0.0366850051 0.0493947241 0.0053143559 0.0348462805 0.0485587195 0.0168112274 0.0950579440 0.0766368300 0.0580364748 -0.0251274630 0.0416078764 0.0642360522 0.0269974289 0.0391451646 -0.0382769785 0.0315907427 -0.0227366661 -0.0990738216 0.0024113979 0.0164496218 -0.1522869617 0.0640321044 -0.0801877786 -0.1291657711 0.0324372782 -0.0126185669 -0.0496147340 0.0385451260 -0.0391567473 -0.1207942333 0.0665214717 -0.0709190528 0.0242026342 -0.0193937354 0.1060792518 -0.0017230356 -0.0522669681 0.1469576982 0.0893338904 -0.0301176169 0.1897322711 -0.0860591442 -0.0171144263 0.0754176957 0.0394041427 -0.0588777002 0.2142542086 0.0655909007 0.0185367191 0.0216110843 -0.0923263268 -0.0083769575 -0.0628128083 0.2154604978 0.0215003747 -0.2210282391 0.1914730280 -0.0102844358 -0.0618175237 0.2336704068 -0.0311528944 -0.0143636610 0.3609056951 0.0124263358 0.0783071113 -0.0739961608 0.0303801737 -0.0088166281 -0.0480499430 0.0182532653 -0.0291237574 -0.0265314307 0.0470064052 -0.0529907301 0.0838402203 0.0997380077 -0.0954516361 0.1376136005 0.0266284635 -0.0827860284 0.0632000067 0.0605099064 0.0312821868 0.0964297460 -0.0080225955 -0.0700687067 0.0266081185 -0.0164348653 -0.1432847571 0.0133333088 -0.0539264127 -0.0354825526 -0.0169673105 0.0109441299 -0.0341341094 0.0490896664 0.0240084880 -0.0531861389 0.0892447187 0.0237469447 0.0063616792 0.0560943213 0.0007879473 -0.0201044624 0.0191289562 0.0148618614 -0.0247225089 0.0220151054 -0.0283350469 -0.0087116281 0.0048397710 -0.0511098663 -0.0099575941 0.0774124461 -0.0900640670 0.0169740975 0.1010015262 -0.0427112705 -0.0615193680 0.1001764653 -0.0217355294 0.0026732368 0.0395190221 -0.0493352477 0.0062683369 0.0656395338 -0.0223465787 -0.0149961661 0.0439246017 -0.0685787786 -0.0032024811 0.0948711003 -0.0577789083 0.0608654137 0.0442319927 -0.0590989373 0.0755741386 0.0360454512 -0.0790195541 0.0802035663 0.0699961627 -0.0397333565 0.0708370688 0.0030454799 -0.0560089693 0.0929609721 -0.0091611859 -0.0289572787 0.0607049132 0.0001644671 -0.0178460791 0.0628180944 -0.0168573421 0.0719933202 0.0143975081 -0.0182166051 0.0880038061 0.0264512559 -0.0214882177 0.0829630778 0.0214963797 -0.0205028673 0.0754305318 -0.0221470917 -0.0141925787 0.0990217064 -0.0178561571 0.0173580470 0.0606726666 -0.0082518120 -0.0354523311 0.0675880713 -0.0821024304 -0.0218297722 0.0820731346 -0.1072112220 -0.0817113585 0.0469909580 -0.1316567069 0.0122439034 0.0650364345 -0.0548599852 -0.0003401385 0.0597236656 -0.1433876781 -0.0061832541 0.0471550455 -0.0182818227 0.0948286547 0.0917732103 0.0395844180 -0.0928248820 0.1039868944 0.1421993157 -0.0842561708 0.0891532565 0.0449483107 -0.0708936500 0.1032386467 0.0061153259 -0.1974470061 -0.0533296777 0.0850729435 -0.0373872740 0.0407724317 0.0292095630 -0.0087564083 0.0205287738 0.0153992795 0.0012696448 -0.0901591924 -0.2018159435 0.0716289087 -0.0797839928 -0.2427710662 0.2229587646 -0.1497434945 -0.3157688697 0.0011370087 -0.0475794378 -0.0942437117 0.0572577137 -0.0809487602 -0.1449924418 -0.0114445882 -0.1228272002 -0.2488899460 0.0029530666 -0.0881054623 -0.1120915903 -0.1551648678 -0.0015280570 0.0051519241 0.0815898422 0.0164517310 -0.0403495045 0.2294617515 0.0457771993 0.1186928308 0.0877858390 0.0052417305 0.0786288695 -0.0165486833 0.0315815385 0.0702294077 -0.1042477052 0.0059624763 0.1548949433 0.0199915405 -0.1519739871 -0.0195652011 -0.0195334031 -0.2179371650 0.0092408515 -0.0240497283 -0.1822420165 -0.0637742234 -0.0330289598 -0.1139117941 0.0458271592 -0.0009891948 -0.0784436505 -0.0846973460 -0.0213505356 -0.0284400971 -0.1034738332 -0.0120036027 -0.1087228423 -0.1460545962 -0.0524170466 -0.0308032115 -0.0486245695 0.0060566145 0.0147716584 -0.0862293474 -0.0046779494 -0.0672107876 -0.0353835730 0.0061281914 0.0039450578 0.0112639233 0.0435001115 0.0154919163 0.0164278709 0.0512620745 -0.0216404933 0.0438206625 0.0450551890 0.0405476456 0.0126415110 0.0738150791 0.0257201608 0.0578498385 0.1084315641 0.0302290032 0.0201748068 0.1477222438 -0.0275396964 0.0758570053 0.1333703108 0.0202648238 0.1136918450 0.0380544442 -0.0278025448 0.1236928293 0.0271814036 0.0066513108 0.1279646544 0.0174985513 0.0902285171 0.1298109191 0.0062794359 0.0567621117 0.1568299866 0.0583027500 0.1727032677 0.1823676819 0.0070151388 0.0985577525 0.0529648025 -0.0927012206 0.1564890447 0.1086051485 -0.1074273438 0.1318481342 0.0138039248 -0.1823400832 -0.0052322453 -0.0470718421 -0.0595993730 -0.0597296987 -0.1143165595 -0.0548504892 0.0051812994 -0.0957975174 -0.1281757195 -0.0418963535 -0.0096588884 0.0326567398 0.0204103487 -0.0038908873 0.0938464118 0.0870464314 0.0330066474 0.0966215165 0.0510349119 0.0518941641 0.0619294089 -0.0909532286 -0.0758524616 -0.1014363604 -0.2213392450 0.0220310252 -0.2055380547 -0.0226096853 -0.0426754409 -0.0575054546 -0.1371152215 -0.2624472740 -0.1097449069 0.0416200238 -0.0048042286 -0.0138573816 0.0763510001 0.1593020735 -0.0021116190 0.1577942138 -0.0867691768 0.0688031533 -0.0234530946 -0.0360397841 -0.0582173587 -0.0356724857 -0.0129489789 -0.1228909556 -0.0577320113 -0.0865286423 -0.0466234177 -0.0265131939 -0.0366306191 -0.0483562565 0.0072968517 -0.0370472906 -0.0314295207 0.0498592428 -0.0519857497 0.0004249904 0.0295014342 -0.0168264366 0.0128707336 0.0385192828 -0.0243089153 0.0040611206 0.0524711650 -0.0049060437 0.0295045814 0.0290861880 -0.0318072450 -0.0068266316 -0.0107375014 -0.0023229301 0.0279008959 -0.0152252406 0.0026858462 0.0340226257 -0.0113122777 0.0115857564 0.0520540227 -0.0471964682 -0.0080796855 0.0007555988 -0.0716316651 -0.0166773430 0.0241836866 -0.0711012526 -0.0077218839 -0.0186531860 -0.0226734675 0.0093272510 -0.0409339355 -0.0491619407 0.0308326363 -0.0603479429 -0.0079410376 0.0180671649 -0.0557029785 0.0326081810 -0.0063155524 -0.0395098655 0.0089450674 -0.0182081470 -0.0643979452 0.0074241873 0.0074006967 -0.0896982324 0.0363236444 -0.0334657365 -0.0788160345 0.0121473450 -0.0464006991 -0.0319434659 0.0349579620 -0.0592267802 -0.0505274825 0.0183257538 -0.0706366819 -0.0056764418 -0.0205574880 -0.0203638526 -0.0106502896 -0.0084947316 -0.0216028214 -0.0053737304 -0.0562118838 -0.0234049033 -0.0297427800 -0.0239402324 0.0122222496 0.0306909192 -0.0517456673 0.0329668728 0.0418748346 -0.0367412022 0.0145229982 0.0263697052 0.0227201887 0.0177773636 0.0640221673 0.0423496064 -0.0053980401 0.0570209638 0.0183181490 0.0482462634 0.0867993943 0.0432110769 0.0144752014 0.0739287927 0.1345380907 -0.0196190005 -0.0237563341 -0.0313123511 -0.0016905314 -0.0550665532 -0.0657323842 -0.0077904922 -0.0597756491 -0.1357667822 -0.0897803135 -0.0211551875 -0.3817724774 0.0881652740 -0.1858074891 -0.0079271075 -0.0595490162 0.0498132772 -0.2232138867 -0.4155046533 -0.0272035461 0.1104040299 0.0638831876 0.1019831551 0.1724089117 0.3405977976 0.1167743990 0.3291476525 -0.0835441823 0.2242388261 -0.0180677279 0.0392956176 0.0274136506 -0.0593292775 0.0948750596 -0.0767688194 -0.0972114521 -0.0545418192 0.0678041908 -0.0145591309 0.0455491664 0.0150436210 -0.0253649761 0.0460564646 0.0025597136 -0.0487354909 0.0572394435 -0.0038196111 -0.0419991894 0.0532723242 -0.0415508001 -0.0199067864 0.0632021510 0.0121756498 -0.1021844909 0.0317388311 -0.0879892360 -0.0714516171 0.0459504264 0.0040274608 0.0444861599 0.0768552343 -0.1096483260 0.0126980639 0.0695285272 -0.1604712750 0.0739042828 0.0853859824 -0.1637247631 0.1370526101 0.0954406051 -0.0414704475 0.1946995841 0.1334672243 -0.1080749216 0.2001011528 0.0989503458 0.0194464505 0.0830882245 0.0540213384 0.0418649144 0.1465904892 0.0411492743 0.0868103579 0.0406344052 0.0224124841 0.0894410907 0.0138798797 0.0629958241 0.0041165590 0.0405907949 0.0274200709 -0.0042091621 0.0264714038 0.0396602757 -0.0234381849 0.0744257767 0.0184741469 -0.0202661234 0.0474559716 0.0037151925 0.0437792388 0.0762231684 0.0260286318 0.1305997794 0.0531430259 0.0543285152 -0.0022712355 0.0081610003 -0.1249173623 0.0394510735 -0.0022299809 -0.1595602918 -0.0716473930 -0.0162662294 -0.2012179530 0.0956008632 0.0083161322 -0.1367466978 0.1036946219 -0.0281081763 -0.2768244863 0.1039439339 0.0289760922 -0.0952554425 0.2470604610 0.0292541552 -0.0300990736 -0.0090943555 0.0778006940 0.1231959308 -0.0030119686 0.0256627385 -0.0634024965 0.0492305490 -0.0000400251 -0.0659790540 -0.1646086210 -0.0301526619 0.0860585902 -0.0120309080 0.0325250201 0.0357771622 0.0108633826 -0.0026116661 0.0293630267 0.0076704445 -0.0803185143 0.0035736527 -0.0551188114 -0.1498634528 0.0695941916 -0.1710290599 -0.0162569474 0.0650133212 -0.0024813628 -0.1249084956 -0.1350849199 -0.0490105919 -0.0190052704 0.0179693231 0.0168997344 0.0196283242 0.1404660741 0.0120539294 0.0407541989 -0.0355187526 0.1156922107 -0.0861856603 -0.0516077954 -0.0420082579 -0.0806641607 -0.0383011115 -0.1263372049 -0.1194208597 -0.0998381307 -0.0303746724 -0.1118652076 -0.0799989941 -0.0152541604 -0.0661378231 -0.0830904905 0.0695428204 -0.0850102961 -0.1253675728 -0.0149293638 -0.0467517064 -0.0452567826 0.0689897570 -0.0659568776 -0.0195169057 0.1137258504 -0.0472605005 -0.0985425855 0.0845126070 -0.0328786239 -0.0508885214 0.0350410481 -0.0391208080 -0.0024643396 0.0364918014 -0.0418993184 -0.0164830076 -0.0021285321 -0.0369556894 0.0121366688 0.0554156589 -0.0359896713 0.0426648574 0.0254954516 -0.0369380838 0.0630450252 0.0132625709 -0.0496704890 0.0601975752 0.0530334477 -0.0182123698 0.0486999299 -0.0167229827 -0.0391726807 0.0683457994 -0.0321352703 -0.0035256953 0.0472136755 -0.0263704246 0.0169927617 0.0384476696 -0.0179563358 -0.0457015434 0.0697777510 0.0023660990 -0.0724772673 0.0508607920 0.0062946802 -0.0274827285 0.0793676315 -0.0009207716 -0.0464855038 0.0878196544 0.0412042413 -0.0480121799 0.1172969876 0.1243600397 -0.0292359585 0.1488423866 -0.0080503432 -0.0675968358 -0.0194217136 0.0308489507 -0.0931821008 -0.0372478290 -0.0450671844 -0.0594815248 -0.0649085194 0.0771110737 -0.0647623379 -0.0693229263 0.0559626796 -0.0790439210 -0.1820400865 0.0510158132 -0.0239286008 -0.0481389520 0.1554614845 -0.0956354263 -0.0154210417 -0.0364178930 -0.0571490327 0.1130801223 -0.0306179619 -0.0947569680 -0.0871070646 0.0034812605 -0.1594595567 -0.0307383403 -0.1559313832 0.0910843698 0.0225295282 0.0001925212 -0.0368314583 0.0566978970 -0.0270901502 -0.0283745369 0.0648627248 -0.0349915873 0.1980488341 -0.0524618750 0.1087452128 0.2050024692 -0.0350208785 0.0152571687 0.3412938754 -0.0435861756 0.1784986486 0.0953669949 -0.0885298219 0.2200179591 0.1463724484 -0.0388655655 0.0060994738 0.2432605391 0.0142145117 -0.0880868803 0.1530820889 -0.0621196494 0.1025193511 -0.0344160091 -0.0536391316 -0.0883100011 -0.1006555573 0.0249203336 -0.2076265628 -0.1421991220 -0.1748981601 -0.0299204536 0.0069875433 -0.0196669543 -0.0944048824 0.0521439374 -0.0326849395 -0.1057168632 0.0005824285 0.0080772195 -0.0871511304 0.0120367547 0.2712780499 -0.1111231414 0.0086590529 0.2038718996 -0.2941098926 0.0570529468 0.4195338673 -0.1160749829 0.0220181198 0.3274153569 -0.0512948755 -0.0523509453 0.0876046822 0.0476238622 0.0085790988 0.1256729100 0.2091685423 -0.1007854785 0.0073187998 0.0274952309 -0.1271132624 -0.0355575878 0.0223131795 -0.1656855200 -0.1397460272 0.1161224775 -0.1819540738 -0.0745547902 -0.1104865676 -0.0820007297 0.0286258203 0.0373406325 -0.0753327410 0.0529619599 0.0415318353 -0.1044764212 0.0559001574 0.0396177769 -0.0153845214 0.0130392704 0.0313044909 0.0273922784 -0.0401852908 -0.0118156141 0.0500126690 -0.0034798938 -0.0350203838 0.0318088832 -0.0619996339 -0.0206784068 0.0315671833 -0.0839715308 -0.0264264098 0.0561977275 -0.1100729102 -0.0817442184 0.0096417519 -0.1340322397 0.0096568324 0.0334709358 -0.0260270495 -0.0159021704 0.0525508156 -0.0192498396 0.0201254445 0.0162175909 -0.0096418969 -0.0413894699 0.0306519628 0.0145224537 -0.0152592486 0.0305046126 0.0570536786 -0.0114973445 0.0010311230 0.0132682820 -0.0449448357 0.0660014671 0.0122797137 0.0178190590 0.0524811598 -0.0353924726 0.0154011293 0.0637848475 0.0607221112 0.0071524311 0.1095609687 0.0105299470 0.0569233971 0.0200474479 0.0229775852 0.0250675826 -0.0075606466 -0.0156162664 0.0275568517 -0.0301998586 -0.0296108333 0.0399809005 0.0748259573 -0.0167875439 0.0366201123 0.0953571195 -0.0165187151 -0.0158126444 0.1295464144 0.0076559111 0.0710760995 0.0354416608 -0.0264667801 0.0807277278 0.0346423773 -0.0359293070 0.0074371219 0.0715949830 -0.0164712521 -0.0289790590 0.0211032035 -0.0392195588 0.0614573509 -0.0327375095 -0.0682253283 -0.0375449480 -0.0480988248 -0.0431996386 -0.0964914075 -0.0713728265 -0.1174823581 -0.0198638749 -0.0253220179 -0.0697337237 -0.0231853459 -0.0046410373 -0.0737437692 -0.0032621144 -0.0101516977 -0.0795757311 -0.0164527337 -0.0432032578 -0.0007674352 0.0358645066 0.0064099553 0.0028305919 0.1068101348 -0.1027748414 -0.0159566512 -0.0116979766 -0.0887608174 -0.0345783731 0.0747717921 0.0309275065 0.0567050848 -0.0467003522 -0.0454731940 0.0661486167 -0.1071113266 0.0903107906 0.1022826429 -0.1098473122 0.1216073504 0.0399931902 0.0288291086 0.1645592750 0.0884876629 -0.0339164134 0.2039531959 0.0327438331 0.0810832814 0.0591733573 -0.0126865918 0.1112092442 0.1146259842 -0.0372701512 0.1513626202 0.0271190246 -0.0245355201 0.1388526103 0.0241124823 -0.0057667813 0.1017472166 -0.0460638145 -0.0368107798 0.0343933318 0.0224150948 0.0049277264 0.0313522429 -0.0616389983 -0.0316125808 0.0419852205 -0.0409116471 -0.1281255741 -0.0219281755 0.0022227998 -0.1624411562 -0.0863702279 -0.0993600527 -0.1904719430 0.0060389123 -0.0111060927 -0.0760064809 -0.0253115433 0.0608341056 -0.0888409958 -0.0026005121 -0.0524791979 -0.0953847931 -0.0325922968 -0.0209129570 0.0424793216 -0.0465101297 -0.0028466185 0.1876590126 -0.0399925242 -0.1097809043 0.0301900040 -0.1611939810 0.0599498420 0.0092688655 0.0645588006 -0.0426095327 -0.1933600084 0.0643063750 0.0581647790 0.1813375829 -0.0325661974 0.2266389257 0.0131152270 0.2506331339 0.1613901451 -0.0372236056 0.1331312669 -0.1083275819 -0.0017174873 0.0704981162 -0.1616225478 -0.0150519119 0.0695416012 0.0049331168 -0.0240455327 0.0042204431 0.0478115451 -0.0643991810 0.0729783090 0.0090249390 -0.0859674987 -0.0173621667 0.0014202912 0.0666456325 0.0399343339 -0.0494402666 -0.0132026145 -0.0992781651 -0.0376000715 -0.0982106379 -0.1361368875 -0.0856861009 0.0175111367 -0.1494652735 -0.0645044917 0.0449499386 -0.0835113200 -0.0781697232 0.0516649105 -0.0626325587 -0.0739611398 0.0443648700 -0.0728162340 -0.0427509243 0.0684585075 -0.0932909187 -0.0672110851 0.0750096661 -0.1612956596 0.0189837565 0.0922992817 -0.0405998412 -0.0016069491 0.0524588987 -0.0168077295 -0.0229321301 0.0378512625 -0.0817253750 0.0058677576 0.0904762233 -0.0216364832 0.0141312488 0.0912165987 0.0079044085 -0.0039826242 -0.0290112662 0.0376939549 0.0346268569 -0.0233380187 0.0926444206 -0.0334604298 -0.0762910635 0.0277875299 -0.0210895659 -0.0472488694 0.0284918001 -0.0220541414 -0.1017611162 0.0629615214 -0.0750031020 -0.0488069917 -0.0197471870 0.0293061361 0.0180244886 0.0232582451 0.0389809147 0.0675325246 0.0288478061 -0.0006008381 0.0346196541 0.0370581315 0.1058411123 -0.0039192300 -0.0007457764 0.0171322650 -0.0149538969 -0.0506547277 -0.0249580807 0.0092197876 -0.0954902948 0.0468818362 -0.0661023140 -0.0775354203 0.0150638302 0.0240332646 0.0043019180 0.0105058544 0.0157415289 -0.0252197999 0.0505984714 0.0010602113 0.0462151390 -0.0332658057 0.0762257117 0.0360812761 -0.1014016870 0.1143740295 0.0861989915 -0.0058616534 0.1423313504 -0.0101212791 -0.0261775460 -0.0352951586 0.0663018913 -0.0513256450 -0.1922368006 0.0611692079 0.0636708289 -0.0187802960 0.1938635670 -0.1044679515 0.0101490292 -0.0567156012 0.0475259200 0.2665149658 -0.0613864754 -0.1047171862 -0.2045581658 0.0898089530 -0.3191018563 0.0040888814 -0.2994454003 0.2411490385 -0.0092800603 0.0088159189 0.0288167043 -0.0133451856 -0.0213401793 -0.0293975516 -0.0166854636 -0.0361548543 -0.0560034001 0.0119790401 -0.0404861581 0.0321813031 -0.0718511460 0.1052735188 -0.1855557670 -0.0367585497 -0.1191587573 0.0353921950 0.1776922017 -0.0932596367 -0.1223251715 -0.0343185531 -0.0667554386 -0.1841205259 -0.1833247262 -0.0395333945 -0.2030813077 0.0327655232 -0.1727831265 0.0000600327 0.0054202225 0.0102384775 0.0454101383 -0.0522300849 0.1076990056 0.0728150560 0.1004587266 -0.0217824597 -0.0257592414 -0.0084224601 0.0090174434 -0.0361708785 -0.0036610749 0.0339892395 -0.0251611401 -0.0280487656 0.0020943212 -0.0272744557 0.0483622174 -0.0065634031 -0.0506268063 0.0579483466 -0.0099239475 -0.0541975288 0.0362562331 -0.0265040200 -0.0178758600 0.0793236195 0.0189446558 0.0250502456 0.0084210510 -0.0122795850 0.0368717791 0.0056656730 -0.0046637898 0.0206647275 -0.0201684488 -0.0495366675 0.0685679215 0.0028479825 0.0242313172 0.0940969390 0.0227479727 -0.0070892649 0.1107567390 -0.0011680804 0.0504739543 0.0277847022 -0.0309472226 0.0744089240 0.0675227690 -0.0394025453 0.1021170742 0.0027249228 -0.0565324837 0.1040434658 -0.0320651228 -0.0232733013 0.0340483361 0.0170050780 -0.0887306464 -0.0212395747 0.0129608663 -0.0455206398 -0.0653099362 0.0286311022 -0.1413529991 -0.0424653005 0.0153340347 -0.1092412728 -0.0150478867 0.0454586012 -0.1739917366 -0.1775301034 0.0086799977 -0.2432989076 0.1116282828 -0.0213083250 0.0931452150 0.0385601103 -0.0852957427 0.1678543759 0.2027037388 0.0158805015 0.2469615582 -0.0815793372 -0.0153119217 -0.0008574142 0.0355572897 -0.0175041460 -0.1169057495 0.0261921434 0.0517221460 0.0086836372 0.1227376330 -0.0975475585 0.0298235391 -0.0723384359 0.0590603488 0.2761182374 -0.0789007402 -0.0980176432 -0.1892600294 0.0774416169 -0.3188745049 0.0285488490 -0.3049319337 -0.1204365557 0.0151086279 -0.0019477078 0.0195600938 -0.0704591405 0.0396708907 0.0150601681 -0.0906944106 0.0644673425 0.0219712036 -0.0320919758 -0.0029930044 -0.0587763332 0.0257330236 -0.0544100145 0.0745030053 -0.0302944330 0.0221799187 -0.0143709406 -0.1364259892 0.0047492704 0.1004366216 0.0255491731 0.0241824381 0.1167177361 0.1078223236 0.0292782327 0.1678527330 -0.0166829444 0.0454153675 0.0663096615 0.0370443752 0.0104663657 0.0898998604 0.0192133859 0.0025613239 0.0526410619 0.0644467616 0.0398497473 0.0131939764 0.0333282073 -0.0346407739 -0.0422358862 0.0501358470 -0.0928248496 0.0620191405 0.0366672194 0.0007044663 -0.0381028237 0.1155540970 -0.0083556995 -0.1984842624 0.1617906266 -0.0833780290 -0.0418597815 0.0559301279 0.0062183444 0.0678613247 0.2593308793 -0.0069588566 0.0310554714 -0.0575287910 0.0620616525 0.1492824644 -0.0810943980 0.1346087436 -0.0484419428 -0.1861936811 0.0335729569 0.0470831023 -0.0310130709 0.0668913952 0.0625006938 -0.0378156142 0.0596447476 0.0274877398 -0.0197736834 0.0756494404 0.0583267311 -0.0180413254 0.0595236426 0.0787230581 0.0266042905 0.0717012913 0.0315248882 -0.0486745136 0.0941090431 0.0407000866 -0.0271814886 -0.0110656043 -0.0452654878 -0.0240692396 -0.0187225800 -0.1088715951 -0.0693237701 -0.0091243616 -0.0708457454 -0.0472094968 -0.0164648551 -0.0603028318 0.1282811699 -0.0026456226 -0.1637548483 0.2274691153 0.1994812184 0.0171717757 0.3162149365 -0.1429380629 -0.0517525025 -0.0778490860 -0.0474066511 -0.0065693411 -0.1522807703 -0.2282088263 -0.0952601328 -0.2320598833 0.0696170676 -0.0591814641 -0.0205571275 -0.0178457568 -0.0722769316 0.0178103742 -0.0100735332 -0.0886697694 -0.0190184396 -0.0387887132 -0.0078080161 -0.0238197842 0.0301990450 -0.0970806914 -0.1536095146 0.0352553863 -0.0076936639 0.1035766332 -0.0550895158 0.1223996801 -0.0274806152 0.1512730648 -0.0181494103 0.0188149235 -0.0507825301 0.0684021799 -0.0624385853 -0.0085432901 0.0807885158 -0.0588660974 -0.0072355008 -0.0021916451 -0.0200888819 -0.0297040785 -0.0347943356 -0.0088549374 0.0022037944 -0.0390002207 -0.0375491245 -0.0533016968 0.0245980536 -0.0344162732 -0.0669729897 0.0458095220 0.0055551390 0.0042899935 0.0199927690 0.0112177253 0.0346743320 0.0690143157 0.0000954009 -0.0327468041 0.0920088925 0.0318636702 0.0368013989 0.1562453293 -0.0323353686 0.0885408408 0.1276546853 0.1349237676 0.0502616036 -0.0025597645 0.0096178094 -0.0187490975 -0.0686854757 0.0313014171 -0.0440758826 0.0326617235 -0.0098862750 -0.0017909068 -0.0607673310 0.0904403514 0.0242892089 -0.4697174747 0.2925867581 0.0566840918 -0.0341539191 -0.2572186557 0.1513107196 0.2166419744 0.3403480985 -0.1490357459 0.0471859541 -0.0557609510 0.0539213170 0.2056411135 -0.1158989444 0.0771455933 -0.0596206838 -0.2008009359 0.0615792922 0.0602918165 0.0480021899 0.0349732906 0.0421038082 0.1589401109 -0.0206782931 0.1001298665 0.0797828160 0.1384333695 0.0243509122 -0.0438487330 -0.0711175616 -0.0399640699 -0.0569809288 -0.1162484118 0.1032095770 -0.0927970157 -0.1010295284 -0.0132191814 -0.0362031953 -0.0532734284 0.0063200791 0.0200877532 0.0141410566 0.0289843334 0.0024549680 0.0427926440 0.0178429000 0.0730885143 0.0265763913 0.0124358342 -0.0418002200 0.0141280479 0.0541060159 -0.0737530786 -0.0443145349 -0.0193277734 -0.0996473473 0.0532099260 0.0178847163 0.0138935070 0.0235228354 0.0095570119 0.0348986912 0.0787999334 0.0367225868 0.0591741795 -0.0071576286 0.0206415395 0.0066946606 -0.0008890814 0.0367764088 0.0143982317 -0.0056639425 0.0156782343 0.0042419267 -0.0126506245 0.0088100164 0.0034532794 -0.0071889861 0.0039003310 0.0079191900 -0.0054926306 0.0097713047 -0.0027163245 -0.0128496662 0.0050189228 0.0042638154 -0.0083421110 -0.0009199314 -0.0739807522 -0.0225142174 -0.0359583055 0.0174722374 -0.0488406191 0.0119213325 0.0371544930 -0.0586282443 -0.0168751691 0.0315973037 0.0270357466 -0.0034688299 0.0370194398 -0.0294157258 0.0322336313 0.0617200621 0.0611998099 -0.0522956995 0.0129182573 0.0633679412 -0.0458515692 0.0111262657 0.0100128270 -0.0236339597 0.0165466096 -0.0122904345 -0.0590426340 0.0111700735 0.0447772157 -0.0813207605 -0.0122602424 -0.0173307134 -0.1362231143 0.0417564370 -0.0564392711 -0.1091579904 -0.0938720683 -0.0282015621 -0.0011631657 0.0168798952 0.0089940190 0.0512372723 -0.0006136179 0.0015530072 -0.0407231766 0.0563811362 -0.0021511917 -0.0776321353 0.0481027070 0.0640991661 0.0313007213 0.0321692999 0.1568114614 -0.1308915126 0.0600631378 0.0140494577 -0.1626672079 -0.0443295216 0.0982415709 -0.0419492817 0.1618347045 -0.0328133357 -0.1753314116 0.1930954465 -0.0988243042 0.0511541557 0.2632440922 -0.0825635494 0.0011672854 0.1005249126 0.0118833628 -0.0255585911 0.2218562433 -0.0444336983 0.1279868158 0.0836267265 0.0788542024 -0.0764081330 -0.0307862815 -0.0239936332 -0.0709875195 0.0103683091 -0.0228399931 -0.0591942389 -0.0960256168 0.0005194174 -0.0321675082 -0.0737303334 -0.0905498091 -0.0005806284 -0.0476709516 0.0492174390 -0.0657058137 -0.1160699295 0.0794787257 0.0692661214 0.0224187992 0.0447049807 -0.0041390697 0.0028748216 0.1519717604 -0.0374769985 0.0225579804 0.1795718471 0.0408190483 0.0444772675 0.1373181955 0.0489302287 0.0168498027 0.1325354142 0.0781160817 0.0220391023 0.1748349580 0.1098912489 0.0393237323 0.1470924748 0.0563375913 0.0352715576 -0.0310705671 0.1827321173 0.1068622836 -0.0676000223 -0.0041375105 0.0202696738 -0.1290704810 -0.0180478378 -0.0011921573 -0.0537678534 -0.1801575988 -0.1104534927 -0.0289413710 -0.0053109277 0.0700688667 -0.2263907312 0.0833551596 0.0076466531 0.0819796639 0.0776927242 -0.0587645691 -0.1008176053 -0.0294296625 -0.0729411265 -0.0880298018 -0.0412577210 -0.0395500904 -0.1281129865 0.0166419362 -0.0216174314 -0.0368794718 0.0146020104 -0.0366846502 0.0345952584 -0.0695111790 -0.0426072827 -0.0845725912 0.0781485203 0.0142375419 -0.0985940143 0.0419341656 -0.0182376656 0.0026307368 0.0045898630 -0.0348278023 0.0383095895 0.0461906973 -0.0120199033 -0.0381420020 0.0956146543 -0.0042085768 0.0358675004 0.1569899137 -0.0642116083 0.0801318996 0.1279739629 0.0901958694 0.0484959152 0.0026934838 -0.0405264177 0.0006466727 -0.0734605296 -0.0235198614 0.0129696469 -0.0392644371 -0.0713160049 -0.0431157443 -0.0047589493 -0.0038265799 0.0050408249 0.0974922582 -0.0513879908 0.0052428274 -0.0231055854 0.0770046630 -0.0351052185 -0.0755073385 -0.0641514944 0.0542071875 -0.0121294230 0.0306545399 -0.0130476736 -0.0638261315 0.0492495018 -0.0228051935 0.0235560150 0.0696511329 -0.0315087005 0.0001487654 -0.0031996786 0.0051504461 0.0055302680 -0.0110000858 0.0058776267 0.0104062383 -0.0124051136 -0.0068040500 -0.0034060497 0.0012261539 0.0284843303 0.0189182546 0.0186328170 0.0435992679 -0.0238013219 -0.0043275568 0.0451666424 0.0150024687 -0.0090560496 0.0004040056 0.0017432315 -0.0277869816 -0.0125660181 -0.0276056762 -0.0285490386 -0.0272090389 0.0087757838 -0.0501406630 -0.0219704978 -0.0022316573 0.0243580498 0.0059270477 -0.0370961194 0.0471394107 0.0430020827 0.0289323026 0.0652413508 -0.0168051543 -0.0008779247 -0.0003079854 0.0000182784 0.0036098905 -0.0091358211 -0.0221989531 -0.0032789011 -0.0188183608 0.0155686857 -0.0008866559 0.0002041095 -0.0018359811 0.0009255114 -0.0003090243 -0.0024837238 0.0003604518 -0.0004131669 -0.0027126068 -0.0045481602 -0.0028968642 -0.0017272445 -0.0046411711 -0.0043728269 -0.0017938022 -0.0041659070 -0.0063588862 -0.0029022325 -0.0077160659 -0.0013799773 0.0002212861 0.0341971099 0.0093296782 -0.0136369178 0.0236845140 -0.0324273657 -0.0007323457 -0.0157307733 -0.0322489923 -0.0114645294 -0.0326384586 0.1695875044 -0.0546620383 0.0311416070 0.2020619151 -0.3528697249 -0.0196303926 0.4733333506 0.0651071809 -0.0390543753 0.0195428409 -0.0972347763 -0.0897124330 -0.0325286064 0.1741625272 -0.1328161623 0.0171797581 0.2385230277 -0.1613058063 -0.0150240033 0.2728643992 -0.0421126311 -0.1384328893 0.1548957558 -0.0629994165 -0.1240329882 0.1721879674 -0.0426797349 -0.1219096037 0.1626001885 0.0118959904 -0.0020474495 0.0115040017 0.1045821723 -0.0337126209 -0.2476908012 -0.0104082200 0.2191977719 0.0950154272 -0.0493715095 0.0266364679 0.0389143967 -0.1706053283 0.1228306741 0.1450863658 -0.0446828102 -0.1585655466 0.0982808874 0.0312583014 0.0560983588 -0.0705972141 -0.0201432639 0.0909166840 -0.0209412669 -0.0678699389 0.0930987882 -0.0661705250 0.0122343440 0.1319166854 -0.0292580683 -0.0092424191 0.0792193575 -0.0129673355 -0.0470335118 0.1795242634 -0.0478601795 0.0761534599 0.0718898789 0.0416161056 -0.0573304897 -0.0245097878 -0.0794462055 -0.1347989500 -0.0783560632 -0.1327755023 0.0354641864 -0.0322342215 -0.1399674813 -0.0228747876 -0.0155175512 0.0259155355 -0.0040086496 0.0434146783 0.0159287792 0.0853510935 0.0404834096 0.0678449480 -0.1158387988 0.0640285462 0.0645359896 -0.0005215321 0.0355337121 -0.1288143431 -0.0134454405 0.0349804793 -0.1388507679 -0.0372194261 0.0272111016 -0.1423662898 -0.0141253248 0.0144901820 -0.1287824375 -0.0547958459 0.0153717668 -0.1615639916 -0.0492430085 -0.0006611862 -0.1347087771 -0.0167897503 -0.0259537021 0.0253302377 -0.1511154539 -0.0999406315 0.0642937057 0.0608667706 -0.0156028641 0.1239039905 0.0518634949 -0.0024468228 0.0580255504 0.2846902898 0.1548707349 0.0223735713 0.0363806708 -0.1388410218 0.3013882023 -0.1251710554 -0.0035695648 -0.1292384428 0.0128724512 -0.1075574546 0.1107076031 0.0202861439 0.0399318641 0.0494212424 -0.0132965225 0.0532409338 0.0232540487 0.0228204957 -0.0037797338 -0.0571802635 0.0400703605 -0.0318831887 0.0227284710 -0.1121409074 0.0009387557 -0.1182160137 0.1199516799 0.0473237419 -0.1566648836 0.0444206436 -0.0300358119 0.0278663245 -0.0016966589 -0.0353165312 0.0769435190 0.0405267522 -0.0219606253 -0.0011640164 0.1033626251 -0.0267746991 0.0602132233 0.1754194970 -0.0967842625 0.1074846276 0.1368767141 0.0842315042 0.0791861137 -0.0020555404 -0.0474936154 0.0041534474 -0.0483072785 -0.0326327741 -0.0048588318 0.0149172400 -0.0686638906 0.0075414415 -0.0540400431 0.0350328898 0.0433969639 0.1832569224 -0.0807839225 0.0295239061 -0.1357635630 0.2412235213 -0.0895091660 -0.2279379928 -0.0796383144 0.2141833848 -0.0181445243 0.0650973514 0.0006457735 -0.1262175191 0.1081277906 -0.0097535707 0.0569042364 0.1264126134 -0.0730804680 0.0189209487 -0.0184102721 0.0465803286 0.0099785903 0.0149919594 0.0320332614 0.0773566581 -0.0387487322 0.0496241497 -0.0150156297 -0.0668997645 0.0444269751 0.0116355094 -0.0186320315 0.0604433010 -0.0356846068 -0.1047414695 0.0808004923 -0.0094866170 -0.0814107776 -0.0225432697 -0.0006012586 -0.0585389617 -0.0160136477 -0.0453814495 -0.0871493581 -0.0116124777 -0.0256381443 -0.0725474976 -0.0108801279 -0.0012820645 0.0977845563 -0.0343222504 -0.1303577574 0.1673837838 0.0623062644 0.0803773241 0.2189119150 -0.1098173901 0.0283766237 0.0330351852 -0.0612913112 0.0089487009 0.0192427507 -0.1154419364 0.0319955011 -0.0039430461 -0.0240603956 0.0354403791 -0.0107717195 0.0038609705 -0.0389968222 -0.0530371233 0.0253534678 0.0957497138 -0.0110088604 0.0554073491 0.0641094847 -0.0159012143 0.0313705150 0.2829209047 0.1287241804 -0.0020860570 0.0522587970 -0.1735831447 0.2536531694 -0.1281180743 -0.0064878241 -0.1349522242 -0.0180131274 -0.0715576407 -0.0340077020 0.0304671194 -0.0765385214 -0.0196482939 -0.0213535649 -0.0648532647 -0.0482221702 -0.0220991852 -0.0044685409 0.0629340613 -0.0471325515 0.0281291400 -0.0171689783 0.1336215875 -0.0225976977 0.1284293169 -0.1340596285 -0.0595346902 0.1788920057 -0.0427222644 0.0338904385 -0.0407039984 0.0011109241 0.0260632187 -0.0908973908 -0.0392124919 0.0287759366 -0.0247546554 -0.0894621786 0.0372989425 -0.0645372301 -0.1585416494 0.1039165273 -0.1057829276 -0.1104519975 -0.0706870883 -0.0958403532 0.0209766514 0.0510745110 0.0067928833 0.0814250893 0.0358258928 0.0345363329 0.0220056262 0.0617592318 0.0116637709 0.0023884804 -0.0024032992 -0.0000461279 -0.0375567714 0.0238723194 0.0204239224 0.0142623888 -0.0523634522 0.0252188331 0.0308306172 0.0092891313 -0.0376846866 -0.0028213992 0.0110246294 -0.0056344724 -0.0063093331 0.0101899643 -0.0110682519 -0.0009129548 0.0176119323 0.0008066206 -0.0070625451 0.0095344567 -0.0086227434 -0.0116948971 0.0134840494 -0.0076434217 -0.0019947878 0.0073860829 -0.0090970220 -0.0085776311 0.0041019517 -0.0109642232 -0.0168159122 -0.0056930118 -0.0163053943 0.0009038176 0.0100915819 -0.0206967623 0.0020250076 0.0043285248 0.0071316647 0.0062079802 -0.0003874799 -0.0026071540 0.0097651195 0.0071450272 -0.0076788223 0.0025097432 -0.0091801013 -0.0041136054 0.0035763722 -0.0040273501 -0.0038222210 0.0100821451 -0.0065344397 -0.0058233142 0.0003486376 -0.0088392348 -0.0003881768 -0.0075320720 -0.0040698645 0.0005658774 -0.0069189069 -0.0052363311 -0.0030215565 -0.0146459895 -0.0063435471 -0.0016599154 -0.0098642305 0.0005068329 0.0024386222 -0.0052276683 -0.0006620294 0.0007549204 -0.0136724208 0.0014728917 0.0020676705 -0.0150835440 0.0027634760 -0.0036289900 -0.0530658794 -0.0206026410 0.0023949896 -0.0129190820 0.0289007785 -0.0424536597 0.0172029707 0.0010267540 0.0237065665 0.0079003909 -0.0037890629 0.0143395587 0.0119991064 0.0021596248 0.0097169207 0.0050815790 0.0000256000 0.0104142466 0.0238469937 -0.0112940932 -0.0086633903 -0.0286020090 0.1322301707 -0.5020999059 0.4482808588 0.2159226223 0.2735605512 -0.2774436951 -0.3429569567 0.2416240668 -0.0464140209 -0.0451596490 -0.0538358852 -0.0774093210 -0.1491818714 -0.0511395831 -0.1059205791 0.0036542963 -0.1260664855 0.0433034123 0.0169619823 0.0158745905 0.0962026156 -0.0514286315 0.1357522964 0.1151227596 0.1388666292 -0.0015558006 0.0087162673 0.0064087368 0.0076784307 -0.0174285965 0.0147062981 0.0335076435 0.0156770330 -0.0216837101 0.0003607741 -0.0068504523 0.0061821771 0.0001440924 0.1850768860 -0.1250096691 -0.1118047384 -0.0617618466 0.2580795774 -0.1227838094 -0.1430683493 -0.0445551567 0.1876985238 0.0143631265 -0.0701166930 0.0368922311 0.0615538514 -0.0787413272 0.0638258065 -0.0156649356 -0.1198126409 0.0244584251 0.0227855038 -0.0318113244 0.0329079599 0.0414205512 -0.0505056753 0.0306608024 -0.0234827815 -0.0098217418 0.0424932234 0.0466714593 0.0051196482 0.0208600501 0.0769268447 0.0527020331 0.0402972934 0.0038480664 -0.0165268415 0.0632711930 -0.0030131346 0.0013335173 -0.0548025809 -0.0619646815 0.0939278888 0.1156271721 0.0647455214 -0.0392024216 0.3083938226 -0.1406454825 0.3205504266 0.2173336247 -0.0459673488 -0.0422841148 0.0000342334 0.0208722580 -0.0909429875 -0.0850834306 -0.1442996080 -0.1280297843 0.0274965017 0.0210341295 0.0060222224 -0.0174316428 0.0210380330 0.0270635399 0.0461723155 0.0536384034 0.0473894978 -0.0362303121 0.0268244702 0.0015335836 -0.0139364675 -0.0099122612 0.0232791636 0.0004500168 0.0349934307 -0.0020984831 -0.0178641193 0.0753923995 -0.0057555231 0.0345570127 0.3110587086 0.1356142389 -0.0036217334 0.0607747222 -0.1574303189 0.2796559783 -0.1170244499 0.0028888851 -0.1340081382 0.0076853139 0.0328221583 -0.0872178558 -0.1025807989 0.0506921860 -0.0722931556 0.0316912685 0.0938313117 -0.0844784805 0.0175426935 -0.0019003333 -0.0276285921 0.0163796058 0.0203776982 -0.1205410026 0.0567911933 0.0662008434 0.0163828835 -0.0100061243 -0.0613968330 -0.0145463098 0.0061945189 -0.0269657088 0.0026798513 -0.0154292767 -0.0484775493 0.0193032267 -0.0090101975 -0.0136569271 -0.0194707007 0.0326049577 -0.0103058357 0.0239724258 0.0516006783 -0.0339021631 0.0599146355 0.0425265286 0.0365682181 0.0369087882 -0.0032674734 -0.0148034468 -0.0012429900 -0.0620418488 -0.0065015691 -0.0155610062 -0.0554806540 -0.0162266443 -0.0396990127 0.0546945543 -0.0325587007 -0.0364435254 -0.2210810082 0.1270453563 0.0465352662 0.1593811830 -0.3311943397 0.1440531958 0.2559299563 0.0658584094 -0.2832185226 -0.0039121508 0.0126157896 -0.0295122903 0.0044718078 0.0057234764 -0.0374748687 -0.0107768931 0.0301108753 0.0159093849 -0.0194652171 0.0080356077 -0.0350753783 -0.0045477239 -0.0249399289 -0.0252504179 -0.0164130270 -0.0043618520 -0.0600777418 -0.0300129110 0.0228872012 0.0426407534 0.0169826767 0.0078615269 0.0771264900 -0.0616201451 0.0381475386 0.0542235497 -0.0240474042 0.0141362495 0.0252861200 -0.0333432077 -0.0546500787 -0.0015818843 -0.0895276798 -0.0447410858 -0.0409628545 0.0158053070 -0.0848315454 -0.0297941640 -0.0334948218 0.0216362397 0.0605675732 -0.1068276676 0.0705567236 0.1415138809 0.0398351538 0.1150285980 0.0064863550 0.0277972473 -0.0251384771 0.0226368625 0.1002827475 -0.0610418031 -0.0176305122 0.0305540995 -0.0881566274 0.0826535872 0.0301715040 0.0406833006 -0.0559405382 0.0656425067 0.1437550223 -0.0593924676 -0.0153628019 0.0222321966 -0.1509983016 0.0419421952 -0.0190315801 0.0187893388 0.3447789963 0.1366110692 -0.0319403244 0.0281318506 -0.2643325919 0.3178240053 -0.2507551268 0.0156986501 -0.1626018402 0.0224817502 0.0555780456 -0.0115442674 -0.0535408219 -0.0406968687 0.0050279225 -0.0507487764 -0.0651511452 0.0378446681 0.0017873137 -0.0015920216 0.0030646274 -0.0000469817 0.0016935048 -0.0065055113 0.0147183553 -0.0004126873 0.0096372181 -0.0075042305 -0.0079216523 0.0122073029 -0.0003692656 0.0006030541 -0.0036904308 -0.0021623428 -0.0029243205 -0.0031993189 -0.0000836838 0.0011006812 -0.0063327425 0.0007090033 -0.0007339016 -0.0034669837 -0.0152332715 0.0129755044 -0.0078541595 -0.0028971076 -0.0218855396 -0.0101358379 0.0169468876 -0.0042380359 0.0130743142 -0.0191757636 0.0013360194 -0.0089202372 0.0140016711 -0.0046727349 0.0099878063 -0.0298908665 0.0209760799 0.0117733976 0.1546396788 -0.0945841549 -0.0673641670 -0.0953313119 0.2406541429 -0.1109738780 -0.1624697086 -0.0369539115 0.1845451173 0.0070544337 -0.0292518863 0.0223762625 0.0529855361 -0.0492991910 0.0238173414 -0.0232898036 -0.0738194658 0.0192399321 0.0116272505 0.0315137510 0.0089538489 0.0022873431 0.0914636355 -0.0216029764 0.0164225836 0.0576306277 0.0711351234 0.0134241023 0.0034056684 -0.0683419271 -0.0548919560 -0.0234540356 -0.1157500371 0.0722662361 0.0061511490 -0.1094239208 0.0163494238 0.0148851258 -0.0020493876 0.0525706029 0.0153554223 -0.0276489114 0.0385384131 0.0652682866 -0.0821593384 0.0936240064 -0.0331363632 -0.0589327989 0.0392007924 -0.0349198844 0.0339204949 0.0917532323 -0.0259984092 0.1009332658 0.0518164992 -0.0085200835 0.0152984452 -0.0051420929 -0.1086589764 0.0306634370 0.1532827864 -0.1954844026 -0.0899363632 -0.1175390901 -0.2579375618 0.1016134484 -0.0360845915 0.1015787585 -0.0681697360 0.0785670837 0.2961102377 -0.0911157879 -0.1754294734 0.0762193973 -0.2644207228 -0.0935184779 0.0002786924 0.0102353106 0.1038434560 0.0817720265 -0.0237299555 -0.0947990864 -0.2533012779 0.1885115897 -0.3719184774 0.0594327966 -0.0708907365 -0.0173466778 -0.0333525935 0.0432317553 0.0514512263 0.0334042296 0.0159141161 0.0307463962 0.0288991636 0.0131253663 0.0004161688 0.0005725862 -0.0032505138 0.0025356557 -0.0009735853 -0.0020852521 -0.0054016154 0.0035867136 -0.0049792736 0.0047305136 0.0020998971 -0.0080190220 0.0003700319 -0.0026348504 0.0025969649 0.0009378838 -0.0010305733 0.0027409898 -0.0008417576 -0.0022284811 0.0036316367 0.0010959573 0.0003938279 0.0039327560 0.0185901061 -0.0152480906 0.0109954056 0.0061884809 0.0247575474 0.0105629801 -0.0163631279 0.0029220188 -0.0110259382 0.0163194816 -0.0015966842 0.0107475591 -0.0051009479 -0.0006105485 -0.0037574130 0.0061162039 0.0014480038 -0.0326560404 0.1743132533 -0.1301994757 -0.1758553266 -0.0228402029 0.2583640383 -0.1347429243 -0.1076211008 -0.0340515459 0.1338067539 0.0134017359 -0.0928329541 0.0279411683 0.1723600263 -0.1602746104 0.0344936129 -0.0874844187 -0.2038605308 0.0801366472 0.0257743971 0.0751224495 0.0027757279 0.0514644145 0.2023231313 -0.0952257609 0.0653839271 0.1341130431 0.1662935655 -0.0189308246 0.0064904865 -0.0374795463 -0.0497801941 -0.0530418244 -0.0567285013 0.0256920067 -0.0003346121 -0.0649163362 -0.0596694325 0.0298791324 0.0291627657 -0.0366557453 -0.0295558371 -0.1256451295 -0.1703197751 0.1321097067 -0.3501028506 0.1306899822 -0.2310814282 -0.2523958021 -0.0179263530 0.0591302760 0.0479541384 -0.0858640041 0.0925728124 0.0891497652 0.0799676401 0.1239464655 0.0363802892 0.0213851864 0.0546740416 0.0371114003 -0.0352769782 0.0834616662 0.0765023750 0.1116506162 0.1068141836 0.0434168856 0.0515993879 -0.0421116930 -0.0027227976 0.0447721815 -0.0807885881 -0.0035303446 0.0912573908 -0.0408388974 0.0348574028 0.0879207247 -0.0178647748 -0.0166229431 0.0965154412 -0.0196558194 -0.0191617424 0.0824315313 0.0434043181 -0.0021665450 0.1446043160 -0.0377534227 -0.0278500076 -0.0078179177 -0.0323794060 0.0780096984 -0.1251903989 0.0281498569 -0.0005792714 -0.0773190900 -0.0309842846 0.0835583092 0.0220041545 -0.0054886248 -0.0255319206 0.0338641801 -0.0034980514 -0.0624269071 0.0146563785 0.0379785005 -0.0124976780 0.0279148600 -0.0201945985 -0.0374986752 0.0108744319 -0.0272086638 0.0036328039 -0.0046139376 -0.0381810771 0.0160272646 0.0041471868 -0.0197791349 -0.0109604643 0.0132468560 -0.0108484046 0.0135269004 -0.0227287190 0.0159921866 0.0185142959 -0.0021836936 -0.0419380664 0.0146607878 0.0316724146 -0.0044684785 0.0276943176 -0.0548223937 0.0093555422 -0.0095401780 0.0034084204 -0.0111123734 0.0040694662 -0.0556709510 0.0301298222 0.0968312569 -0.1212017198 0.1162736978 0.2458541179 -0.1465015848 -0.1349209138 0.0675441310 -0.0362888070 0.0518392539 0.0930013564 0.0437191321 0.0723247942 -0.0006661558 -0.1381031153 0.1609047594 0.0144377789 0.1555293257 0.1656601239 -0.1095828108 -0.0010705072 -0.1626830660 0.0059154489 -0.0806942498 -0.4019508038 0.2133366801 -0.1374176138 -0.2465808523 -0.2945789251 0.0923624230 -0.0323760997 -0.0117246743 0.0574447889 -0.0279363333 -0.0364260068 0.0852736899 0.0082764290 -0.0280104925 0.0334890578 0.0100282210 -0.0009453800 -0.0107656042 0.0544695316 -0.0951223670 -0.0751868702 0.1745972345 -0.2442198719 0.1169781017 -0.0681708944 -0.1814048806 0.0060751943 0.0089399266 0.0323835424 0.0525895693 -0.0026112656 0.0360137643 0.0234799534 -0.0024336224 0.0519832208 0.0043287694 -0.0035302585 0.0350629232 0.0102378651 -0.0026514569 0.0418075493 0.0318898560 0.0024151294 0.0465543652 0.0141891953 -0.0035805953 -0.0187951414 0.0452600421 0.0298875912 -0.0265064749 -0.0077406644 -0.0079434367 -0.0510504903 0.0301676828 -0.0083610928 -0.0079733644 0.0743871978 0.0019046945 -0.0167473995 0.0260711234 -0.0151663665 0.0366911792 0.0144396690 -0.0092877747 -0.0274871937 -0.0553554120 -0.0201428841 0.0158940714 -0.0711548734 0.0799157951 -0.0269450683 -0.0180204553 0.0795408989 -0.0133221877 0.0415606105 -0.0090778887 -0.0594569898 0.0782314149 -0.0201164549 -0.1011203895 -0.0179692924 0.0749041126 -0.0557064800 0.0854781665 -0.0103592268 -0.1129417999 0.0204899912 -0.0566132637 0.0117401252 0.0205104504 -0.0502324614 0.0125673741 0.0154019931 -0.0516467540 0.0072503119 -0.0176430240 -0.0082518323 0.0184947968 -0.0591021713 0.0227348940 0.0267925655 -0.0543441904 -0.0328896436 0.0468350519 -0.0097423237 0.0280223794 0.0052128201 -0.0316048510 0.0315225870 0.0204874454 -0.0533155183 0.0230188522 -0.0285960326 -0.0272280085 0.0152572205 0.0412293982 -0.0120867946 0.0259895598 0.0884235524 -0.0856747060 -0.0051013658 -0.0033370259 -0.0517977973 0.0107991433 0.0831514042 0.0278779374 0.0182080181 0.0016255835 -0.0032853990 0.0343612296 0.0063470598 0.0455535206 0.0282967376 -0.0242442244 -0.0018609128 -0.0413889793 -0.0128158765 -0.0426032182 -0.1243663303 0.0687810877 -0.0629386264 -0.0663436487 -0.1197998159 0.0371802046 0.0029966274 -0.0433585631 -0.0129490380 -0.0257784769 -0.0774505280 0.0666085235 0.0325124035 -0.0791387909 0.0177415095 0.0216839806 0.0072769466 -0.0255918883 0.0324796709 -0.0376246051 -0.0542554873 0.0860091495 -0.1044021906 0.0323051752 -0.0268251950 -0.0781251296 -0.0187550003 -0.0011322871 0.0256274215 0.0155837222 -0.0163618558 0.0096615716 -0.0173724472 -0.0233177117 0.0469139277 -0.0085368136 0.0054693754 0.0251641409 -0.0224691342 0.0210335628 0.0576536867 0.0343084842 0.0370389191 0.0217290703 0.0010834030 -0.0156196781 -0.0171888949 0.0151604729 0.0039267141 -0.0202210075 -0.0086124617 -0.0172588607 -0.0309667793 0.0375625697 -0.0069059422 -0.0051554877 0.0845156830 0.0021605038 -0.0150045311 0.0310953453 0.0115289825 0.0465094305 0.0440517974 -0.0157046172 -0.0291596411 -0.0086923178 0.0019653685 0.0192392595 -0.0321967308 0.0386872261 -0.0065845029 0.0700040369 0.0309433898 0.0347959546 -0.1283189627 0.0332688910 0.1717073996 -0.2596119985 0.0839744336 0.2749072902 0.0685458615 -0.2118991831 0.1721576302 -0.2742187560 0.0043923856 0.3378820329 -0.0523284259 0.1739634241 -0.0303732324 -0.0922618527 0.1131952969 -0.0019303167 -0.0565049145 0.1771767158 -0.0551402072 0.1213386381 0.0134339643 -0.0295469352 0.2731508339 -0.1120573865 -0.0228285109 0.2503761158 0.1383983844 -0.1115737261 0.0539645420 -0.1289890329 -0.0072054495 0.0044781164 -0.1279806168 -0.1118120862 0.0692607691 -0.1186801734 0.0079910217 0.0123277740 -0.0084952195 -0.0279620438 -0.0099940825 -0.0134601339 -0.0674558229 0.0602597203 0.0011030089 0.0103948965 0.0411465318 0.0028494567 -0.0663556159 -0.0282591668 -0.0129706097 0.0037407852 -0.0574365370 0.0017362548 0.0058746853 -0.0097821818 0.0030970870 -0.0109725262 0.0066452708 -0.0035086989 0.0304741214 0.0408189923 0.0271786261 -0.0136796989 0.0289698359 0.0093611917 0.0799128638 -0.0006683492 -0.0083154666 0.0408908929 0.0328388589 0.0309051673 0.0636788645 -0.0215683754 -0.0503519958 0.0785181839 -0.0177733492 -0.0040973836 -0.0129514140 -0.0362358306 0.0061631094 -0.0265875853 -0.0676627919 0.0477836558 -0.0804070262 0.0173485314 -0.0432935323 -0.0621915504 -0.0393444912 -0.0105726963 0.0341940938 -0.0012065198 -0.0294792716 0.0061350898 -0.0315164826 -0.0459241184 0.0705495091 -0.0388041116 0.0103123717 0.0335522652 -0.0881693677 0.0483698392 0.0995906245 0.0415472789 0.0846319840 0.0128900360 -0.0279124414 -0.0333279871 -0.0403225001 -0.0020827980 0.0106469338 -0.0447780328 -0.0499413738 -0.0358561747 -0.0695611564 0.0610893329 -0.0086533379 -0.0099432346 0.1529141269 -0.0028057932 -0.0305390470 0.0468863081 0.0524947344 0.0935998688 0.0944583468 -0.0303624128 -0.0510673682 -0.0035889309 -0.0199916645 0.0196602369 -0.0084102242 0.0135849937 0.0076084347 -0.2066986281 0.0373460479 -0.0838147593 -0.0017145877 0.0009054000 -0.0141797975 -0.0216223461 0.0090671592 -0.0016225658 -0.0322892016 0.0005719792 -0.0291959316 0.0208783156 -0.0147446860 -0.0467900210 0.0268785386 0.0114245505 0.0137872248 0.0209353799 0.0088454818 0.0197657031 0.0320235857 0.0094812861 -0.0003034407 0.0367520481 0.0559811788 0.0399120420 0.3028027235 -0.1827218417 0.1520744758 0.1095562172 0.4534924412 0.1635570067 -0.2134692602 0.0394563573 -0.1778390313 0.2013566678 -0.0452982552 0.0651718779 -0.3803990556 0.0760589432 -0.2864867991 -0.0346381780 0.0242954407 0.0490942371 0.0350761481 0.0088306327 0.0942446221 -0.1399309250 0.0553652567 -0.0517711032 -0.1051869145 0.0040382147 0.1583757729 0.0527599108 0.0133223836 -0.0038110640 0.1116025405 -0.0167529363 -0.0085975828 0.0030465691 -0.0375670843 0.0263218915 -0.0171703155 0.0266204120 -0.0646355248 -0.0885846115 0.0007070523 0.0041136401 -0.0571780671 0.0132290704 -0.1274521930 0.0120572940 0.0304746244 -0.1354458145 -0.1419580033 -0.1019743461 -0.2379549176 0.1358346742 0.1284077437 -0.2730615480 0.0653348943 0.0231298242 0.0290563950 -0.0596201093 -0.0592098237 0.0478364835 -0.1110051418 -0.1244864060 0.0825387589 -0.1034262700 -0.0849368056 0.0560968788 -0.0976670508 -0.0403174087 0.0555044057 -0.0621004664 -0.0702135417 -0.0034625541 -0.0864354840 -0.1009634899 0.1158533509 -0.0954947409 0.0199834841 0.0523465744 -0.1953803957 0.1054523791 0.2092025263 0.0630783550 0.1872679947 -0.0081846298 -0.0850851458 -0.0747882045 -0.0783403039 -0.0480495218 0.0044086647 -0.0833076535 -0.1246466177 -0.0771573262 -0.1236273924 0.1069290378 -0.0134614814 -0.0163516578 0.2908004199 -0.0062689286 -0.0581203991 0.0762448679 0.1340850212 0.1927464944 0.1983700176 -0.0642202987 -0.0983158537 0.0198246076 0.0778256467 -0.0082302323 0.1596117104 -0.0823742994 0.0669032837 0.1048074044 -0.0826010025 0.0548205322 0.0125925371 -0.0038328128 -0.0150458829 0.0367395441 -0.0159014598 -0.0232936920 -0.0062421645 0.0211180686 -0.0148638086 0.0269930573 0.0100817457 -0.0278152672 -0.0033888887 -0.0208525787 -0.0002581848 0.0188534233 0.0021516320 -0.0166748196 0.0014498028 -0.0264085037 0.0176256477 -0.0364150807 -0.0029811262 -0.0076081734 -0.0815716825 0.0366650960 -0.0210301206 -0.0524909087 -0.0592948979 -0.0177191222 0.0024291418 0.0247244804 0.0157286837 0.0056456440 0.0330035091 0.0180701830 0.1085835887 0.0086013420 0.0869955705 -0.0265112616 0.0331984719 0.0878027033 0.0089085712 0.0523800806 0.1822488542 -0.2349410678 0.0137841376 -0.0876257570 -0.1044993871 0.0689338677 0.2886729223 0.1480075018 -0.0240566131 -0.0046141804 0.2994410731 -0.0907237944 -0.0006747990 0.0191271445 -0.1505339761 0.0851988315 -0.0093680586 -0.0065593941 -0.1289457938 -0.1190377568 -0.1154748425 0.0196532603 -0.0783918565 -0.0535381670 -0.2893272094 -0.0345002042 0.0164238874 -0.0632096626 -0.0143566251 -0.1281161956 -0.0408697249 -0.0522979403 0.1073124843 -0.0952360342 -0.0625753399 0.0302957196 0.0343283616 -0.0164744546 -0.0992457187 0.0416816016 0.0182466434 -0.1461682465 0.1063638797 -0.0573197884 -0.0191769816 0.0819497787 -0.0058880135 0.0025741445 -0.0288841385 -0.1509331767 0.0594779712 0.0181181021 0.0178854420 0.0990047430 -0.1077222853 0.0756116084 0.0021090144 -0.0515672681 0.1473958473 -0.0462752875 -0.1240279228 -0.0176088223 -0.0993651633 -0.0134135984 0.0778060678 0.0435997362 0.0671492445 0.0086515548 -0.0617505357 0.0813434122 0.1475513488 0.0499119233 0.1492887844 -0.0567372199 0.0079676020 0.0167615030 -0.1956830398 0.0141322036 0.0490396008 -0.0339430068 -0.1014934530 -0.1362365628 -0.1238560186 0.0422009596 0.0660657945 0.0294103680 0.0691237256 0.0084039777 -0.0949095037 -0.0596313655 0.0140299979 -0.1589164120 -0.1080905117 0.0539465861 0.0027442941 -0.0010706598 -0.0058059330 -0.0013064292 0.0011656059 -0.0058535029 -0.0089281169 0.0038485071 -0.0095127241 0.0114957118 -0.0067806414 -0.0180855769 0.0094063738 0.0006602563 0.0044746444 0.0053006485 -0.0007908268 0.0081487097 0.0118991594 -0.0003954369 0.0002088436 0.0056197447 0.0160515842 0.0102610600 0.0769757860 -0.0473389417 0.0399691973 0.0191481537 0.1251041646 0.0518975081 -0.0567206295 0.0104082843 -0.0466650392 0.0474685032 -0.0162722470 0.0152475349 -0.1304070862 0.0247243864 -0.0954172264 0.0168732865 0.0085071452 0.0527851494 0.0003085510 0.0469491745 0.1338505051 -0.1127113569 -0.0503567902 -0.0425462173 -0.0136907054 0.0552488938 0.1716371761 0.1020583537 -0.0176607466 -0.0096003709 0.2712218016 -0.0937206725 -0.0075552400 -0.0339505703 -0.1269637840 0.1276784107 -0.0304246081 0.0272726785 -0.1209355165 -0.0762232569 -0.0225293455 -0.0557820907 -0.0250967484 -0.0053775673 -0.1854708426 -0.0937377829 0.0335535790 0.0930264809 0.2807969488 0.1945856976 0.3490600662 -0.4220077544 -0.0111612367 0.3539722694 -0.0478307944 -0.0205019500 -0.0425579313 0.0606734652 0.0468862898 -0.0088682208 0.0797886627 0.0442192630 0.0042168564 0.0474658953 0.0661634653 0.0020763211 0.0467259373 0.0193361117 0.0031960111 0.1003261958 0.0104070782 0.0213092751 0.0668391011 0.0032018286 0.0295595134 -0.0562028559 0.0019849963 0.0253731089 -0.1309942858 0.0379266758 0.0618269077 -0.0062814282 0.0744792145 -0.0120440531 -0.0697446477 -0.0276707973 -0.0462793233 -0.0133594964 0.0553308734 -0.0582943853 -0.1260234767 -0.0333824554 -0.1145937771 0.0203004384 -0.0018877102 -0.0122597595 0.1133642610 -0.0137177077 -0.0342845978 0.0043588170 0.0840810138 0.0877377881 0.0783558308 -0.0269579396 -0.0396772622 0.0027115292 -0.0869450464 0.0159446058 0.0406573290 0.0266600154 -0.0224567668 0.0625924913 0.0378040244 -0.0316083047 -0.0014510989 0.0005437694 0.0022171520 -0.0029835312 0.0013908431 0.0024914963 0.0003690698 -0.0009682596 0.0025426729 -0.0028174127 -0.0002534774 0.0036202652 -0.0011375858 -0.0001926609 0.0018810382 -0.0045350145 -0.0018477546 0.0049426755 -0.0041516691 0.0014021839 0.0028864113 0.0009454050 -0.0065502745 -0.0017503947 -0.0173943442 0.0107271848 -0.0128168613 -0.0067547266 -0.0360207680 -0.0085966436 0.0146402981 -0.0033058899 0.0058468883 -0.0125498470 0.0031295338 -0.0039784737 0.0214062208 -0.0060377852 0.0110505831 -0.0089280520 -0.0002128755 -0.0094460924 -0.0125181885 -0.0060383501 -0.0290727258 -0.0019268244 0.0121697037 -0.0069099038 -0.0010313260 0.0041393607 -0.0158596722 0.0022125281 -0.0105944757 0.0000297789 -0.0659485521 0.0217355424 0.0018285228 0.0527022680 0.0220085184 -0.0641684975 0.0343462957 -0.0457021398 0.0439785000 0.0348948462 -0.0452654642 0.0430543373 0.0398480040 -0.0503823469 0.0366630869 0.0017467426 -0.0586686484 -0.0130911998 -0.1553261454 -0.2162328469 -0.1146044008 0.1597458944 -0.0456787603 -0.1346386798 -0.0854178415 0.0251802426 0.0350759633 0.1665921069 -0.0602125082 0.0429236054 0.3248774643 -0.1212031373 0.1881882419 0.0626231302 0.1482728039 0.1490471191 0.1446842176 0.0479991460 -0.0233787979 -0.0068404400 0.1607614671 0.1827097169 0.3331004795 0.2358026817 -0.1012006162 -0.0700422496 0.0209238721 0.0143456689 -0.2200026989 0.0869395271 0.0763827974 -0.0241396921 0.1576412479 -0.0861611354 -0.1147684804 -0.0390400161 -0.0537241578 -0.0311412148 0.0777716251 -0.0724600177 -0.1941141410 -0.0485126537 -0.1548320962 -0.0023213870 0.0046389441 -0.0170908096 0.1144842279 -0.0221985466 -0.0448352971 -0.0246922664 0.1524773594 0.1022343334 0.1084847983 -0.0363548768 -0.0452546786 0.0265778309 0.0725737432 -0.0053443169 -0.1291460388 0.0050668482 -0.0061889605 -0.1993090822 -0.0520073953 0.0395227955 0.0006459530 -0.0005276563 0.0001671167 -0.0037254981 0.0020637609 -0.0000727315 0.0007267570 -0.0022809643 -0.0002434251 0.0003244180 -0.0044167086 -0.0005450654 0.0030293853 0.0021623166 -0.0003535715 -0.0071479689 -0.0075282826 0.0069282904 0.0019133578 0.0040348389 -0.0074454541 0.0060124904 -0.0014037428 0.0009307247 0.0113928737 -0.0035508359 -0.0042186605 -0.0014198371 -0.0053346630 0.0068379217 0.0058326320 -0.0066963067 0.0040704951 -0.0078070691 -0.0114130983 -0.0031618928 -0.0517211997 0.0046384293 -0.0331533318 -0.0024403410 -0.0048285008 -0.0099292516 0.0251872559 -0.0208089633 -0.0190430773 0.0753013078 0.0081077670 0.0541436847 -0.0022005000 -0.0590180243 -0.0863829485 -0.0597117208 0.0253896561 0.0134886874 -0.0017774001 -0.0030161523 0.0071438868 -0.0885852712 -0.0018562076 0.0352536581 -0.0267083456 0.0717358493 -0.0034961321 0.0170634654 -0.1502198960 0.1023516340 -0.2695385308 0.0961366147 -0.1541196939 0.1658656165 0.2095916090 -0.0237827002 0.1854984522 0.3470815952 -0.0201426002 0.1119521591 0.2106439913 0.0149140275 0.1130307392 0.0446133169 -0.0379666751 0.0195818505 -0.1256416138 0.0031229458 0.1112310299 -0.3445802434 0.2692105739 -0.0832905719 0.2078784865 0.1484172329 0.0050643445 -0.0182501209 -0.0017186370 -0.1586312560 0.0774096535 0.1429111118 0.1431438301 0.1465791039 -0.0857824077 -0.0045571293 0.0092130535 0.0090834385 -0.0223802541 0.0408288929 0.0873243906 0.0138775995 0.0779650097 -0.0430650626 -0.0074596403 -0.0046062065 0.0003882334 0.0008705944 0.0032201850 -0.0018795620 -0.0122286179 -0.0061601742 -0.0081766455 -0.0031110925 0.0018259363 -0.0028046907 0.0018901087 0.0014755323 -0.0032904559 -0.0047980766 0.0203788018 -0.0002419757 0.0142780254 -0.0042750980 -0.0062861886 -0.0885161522 -0.1353311004 0.1119982048 -0.0716533175 -0.0724688800 -0.1262520968 0.0148935350 -0.1664277321 0.0168976127 -0.0040425543 0.0030700445 0.0030877674 -0.0068530887 0.0055594132 0.0000154282 -0.0065681524 0.0071889888 0.0036431950 -0.0027526420 -0.0008428444 0.0000211930 -0.0017795604 -0.0016814422 0.0055275293 -0.0096008507 -0.0132464433 0.0100727552 -0.0087931940 0.0036394894 -0.0011393382 0.0005457658 -0.0017353660 0.0013598168 -0.0105999111 0.0097111769 -0.0052007811 -0.0098293808 -0.0108325463 0.0083531913 0.0042858779 0.0022709457 -0.0163314247 -0.0025919182 0.0002953004 0.0031443970 -0.0819099673 0.0115204563 -0.0759918708 -0.0000449730 0.0014886979 0.0030691588 -0.0031709905 -0.0021553109 -0.0103729097 0.0052149291 0.0106906288 0.0050078430 0.0045895027 0.0064658016 0.0020891710 -0.0038261776 -0.0037951974 0.0053484618 -0.0071735916 -0.0039533579 -0.0017166883 -0.0069883209 -0.0034821510 0.0130482789 -0.0038843015 0.0095661638 -0.0077590138 -0.0040284598 -0.0091021038 0.0037416846 -0.0378610123 0.0177062159 -0.0181535757 0.0198949986 0.0188554508 -0.0119857970 0.0534933687 0.0648060869 0.0092978998 -0.0103939744 -0.0113448723 0.0264246068 0.0124331345 -0.0099822697 -0.0197848660 0.0018368458 -0.0023316201 0.0015677299 0.0231944113 0.0103388734 0.0017941018 -0.0087520904 -0.0188685266 0.0008136281 0.0053602788 -0.0013914874 -0.0021292068 -0.0133732792 0.0115064608 0.0204470972 0.0179687162 0.0195376505 -0.0143376407 0.0002371817 -0.0008506994 0.0022175338 -0.0050723455 0.0041824921 0.0119068725 0.0012335905 0.0091375225 -0.0064895475 -0.0001541122 -0.0005258402 0.0007113555 0.0032029658 0.0049941968 -0.0000460346 -0.0040965754 -0.0010875601 -0.0045041197 -0.0005290757 0.0002494281 -0.0002727162 -0.0006514673 0.0018868527 0.0000184011 -0.0006032234 0.0018350095 -0.0011069211 0.0009646769 -0.0006433846 -0.0021352963 -0.0074535621 -0.0128193487 -0.0149920561 -0.0050676399 0.0108980075 0.0125151271 -0.2775567903 0.0328835660 -0.0969980522 0.0853678997 -0.0683475537 -0.0712935696 0.1163575274 -0.0828503936 -0.0845628233 0.0800667661 -0.0583832473 -0.0725467872 0.1034687829 -0.0486960867 -0.0860006621 0.0315245736 0.0532638998 -0.0886329742 0.1525970834 0.1105800748 -0.2049297371 0.1567102302 -0.0100232442 -0.1283077483 -0.1243946942 0.1661954394 0.0440951031 0.1184674409 -0.0448147328 0.1223152197 0.0288615134 0.3662805889 -0.0159744345 -0.1269805536 -0.0354585096 0.2934450800 0.0491013427 -0.1206248265 -0.1076174706 0.1409858795 0.0992640980 0.5588544213 0.0128429200 0.0046458833 0.0150843162 -0.0643013337 0.0213866443 -0.0370866825 -0.0395989788 0.0170299435 -0.0341177876 0.0450261870 0.1036258580 0.0898969224 0.0118901963 -0.0236715338 0.0059967398 -0.1462899925 0.0430659128 -0.0070851437 0.1166003955 0.1184032586 -0.0052562288 -0.0219091528 -0.0335815441 -0.0252899872 -0.0236926417 0.1803379271 -0.1553032517 0.1126792275 0.0133446469 0.1903134089 -0.0324581522 -0.0267900881 -0.0180722272 0.0540718786 0.0368704615 0.0400574829 -0.1515450102 0.0731595812 0.0154477469 0.0829620800 -0.0042280934 0.0258157009 -0.0360622565 0.0117682501 -0.0325668122 0.0372572036 -0.0068363935 0.0246559509 -0.0837003547 0.0706105040 0.0046901199 -0.0114447438 -0.0352003502 -0.0430991111 -0.0785168157 0.0884365791 0.2508927836 0.0181785772 0.2115934613 -0.2620704706 0.0171910218 -0.0658215837 0.0057527200 -0.1306916441 0.0901637674 0.3279381752 0.1027982761 0.2455774660 -0.2316320866 0.0380862271 -0.0199742201 0.0540678335 0.1066332455 0.2833715862 0.0560659003 -0.1226009457 -0.0620099707 -0.2159643761 -0.0004323883 0.0091999295 0.0209616077 -0.1415652363 0.2133995703 0.0749641966 0.0180460510 -0.0377473901 -0.1324640343 -0.0159276646 -0.0312201203 -0.1392952126 -0.0169408147 0.0182097806 0.0046865776 -0.0082088618 0.0153818640 -0.0025170368 0.0971911931 0.0140256730 0.0312138952 -0.0015511961 0.0003219736 0.0007984981 0.0111701212 -0.0060225879 -0.0023298383 -0.0031633174 0.0090619464 0.0033699539 0.0004048373 0.0113604369 0.0021581753 -0.0030635539 -0.0033111744 0.0005060355 0.0120057690 0.0247996988 -0.0071456022 0.0136660191 -0.0171880325 0.0233987975 -0.0065854797 0.0021936052 -0.0032396438 0.0072701448 -0.0145393606 0.0251790657 0.0077542085 0.0350538016 -0.0016592842 0.0006924688 0.0002384667 -0.0047164599 0.0006312445 -0.0001074190 0.0006935164 0.0002042244 -0.0061990882 -0.0080529013 0.0004946258 0.0158333432 0.0074330681 0.1421399284 0.0106796374 0.1687465351 0.0495026270 -0.0446377205 0.0690454340 -0.0784845314 -0.1583294481 -0.0849160439 -0.0409549939 0.0588873997 -0.0161440894 0.3093280689 -0.0716083160 0.0622846756 -0.2766821717 -0.1920775875 0.1196107583 -0.0422084661 0.0384063356 -0.0484047596 -0.0426933988 0.1102092281 -0.0909254615 0.1285857919 -0.0089888581 -0.0139927556 -0.0137802528 -0.0569055992 0.0339515937 -0.0766931870 -0.0728483412 -0.0117338813 0.0158964858 0.1340117168 -0.0885164572 0.2085077411 -0.1060194532 0.0966972516 0.0313547317 0.0102736990 0.0379060536 0.0159048606 0.1377990888 -0.0963126915 0.1137417720 -0.0947358192 -0.0248179995 0.0372698198 0.0099716881 0.0105892519 0.0213103582 0.0048612577 -0.0139911634 0.0394015895 -0.0016419569 0.0229415682 0.0031133268 0.0180843186 -0.0213849484 0.0211607383 -0.0036477725 -0.0690996491 -0.0153720487 -0.0211884994 0.0036066509 -0.0306514260 -0.0038245154 -0.0210186003 -0.0540955654 -0.0720628343 -0.0191250268 0.0054421915 0.0061273632 0.0418664262 -0.0110543309 0.0029428167 -0.0017732057 0.0458464227 -0.0499890817 -0.0199229854 -0.0205646275 0.0454837969 0.0596715621 0.0173455006 0.0041225395 0.0325349802 -0.0391339312 0.0138051492 -0.0570833054 -0.1175360156 0.0083068058 0.0040905439 0.5277626562 0.0343183990 0.1643007457 0.0071634864 -0.0040228102 -0.0010859333 -0.0294288070 0.0221165870 -0.0237209963 -0.0338787828 0.0224562266 -0.0098602735 0.0336676228 -0.0535526620 -0.0503404756 0.0109481087 0.0051258056 0.0060537329 -0.0013718668 -0.0942550422 -0.0119463723 -0.0365247152 0.0475411543 -0.0784607250 -0.0250424370 0.0468447380 0.0119731189 -0.0171559777 0.0443155049 -0.0009804473 -0.0646626909 0.0554072504 0.0614290149 -0.0157133237 -0.0033010842 -0.0061724024 0.0032588802 -0.0291295376 -0.0106600851 -0.1928142665 0.0198645787 -0.1261283111 -0.0047475032 -0.0000348553 -0.0060552791 0.0467294940 -0.0057239704 0.0429919212 0.0196519905 -0.0178240927 0.0205042145 -0.0307313197 -0.0654455672 -0.0473492872 -0.0080446504 0.0181729336 -0.0062012012 0.1065196688 -0.0265041895 0.0133016157 -0.0837458577 -0.0758907926 0.0158022004 0.0033162255 0.0161082312 0.0054264961 0.0040037223 -0.0533210816 0.0477516104 -0.0177381727 -0.0104350773 -0.0710715169 0.0063810463 -0.0008995795 0.0133196668 -0.0361329777 -0.0113625037 -0.0169805725 0.0542807113 -0.0197190612 -0.0117268034 -0.0034349526 -0.0154737777 -0.0009612628 0.0013195641 0.0047789529 0.0040618090 0.0060985737 0.0345516596 -0.0226659071 0.0147182266 -0.0163349037 -0.0084403152 0.0035988811 -0.0007967879 -0.0020867311 -0.0050114557 0.0086216578 0.0180581704 0.0026659964 0.0181920319 -0.0205296487 0.0023743115 -0.0040517204 -0.0035853673 -0.0128407467 0.0078893077 0.0178589657 0.0076632364 0.0181759541 -0.0211359131 -0.0000825169 -0.0021053539 0.0022068071 0.0021210719 0.0172634889 0.0029729497 -0.0105095111 -0.0045581167 -0.0143864882 -0.0014717393 0.0013928289 0.0019123886 -0.0079139515 0.0137409822 0.0047177567 -0.0008235000 0.0009392770 -0.0051318069 -0.0003729038 -0.0017691572 -0.0082550023 0.0045957270 -0.0060005653 -0.0105528764 -0.0172063826 0.0055518008 0.0049398376 0.0600577272 0.0077950467 0.0258242571 -0.0193035586 0.0003940314 0.0036518787 0.2114099686 -0.1265035328 -0.0060238683 0.0357977297 0.0690871014 0.0555874507 -0.0418955266 0.2280956936 0.1091102274 -0.0513353327 -0.0395812367 -0.0150420006 0.1224314834 0.4569622627 -0.0515363682 0.2574026985 -0.2842285249 0.3559287910 -0.0352575916 -0.0301377309 -0.0417312371 0.1121530204 -0.2125022981 0.2724673198 0.1754789249 0.3045039651 -0.0998463325 0.0360467569 0.0046109762 -0.0194800881 -0.0098904612 0.0235510345 0.0151882970 0.1385473988 -0.0312986296 0.0385710199 -0.0197432885 -0.0036309800 -0.0255353285 0.1430064057 -0.0255933567 0.1199956003 0.0627327509 -0.0549066348 0.0612642350 -0.0981885689 -0.2108695204 -0.1626534692 -0.0198468490 0.0540007262 -0.0192253064 0.3200583087 -0.0784818898 0.0395914620 -0.2445663805 -0.2413306487 0.0208222611 0.0266422251 0.0441652034 0.0377420507 0.0239644232 -0.2273756013 0.2068378481 -0.0830442956 -0.0492426841 -0.2589529392 0.0137259519 -0.0044210929 0.0433822789 -0.1304429334 -0.1044412046 -0.0533694551 0.2043180749 -0.1312439213 -0.0283660019 -0.0896490098 0.0027056537 -0.0183252141 -0.0268161924 0.0286621691 -0.0172660224 -0.0267365978 0.0271253361 -0.0170125859 -0.0460141959 0.0087495238 -0.0177879068 -0.0063538257 -0.0018422230 -0.0310452798 0.0170742521 0.0282123381 0.0698053689 -0.0463075490 0.0680074301 -0.1188900314 0.0083482149 -0.0422832527 0.0051878365 -0.1051237116 0.0438139413 0.1555775548 0.0563343816 0.1195335461 -0.1161391395 0.0294412718 -0.0165878465 0.0433386339 0.0920931566 0.2375376483 0.0432981351 -0.0928672152 -0.0564028300 -0.1869881240 0.0033507339 0.0020158933 0.0152406216 -0.1075596405 0.1743134087 0.0586441059 0.0177107410 -0.0292006877 -0.1056627257 -0.0018925038 -0.0352986043 -0.1229702281 0.0263202075 -0.0125126933 -0.0045169491 0.0429463318 -0.0055660369 0.0051608180 0.1107589081 -0.0036882802 0.0242044883 0.0067025547 -0.0018452296 -0.0018282420 -0.0461036762 0.0280255090 -0.0031128750 -0.0100150673 -0.0126897063 -0.0138074158 0.0150265138 -0.0563823400 -0.0305693143 0.0127438990 0.0096980729 0.0038171733 -0.0283729303 -0.1088210001 0.0118179835 -0.0566468741 0.0667357186 -0.0899999508 0.0035870326 0.0149964945 0.0120264771 -0.0289855187 0.0561237677 -0.0609721840 -0.0486828644 -0.0592654227 0.0313862353 -0.0119135274 -0.0016100290 0.0048339023 0.0044162222 -0.0074221839 -0.0041686319 -0.0298233167 0.0092568567 -0.0028394900 -0.0019754893 0.0058948071 0.0152799953 0.0147537587 -0.0158522464 -0.0212683352 0.0536819522 0.0411063226 0.0537284116 0.0079573034 -0.0103471598 -0.0242837411 -0.0313838700 0.0017172791 0.0154642142 0.0063867645 -0.0211490506 -0.0021155771 -0.0727377598 -0.0360926784 0.0486903476 -0.0027800646 0.0328657396 -0.0306651298 -0.0007565170 -0.0381621804 0.0110941386 -0.0919867858 0.0422494750 -0.0843682516 0.0621323080 0.0247959311 -0.0227120328 0.1300700590 0.0797160625 0.0214411815 0.0073111282 -0.0114104266 0.0377917232 0.0093612928 -0.0546190696 -0.0202110070 0.0322445032 -0.0188033816 0.0969205196 -0.0393487924 0.2326774428 -0.1868896670 0.1931900477 -0.3244440127 -0.0614541067 -0.0155773447 -0.0491069922 0.0336797073 -0.1480577165 0.0555458290 0.2230176473 -0.0453110185 0.1448200412 -0.1656621928 0.0370471404 -0.0340669621 -0.0701424910 -0.0311146727 0.0720336170 0.1781746296 0.1162125304 0.1769960505 -0.2196429287 -0.0263277029 -0.0040696396 -0.0315527778 -0.1268479775 -0.1147245606 -0.0073881371 -0.0129708634 0.0347713118 0.1007206957 -0.0232069986 0.0302839280 0.0172493694 -0.0030243399 -0.0401039136 0.0050506893 -0.0264977124 0.0121239391 0.0538525579 -0.0563122551 0.0597019139 0.0850851063 -0.0048929550 -0.0193726450 -0.0657993447 -0.0060424638 0.0599903830 0.0934146351 -0.4779251217 0.1691358715 -0.1833695042 -0.0058576007 0.0094961936 0.0039394777 -0.0474329362 0.0266257830 0.0296977607 0.0077132665 -0.0344681196 -0.0061272533 -0.0209400006 -0.0167450054 0.0128997394 0.0038987939 0.0013208069 0.0024291582 -0.0219753900 -0.0457270094 0.0176274807 -0.0543488090 0.0359923768 -0.0082577577 0.0318153017 -0.0437681130 -0.0072691762 0.0080988087 -0.0166596517 -0.0549671764 0.0139580086 -0.0963273558 -0.0175930871 0.0017514469 0.0065710034 -0.0096038239 -0.0038512418 0.0207181093 0.0089619941 0.0819061416 -0.0075938417 0.0399512375 0.0028180335 0.0100083223 0.0154669598 0.0150169741 0.0015572545 0.0081922168 0.0272357665 0.0227793112 0.0334593092 0.0027399605 -0.0056913695 -0.0039510513 -0.0198680082 0.0020670565 0.0070231671 0.0244009258 -0.0183761439 0.0041220796 -0.0671799560 -0.0369955046 0.0517114762 -0.0125749133 0.0161116110 -0.0342793550 -0.0059940492 0.0305350138 -0.0482257678 -0.0039055790 0.0228752932 -0.0127167986 0.0262573640 0.0018808981 -0.0034312978 0.0391238662 0.0051320681 0.0043791519 0.0035748945 0.0533951840 -0.0136777852 0.0624790676 -0.0447176119 0.0229939072 -0.0093535684 -0.0053904059 0.0117428191 -0.0191857187 -0.0007777429 0.0044297969 -0.0572862716 -0.0527903659 0.0175430513 0.0306444942 0.0604880016 -0.0346342087 0.0883828322 -0.0382999316 -0.2680474232 -0.0255709760 -0.1480354546 0.1358965599 -0.0236369687 0.0357516198 0.0302272502 -0.0449874865 -0.0504744328 -0.2377213006 -0.1052018052 -0.1484651603 0.1528810441 0.0135967889 -0.0268744389 0.0558730082 0.1351722089 0.3209567458 0.0435941325 -0.0551805670 -0.1207733427 -0.2966783645 0.0133690056 -0.0325961862 0.0027467096 -0.0706270941 0.2203026898 0.0485813172 0.0193788588 0.0495006200 -0.1055573719 0.1126198909 -0.1291257920 -0.2345866331 -0.0228003331 0.0023860552 -0.0238502346 -0.0301222663 -0.0114555072 0.0315332979 -0.5268074365 0.0232935997 -0.1664844130 -0.0047818851 0.0061584985 0.0000567094 -0.0140594653 0.0054185164 0.0250037979 0.0217115788 -0.0321204984 -0.0019221858 -0.0256439842 0.0123567185 0.0273118420 -0.0013703831 0.0013665930 -0.0053089786 -0.0090726361 0.0109341676 0.0070213207 -0.0135110951 0.0037315218 0.0177289430 0.0248252317 -0.0390043062 -0.0050232741 0.0091221232 -0.0234491625 -0.0266308554 0.0304402353 -0.0727189794 -0.0311625663 0.0029062957 0.0073360099 0.0005806527 -0.0029349212 0.0172630000 0.0055602769 0.0284771029 0.0081604343 0.0178771134 -0.0006621598 -0.0191467100 0.0006082470 -0.1110501143 -0.0240945658 -0.1518556586 -0.0226403582 0.0575496696 -0.0414658470 0.0684370352 0.1295204046 0.0722176467 0.0108603468 -0.0289096852 0.0148289688 -0.1981637283 0.0290639971 -0.0778108857 0.1741369847 0.1808263130 -0.0227214875 0.0069907480 0.0186011606 0.0052208881 -0.0002840067 -0.0515965249 0.0532782693 -0.1331921057 0.0530997946 -0.0375264161 0.0318896809 0.0550036234 -0.0234662035 0.0663309009 0.0588076789 -0.0001627981 0.0089903262 0.0259039914 0.0101706911 -0.0706697583 -0.0083543191 -0.0199313761 0.0357248446 -0.0347140049 0.0958392011 -0.1055977599 0.1329671278 -0.1475906948 0.1835433081 -0.2825338119 -0.0419158157 0.0017268941 0.0236193533 0.0155446401 -0.0528803408 -0.0183087305 -0.1422570498 -0.0992176183 -0.0657561324 0.0467784452 0.0174503870 0.0212201620 -0.0484556196 -0.0390014168 0.0014671346 -0.1507404553 -0.0013456616 -0.0377613923 -0.0062276414 -0.0171332732 -0.0354124307 0.0216179152 -0.0140027605 0.2093237634 0.0396654739 -0.0403434281 -0.1037896145 -0.2108508413 -0.0129170476 -0.0069899517 0.0234224667 -0.0708393330 0.2033661254 0.0586047414 -0.0131763765 0.0920314219 -0.0454388411 0.0837740390 -0.0914083567 -0.1749596989 0.0237857663 -0.0249065101 -0.0258664872 -0.0294616954 -0.0008532585 0.0208863018 0.4986971283 0.0120705009 0.1721020784 -0.0000076879 -0.0039648246 0.0068606173 0.0128107096 -0.0014667652 -0.0339657328 -0.0459038725 0.0606557038 0.0099334249 0.0343110901 -0.0156061510 -0.0385816684 0.0010972309 -0.0086816484 0.0138969444 0.0098727222 -0.0237016427 -0.0012967265 0.0095311424 -0.0078486935 -0.0153175637 -0.0256953052 0.0471955242 -0.0013689631 -0.0090869379 0.0281467888 0.0339906609 -0.0377710532 0.0978509635 0.0412318877 0.0087065549 -0.0106641992 -0.0145671606 -0.0004085289 -0.0201523190 -0.0037886733 -0.0256718895 -0.0283075781 -0.0475448567 -0.0039295577 -0.0634401773 -0.0956005029 -0.1236171922 0.0082278302 -0.0525648075 -0.2569730008 -0.1420014766 -0.2962791387 -0.0110052454 0.0794139442 0.1112091888 0.1483581374 -0.0059792230 -0.0411694765 0.0654649033 0.0013276064 -0.1219898902 0.2043675896 0.0766173779 -0.0314834338 -0.0233486831 0.0437417621 0.1278907130 -0.0853609549 -0.0687172714 0.2470399367 -0.0611309898 -0.0112094407 -0.0253307218 -0.1039018413 0.0764489450 0.0735331150 -0.3942763977 0.0887381385 -0.1306364248 0.1431261527 0.1105046736 -0.1237696636 0.0830335351 -0.0380393106 0.0204896438 0.0049894859 0.0145381998 0.0208384460 -0.0538269223 0.0534633113 -0.0475087437 0.0677587891 -0.0590308722 -0.0237265013 0.0054425740 0.0040781464 0.0138323785 0.0337097631 -0.0057512090 0.0072412963 -0.0550993187 -0.0092137660 -0.0051783851 0.0207048673 -0.0098705058 -0.0244267014 -0.0098254457 0.0152698203 0.0204344390 0.0587290238 0.0397790488 -0.0481584888 -0.0116685960 -0.0123636316 -0.0084109076 -0.0352062934 0.0048085975 0.0005433297 -0.0191595773 -0.0127618821 -0.0160305149 -0.0126444718 0.0110169885 0.0122748544 -0.0131368312 0.0291974909 0.0143842545 -0.0149722583 0.0301127645 0.0176894166 -0.0018146888 0.0033848463 -0.0044842693 -0.0268191582 -0.0233100173 -0.0102109028 -0.0063191276 -0.0105047979 -0.0211858729 -0.1178139014 0.0515468566 -0.1342791286 0.0045099877 -0.0085589454 -0.0305617323 0.0819048683 -0.0670481537 0.0343436427 0.1400826481 -0.1063278264 -0.0046752603 -0.0809486134 0.1082851598 0.1135804689 -0.0125477704 0.0246572375 -0.0437084146 -0.0457893649 0.1331901839 0.0255635629 0.0813222517 -0.0328017868 -0.0143245633 0.0379263500 -0.0430876126 0.0387025905 -0.0384613182 0.0354768279 -0.0565031740 0.0311721509 -0.1975518324 -0.0402142661 -0.0278562949 0.0163108956 0.0375733621 -0.0011343445 0.0072241592 -0.0068728945 -0.2689873654 0.1108916104 -0.0971574760 -0.0029154387 -0.0263885961 -0.0431736872 -0.0435683150 0.0039624274 -0.0120196794 -0.1056916037 -0.0674366066 -0.1221060702 -0.0129371586 0.0177754597 0.0352225396 0.0606875688 0.0017586435 -0.0153887994 0.0458726606 -0.0010844148 -0.0424660438 0.0667780291 0.0144593768 -0.0067575107 -0.0124110961 0.0223413903 0.0548200341 -0.0471099136 -0.0258158362 0.1117527049 -0.0324351644 -0.0022913085 -0.0163316372 -0.0376659572 0.0286152466 0.0251441373 -0.1408736938 0.0530987624 -0.0481826240 0.0501744988 0.0274332675 -0.0385264183 0.0405093402 -0.0229264901 0.0034385402 -0.0075993802 0.0058949011 -0.0111290146 0.0281878679 0.0041186116 0.0108268799 -0.0369804117 0.0253533951 0.0052872410 0.0058148609 -0.0009746206 -0.0095490734 0.0082183175 0.0067010139 0.0134077167 0.0292678805 0.0106065164 -0.0076012079 -0.0090147587 -0.0001664222 0.0136372748 0.0003583011 -0.0038004916 0.0102615299 -0.0210382392 -0.0043454079 0.0107738115 0.0046856861 0.0067411449 0.0019616031 0.0188805521 -0.0146283849 -0.0043265357 0.0021579158 0.0131596876 0.0194938248 0.0054208965 -0.0029856552 -0.0068753515 0.0113939886 -0.0283876442 -0.0108937489 0.0061875334 -0.0185852081 -0.0017593345 -0.0069639411 0.0071921325 0.0165315223 -0.0128416057 -0.0127593354 -0.0179591249 -0.0157472929 0.0092189922 0.0085351735 -0.2005976988 0.0192351105 -0.0613499756 -0.0055733003 0.0192119536 0.0604495346 -0.1847510649 0.1457324723 -0.0518730938 -0.2668527800 0.1824815810 0.0013776976 0.1542480145 -0.2269187225 -0.2189036694 0.0240314838 -0.0450116763 0.0763811597 0.0918334341 -0.2621114227 -0.0662299402 -0.1846496088 0.0798885590 0.0260919956 -0.0620959219 0.0613750538 -0.0769810690 0.0776801344 -0.0845381377 0.1026016570 -0.0382800798 0.3412473185 0.0516062082 0.0587182695 -0.0275096237 -0.0602179890 -0.0041684372 -0.0107108899 0.0112942901 0.4436773583 -0.1876234315 0.1491997344 0.0009161455 0.0055797510 -0.0162782689 0.0487956045 0.0242050861 0.0945042326 -0.0232942935 -0.0674023157 -0.0160073654 -0.0436083838 -0.0632911956 -0.0280429041 0.0096076011 0.0088863209 -0.0076449490 0.0429405210 0.0261183974 0.0733926111 -0.0087171429 -0.0419390683 -0.0468331476 -0.0029574967 -0.0278952901 0.0223035018 -0.0022972933 0.0410084416 -0.0204755950 0.0390585635 -0.0153196909 0.0854740969 -0.0099849323 -0.0019942599 -0.0147640663 0.0189447015 0.0574089510 0.0043194993 -0.0496648450 -0.0137333733 0.0199845992 -0.0042176484 0.0278010142 -0.0183530003 0.0148642030 -0.0178359156 0.0115308248 -0.0025071279 -0.0063053157 -0.0092430035 0.0669756466 -0.0056297837 -0.0067896707 -0.0145137975 -0.0072678572 0.0173677774 -0.0649711062 -0.0036838470 -0.0116658385 -0.0137105062 -0.0052397960 0.0155432090 0.0116252535 0.0145597175 -0.0190208846 0.0316375900 -0.0012750954 -0.0466377061 0.0024469839 -0.0226005319 0.0092965692 -0.0077647138 -0.0100151084 -0.0013406267 -0.0349009463 0.0315066451 0.0107415353 0.0282847874 -0.0347039978 -0.0459035785 -0.0097309712 -0.0022629759 0.0104278522 -0.0139996282 0.0626787225 0.0183153418 -0.0128578455 0.0530075721 0.0020764751 0.0379905304 -0.0342521692 -0.0538522050 0.0031089632 0.0017896400 0.0123022364 -0.0160659758 0.0087270860 -0.0193322348 0.1860946811 -0.0171198314 0.0754082984 0.0679689639 0.0167271623 -0.0276368385 -0.3288905243 0.1903572380 0.1794897784 0.0874011980 -0.3535461428 -0.1582309580 0.0079957993 -0.2653198838 -0.0526976966 0.0189619438 0.0588528198 -0.0279460406 0.0689390517 -0.0674674094 -0.1238717084 -0.2749693309 0.1780495082 0.1973482829 -0.0450701199 -0.1567888364 -0.0154240191 0.1434257252 -0.3461343323 0.1514521142 0.1343131527 0.1326447952 -0.0610575685 -0.0299899650 0.0406376054 0.0371071241 0.0018689271 0.0567796885 0.0147183416 0.0448363351 0.1419657741 0.1367431257 0.0084757315 0.0325150969 -0.0348834620 0.1711763437 0.0881030912 0.3206545328 -0.0516108376 -0.1972028554 -0.0193989764 -0.1374764373 -0.2080625521 -0.0892486904 0.0182953105 0.0211631542 -0.0242488288 0.1402745907 0.0727613232 0.2401844024 -0.0758548033 -0.1799649490 -0.1311580753 -0.0083956310 -0.0923637766 0.0472819661 0.0234082108 0.1358185666 -0.1163307918 0.1399481048 -0.0435094530 0.2797576227 -0.0250425529 -0.0024730434 -0.0340412979 0.0346057075 0.1436631030 0.0043047452 -0.1282574984 0.0007981904 0.0370761795 0.0078535774 0.0755373225 -0.0363068022 0.0261392848 -0.0232423181 0.0243983841 -0.0985646475 -0.0608891180 -0.0046968782 0.1627512956 -0.0113035803 -0.0243832416 -0.0250887608 -0.0016965791 0.0630731006 -0.0524901972 -0.0306640196 -0.0406473747 -0.1145356720 -0.0552197765 0.0661625314 0.0767391138 0.0135211318 -0.0695618161 0.0783488660 0.0120554578 -0.0720096273 0.1546635871 -0.0014690349 -0.0121864591 -0.0345723645 -0.0509769473 -0.0272033192 -0.1302919465 0.0488034734 0.0113432347 0.0434189338 -0.1044585151 -0.1227465601 -0.0541655696 0.0223867607 0.0505630990 -0.0435367649 0.1857014080 0.0662020789 -0.0695360210 0.2002644203 0.0666662796 0.0822280729 -0.0619579482 -0.1103061682 -0.0086756752 0.0132898795 0.0465462581 0.0173442802 0.0015530584 -0.0512420904 -0.1759788255 -0.0361635514 -0.0633752909 -0.0226680438 -0.0040604391 0.0145127431 0.0907302586 -0.0496734873 -0.0620349446 -0.0508309583 0.1295891269 0.0517231497 0.0104862682 0.0663263018 -0.0013268402 -0.0037826783 -0.0227211691 0.0151719273 -0.0130296279 0.0001772352 0.0328835745 0.0743800118 -0.0516292320 -0.0587817985 0.0122778329 0.0514411019 -0.0035129248 -0.0310724612 0.0966030934 -0.0486746998 -0.0355342101 -0.0185841972 0.0131626679 0.0126377381 -0.0158211889 -0.0104709062 -0.0001443379 -0.0172112026 -0.0032714653 0.0701568781 -0.0643805587 0.0109009475 0.0012283545 -0.0021341804 0.0542123950 -0.0915209833 -0.0511802868 -0.1963682372 0.0869148035 0.1710831660 0.0786433945 0.1024619339 0.1362855040 0.0555879121 -0.0383119241 -0.0194512055 0.0127954786 -0.0938647504 -0.0627147380 -0.1549415417 0.0001908816 0.0871417786 0.0947483839 0.0142492655 0.0376508681 -0.0636263276 0.0397152466 -0.0765022693 -0.0128504085 -0.0066343897 0.0003891530 -0.1629082325 0.0031531680 -0.0179190461 0.0451482731 -0.0825446957 -0.2207050318 -0.0081164574 0.1141144067 0.0259569654 -0.0595080253 0.0034597207 -0.0090228620 0.0376540402 -0.0506612477 0.0580889954 -0.0426633794 -0.1949495326 -0.0982173010 0.0342473794 -0.0053989458 0.1364388222 -0.0329124254 0.0604378420 0.0656242784 0.0352906513 0.3402356417 -0.0548796004 -0.0881799912 -0.1347656448 -0.1103252570 0.0966727819 0.1324540065 -0.0515149911 -0.0434414415 -0.0114174016 0.0313580065 0.0697238476 0.3921098543 0.1127724300 -0.0456518637 -0.0399256746 -0.0781345201 -0.0617598115 -0.0645091221 -0.0715623490 -0.0547444735 -0.0863933079 -0.0614392140 -0.0481016844 -0.0875354920 0.0775371329 0.0636258041 -0.0016063510 0.0712519720 0.0460782470 -0.1126394339 0.2124021568 0.1912487688 -0.0177342104 0.0598815962 0.0682471516 -0.0059937127 0.0113605846 0.0291042411 0.0031034941 -0.0878662563 -0.0589327250 -0.1096915343 -0.1088764444 -0.0725528431 0.0115561364 0.0038166075 0.0055560049 -0.0706801729 0.0476434995 0.0151211342 -0.0296734267 -0.0208735597 -0.0228227711 0.0301650256 -0.0730341626 -0.0436911868 0.0032831804 0.0027672945 0.0025352247 0.0385861703 -0.0259250693 -0.0455860529 -0.0538663461 0.0249191651 0.0510478294 -0.0206032179 -0.0095089591 -0.0126788710 0.0197541032 -0.0584341867 0.0656000475 0.0331625548 0.0800243730 -0.0240229633 0.0147803921 0.0006915192 0.0048867172 -0.0031607105 0.0035531385 0.0005444818 -0.0112551267 0.0101962312 -0.0097725424 -0.0133054355 -0.0189170988 0.0297304149 -0.0767493193 -0.0746353442 -0.2009581475 0.0823925216 0.1434704613 0.0644100398 0.0789147681 0.0910565652 0.0072071252 -0.0113673066 0.0019580195 0.0046031192 0.0122242163 -0.0846680973 -0.1819526750 -0.0205173224 0.0294440834 0.0714194531 0.0220878678 0.0395019711 -0.0143336562 -0.0235947597 -0.0898141934 0.0988252616 0.0509742557 -0.0595800495 -0.2056137235 -0.0387015933 -0.0503956049 0.0317549167 -0.0728499290 -0.1007799986 0.0100138820 0.0309615966 -0.1079653056 0.0107924777 0.0380212893 0.0132995977 -0.0016329221 0.0326751160 -0.0047464336 -0.0450086311 0.1773256540 -0.0163711564 0.0445868134 0.0390562894 0.1616924176 0.0042059201 -0.0721479795 -0.0907993506 0.0338851411 -0.2865443492 0.0218146669 0.1764903445 0.1019580806 0.1023221584 -0.0565061393 0.0197466734 0.0704208534 -0.0137997445 0.3147487671 -0.0307225445 -0.0519842886 -0.1273493572 -0.1144226863 0.0694736003 -0.0123105587 -0.0004485657 -0.0105787252 -0.1206130465 0.0143930699 0.0264681221 0.2995554328 -0.1184983341 -0.1003494331 -0.0407279064 -0.0346146838 0.0240527157 0.0250180805 0.1867910704 0.0329870722 -0.0638624834 0.2664819147 0.0557330508 0.2145555902 -0.1759512978 -0.2144477079 -0.0063981076 0.0082336303 0.0101340365 0.0307435164 0.0553934878 -0.0202119183 -0.0061145745 0.0788910106 -0.0619122441 -0.0060731878 0.0005885758 0.0031371628 0.0140180686 -0.0078286182 -0.0088653479 -0.0089182756 0.0228571155 0.0102912453 -0.0020009887 0.0149703834 0.0030236723 0.0011804163 -0.0040347793 0.0012172985 -0.0008895743 -0.0056563523 0.0033968012 0.0122559990 -0.0067433720 -0.0169148637 0.0060851017 0.0008425148 -0.0029067031 0.0073928334 0.0049247117 -0.0256181876 -0.0039969447 -0.0183341559 -0.0022598685 -0.0052318233 -0.0003668346 0.0010172883 0.0005553554 0.0008204685 0.0000868212 0.0326914600 -0.0050926964 0.0266859169 0.0169423431 0.0240466225 0.0626071280 -0.0001941044 -0.0037055018 -0.0372737469 0.0900943782 0.1096505257 0.1025193607 0.0617482640 0.0648767708 0.0388534955 -0.0334388684 -0.0235632791 -0.0244748588 -0.0186642815 -0.0594300704 -0.0942186128 -0.0430169625 -0.0214948674 0.0000170405 0.0252055989 -0.0244185432 -0.0380895073 0.1396647271 -0.0651243631 -0.0986550879 0.1243801472 -0.0594638645 -0.0314109069 -0.0482682197 0.0052582647 0.0654318239 -0.2211791464 -0.1478216956 -0.0504687943 0.1143145891 0.0662524784 -0.0881188931 0.0247122879 0.0402927106 -0.0009758960 0.0958750272 0.0096849305 0.0436247020 -0.0899837103 -0.0008585996 -0.0448411902 0.3272586826 0.0014005438 -0.0458278844 -0.0546435400 0.0038569470 0.0786474784 -0.0283390641 -0.0313677326 0.0075363741 -0.1931752428 -0.0636340333 0.0710157556 -0.0801611892 -0.0083319176 -0.0827267536 -0.1730199201 0.0348314600 -0.0392762313 -0.0670276410 0.0597019930 -0.1351539222 0.0019214643 0.0483907914 0.0251493670 -0.1965245743 0.1104082618 0.0964656552 -0.0909664809 0.0901312247 0.0690993611 0.0956372850 -0.0335561358 -0.0202701584 -0.1672701386 0.0217533610 0.0406036602 0.1459338567 -0.3453697746 -0.3029106370 -0.1370694337 0.0305093304 -0.0316200916 -0.0148506034 0.0055519030 0.0484357957 0.0254877409 -0.0262850425 -0.1060842897 -0.1160792055 0.0141225771 -0.2033754634 0.0055265524 0.0000840100 0.0165527873 -0.0390790915 0.0332244529 -0.0184350800 -0.0676968897 0.0444184160 -0.0008295023 0.0511575840 -0.0618858566 -0.0604201374 -0.0016896031 -0.0044993779 0.0013234208 0.0543846086 -0.0131734435 -0.0640955258 -0.0181394726 -0.0026856459 0.0387933666 -0.0146569666 0.0089202719 -0.0134701975 0.0008477756 -0.0171640183 0.0566735976 0.0530019249 0.0471471158 -0.0686963179 0.0262580887 -0.0065174841 0.0173189959 -0.0094986341 -0.0064225470 -0.0056754404 -0.1175247699 0.0194605115 -0.0770673515 -0.0691879776 -0.0565593688 -0.0495520571 -0.0705424792 -0.1313583077 -0.2480006313 0.0717443607 0.0626203005 0.0337586383 -0.0059249033 -0.0455244376 -0.1602889645 0.0429885228 0.0515787447 0.0552656350 0.0883500894 -0.0359350513 -0.1104810722 0.0354819710 0.0174955286 0.0200229954 0.0137061961 0.0574867253 0.0490201174 -0.3233496025 0.0451400223 0.3086999069 0.0150353270 -0.0587813506 -0.2039854904 -0.0085619022 -0.1074724978 -0.0918303515 0.3162970836 0.0799025005 0.1325480859 -0.2713398354 -0.2343821255 0.1678653366 0.0628017409 0.0338719443 0.0026450747 0.0257872930 -0.0196234351 -0.0001877373 -0.0506789035 -0.0935847979 0.0327104644 0.0917377709 0.0543845749 -0.0025100025 -0.0057972471 0.0324754858 0.0386315402 0.0453048853 -0.0261480831 -0.0816685952 -0.0720476050 -0.0758694312 0.1055876418 -0.0102988345 -0.0177906206 -0.0376697071 -0.1426302374 0.0212094161 -0.0396134986 0.1050684574 0.0428424009 -0.0255126158 -0.0045342832 -0.0041820572 -0.0019368856 -0.0824910162 0.0415408478 0.0273269672 -0.1280254145 0.0406271591 0.0267888754 0.0347876404 0.0114710511 0.0038699893 -0.0985943845 0.0049695196 0.0321119567 0.0593162918 -0.1710305618 -0.1242416977 -0.1155014538 0.0649628915 0.0380281263 -0.0090136544 0.0434447952 0.0304817630 -0.0317769320 -0.0009132359 -0.0178756132 -0.0027262506 -0.0851357703 0.0930412111 -0.0166506883 0.0025863044 0.0024463616 0.0367520926 -0.0241828384 -0.0104985563 0.0000227429 0.0348245744 0.0224456000 -0.0217394698 0.0515704092 0.0254599469 0.0079785618 -0.0069170350 0.0013595376 -0.0157658435 -0.0166061527 0.0260087540 0.0334014343 -0.0118669936 -0.0472355302 0.0174962290 -0.0132598861 -0.0075137932 0.0501455227 -0.0234019950 -0.0924604413 -0.0087000481 -0.0323128151 0.0119282212 -0.0294962686 0.0087834724 0.0016362915 0.0085385246 0.0095287449 0.0040392759 0.1207599868 0.0022228779 0.1097734275 -0.0054951725 -0.0038282840 -0.0130546354 0.0045570698 -0.0009681348 0.0082212432 -0.0120055437 -0.0217921151 -0.0136387812 -0.0160051065 -0.0205747135 -0.0173600562 0.0056318153 0.0042334322 0.0091361454 -0.0023850928 0.0162133837 0.0290175427 0.0108853358 0.0042264768 -0.0030310448 -0.0022240064 0.0037265537 0.0050461947 -0.0320865398 0.0159827002 0.0198304542 -0.0293587267 0.0155934708 0.0079479516 0.0094927899 -0.0056683163 -0.0150876770 0.0613428714 0.0032716322 0.0212684190 -0.0317337728 -0.0123670578 0.0193388935 -0.0117133591 0.0001730721 0.0045287063 -0.0078088874 0.0010798880 0.0056176515 0.0097762090 0.0226364981 -0.0063847996 -0.0413673841 -0.0460955244 0.0061790428 0.0016189276 -0.0034954625 -0.0169420403 -0.0121653207 0.0069077271 0.0015289323 0.0095850663 0.0153061255 -0.0302845273 0.0038664245 0.0008805230 0.0153575390 0.0249617305 -0.0058819221 0.0144163982 -0.0180985706 -0.0083335222 0.0109568613 0.0031926124 -0.0018233917 0.0017258764 0.0455438761 -0.0140890284 -0.0132721025 0.0157366341 -0.0081160918 -0.0060959073 -0.0105129143 0.0007619537 -0.0020943824 0.0323307494 -0.0145335529 -0.0128984669 -0.0178026019 0.0423684872 0.0434827898 0.0229582582 -0.0068796763 0.0054783124 0.0016716776 0.0054776482 0.0037996915 0.0163782430 -0.0025069386 0.0075488957 0.0201643368 0.0204746998 -0.0183893585 -0.0334484725 0.0065988365 0.0949079215 -0.0360665005 0.0626318077 -0.1388349849 -0.3250717555 0.3497769340 0.0884097728 0.1703592847 -0.0998306772 -0.1907747636 0.0133628146 -0.0394951493 -0.0149645023 0.1970356487 -0.0752024957 -0.2286242254 0.0665669455 -0.0681897146 -0.0227628783 0.0338394920 -0.0287808535 -0.0678647573 0.1325704031 -0.0998481896 -0.1146547953 0.2714635557 -0.0783946015 -0.3658133986 -0.0218240712 0.0217441806 0.0905369141 -0.0028123455 0.0185589696 -0.0155715021 -0.4363884977 0.1767048362 -0.1494766631 0.0269877536 0.0087469570 0.0185113021 -0.0106642396 0.0371708143 0.0456577873 -0.0469621907 -0.0034597466 -0.0409391684 0.0247797316 0.0586132256 0.0929343238 -0.0188936558 -0.0105649656 -0.0211762736 -0.0139994309 -0.0060001006 -0.0020464830 -0.0270546129 0.0227046511 0.0514287346 -0.0140800973 -0.0094318741 -0.0204924214 0.1087114571 -0.0269597120 -0.1015173255 0.0216121592 0.0009074368 0.0331529301 0.0000742624 0.0198110025 0.0447154417 -0.1444219041 -0.0427225120 -0.0551346960 0.1287065866 0.0197500939 -0.0488787207 -0.0007088226 -0.0007992956 -0.0159975631 -0.0003321583 -0.0050325420 -0.0087666577 0.0020977346 -0.0142297330 0.0028241969 0.0479773408 0.0591375092 -0.0142253486 0.0036989387 0.0073805442 0.0109217664 0.0103615153 -0.0045922820 -0.0185101606 0.0045861297 -0.0140930838 0.0309224192 0.0004724571 -0.0020951935 -0.0104545052 -0.0402827824 0.0062328136 -0.0213445603 0.0306536831 0.0059108290 -0.0004706987 -0.0014627960 -0.0035341450 -0.0023944036 -0.0208998267 0.0092828784 0.0049908169 -0.0287530176 0.0059241928 0.0021904904 0.0062873064 0.0047213240 0.0027328622 -0.0249337457 0.0048396147 0.0096532418 0.0118470769 -0.0349811881 -0.0276179866 -0.0276177515 0.0164899684 0.0092854487 0.0032533733 -0.0162825380 -0.0109394897 -0.0436998766 0.0022792003 -0.0119489724 0.1975633384 -0.0237924381 0.0932392886 -0.0609354042 0.0095856069 0.0208980510 0.1149708418 -0.0715598378 -0.0516419222 -0.0403840910 0.1603433858 0.0878456953 -0.0532710790 0.1589010202 0.0631678893 0.0380816508 -0.0268650384 0.0046504328 -0.0615265384 -0.0922317405 0.0956974995 0.1125234202 -0.0275116579 -0.2119623278 0.0621844580 -0.0654947289 -0.0441776099 0.2511672476 -0.1515801294 -0.3907457449 -0.0294341842 -0.0902334255 0.0465001115 -0.1191204552 0.0409951943 0.0193191827 0.0291764691 0.0379734215 0.0136919016 0.4340039435 0.0542416376 0.4345012487 0.0252368517 -0.0438657509 -0.0913297092 -0.1010491346 0.0863322704 0.1049705313 -0.3354133166 -0.2156880780 -0.3535297067 -0.0606976473 0.0386703382 0.1770870658 -0.0068884993 0.0414964958 0.0584444809 -0.0214541546 0.1219492057 0.2379642767 -0.0539702255 0.1661389695 0.3684571100 -0.0894552363 0.0444964240 -0.0430248230 -0.0461971247 0.0974878344 -0.1063937529 -0.1558777007 0.1295045262 0.0869549069 0.1238942843 -0.0604023045 0.0334550022 0.1219708114 -0.2423037861 0.0378301759 0.1522476829 -0.0886521972 0.0302607296 -0.0422325780 -0.0182145610 0.0205614822 0.0147895195 0.0396732582 -0.0355225400 0.0192226492 -0.0184336033 0.0241378300 0.0656999358 0.1567398181 -0.0163737891 -0.0037023340 -0.0162779249 0.0536572828 0.0824886613 -0.0163588847 0.1202177592 0.0051723238 0.0019084368 0.0424027645 -0.0139172108 0.0122506911 -0.0443468453 0.0689271978 0.0060283355 0.0053808622 -0.0303121436 0.0046723180 -0.0468159463 -0.0163723490 0.0266708754 -0.0088404996 -0.2080655937 0.0302703352 0.0552135128 0.0868278167 0.0066745578 0.0187619659 0.0232892795 -0.0272441121 0.0064716000 -0.0733327695 0.0883671771 0.0387739682 0.0373745081 -0.0442079796 -0.1199177208 0.0168393304 -0.0551278914 -0.0995428422 0.0090814648 0.0105231297 0.0036979596 0.0137849233 -0.0313134393 -0.0033679684 -0.0435866727 -0.0509632193 0.0002699852 0.0042667250 -0.0005112480 -0.0026590917 -0.0067845957 0.0038485833 0.0052270906 0.0066423826 -0.0145587535 -0.0068587970 0.0010802391 -0.0080534151 -0.0013720138 -0.0026118233 0.0026745222 -0.0007538581 0.0051272583 0.0087625010 -0.0066365516 -0.0040257573 -0.0001077917 0.0180177485 -0.0055296147 0.0051524240 0.0041239675 -0.0204770006 0.0117476082 0.0322788662 0.0007903603 0.0063306803 -0.0023341314 0.0091943845 -0.0031866655 -0.0024909276 -0.0019957458 -0.0022314978 -0.0009723053 -0.0234345052 -0.0020211446 -0.0254030572 -0.0238750602 0.0225583999 0.0138435078 0.0759290146 -0.0287635379 0.0015367820 0.1325076783 0.0356597899 0.1450747071 -0.0213550287 -0.0821814021 -0.1327651116 0.0234369981 -0.0228494575 -0.0071482929 -0.0373685183 0.0029944477 -0.0127173516 0.0879827548 -0.0655584124 -0.2267299219 0.0265709023 -0.0082611446 0.0200018621 -0.0580093259 0.0198189958 0.0652438057 -0.0574707407 0.0220969544 0.0153761151 -0.0179096138 0.0446575612 -0.0415408170 0.0643402710 0.0831706487 0.0153103684 -0.1073191246 0.1190386758 -0.0156342024 -0.0174584867 -0.0364024746 0.0248838644 -0.0840482861 0.0689519824 0.0026285585 -0.1791677084 0.0305275271 -0.0100486645 -0.0288611872 0.0362410142 -0.0261937746 0.1127129514 -0.0207128739 0.0509276431 0.4240465365 -0.0149799310 0.3061889586 0.0709870639 0.0491471763 -0.0341126406 -0.0129850924 0.0192120373 -0.0530763991 0.2144079503 0.0060391295 0.0925261476 -0.2266408557 0.0262084902 -0.1855866272 -0.0506736605 0.0857315792 0.0078547329 -0.3137377655 0.0362703955 0.0918730032 0.1960235404 0.0316866058 0.0542770205 0.0219265104 -0.0839299370 -0.0222900619 0.0117086844 0.0715322323 -0.0065831382 0.0237970954 0.0405775113 -0.1032971525 0.1503924256 -0.1738448493 -0.2053326263 0.0028829442 0.0006819521 -0.0066069320 -0.0180021519 -0.0843208456 0.0210540294 -0.0148736315 -0.1146115618 0.0587634635 -0.0064115392 0.0017033889 0.0017919842 0.0091386018 -0.0057549481 -0.0030596842 -0.0025719871 0.0137952855 0.0081951116 -0.0070218198 0.0164606179 0.0076522700 0.0059256407 -0.0025252011 -0.0002339724 -0.0071471116 -0.0115697186 0.0114787223 0.0104454678 -0.0002640750 -0.0256741890 0.0046644015 -0.0086673775 -0.0047718141 0.0275871080 -0.0214979174 -0.0393602279 -0.0041055744 0.0010892049 0.0106333015 -0.0125027007 0.0068987659 0.0008412652 0.0042589501 0.0043030618 0.0022157837 0.0320285382 0.0113500823 0.0368389407 0.0055133452 0.0257627835 0.0197870341 0.0624821411 0.0145624717 0.0595641602 0.0585405997 0.0098174222 0.0713807094 -0.0032570197 -0.0252129844 -0.0310139035 0.0054609638 -0.0296258539 -0.0279504069 -0.0395918140 -0.0061516511 -0.0207751395 0.0508785314 -0.0425544200 -0.1559716912 0.0082119157 -0.0008986439 0.0131235439 0.0283045333 -0.0190231189 0.0084196682 -0.0870306759 0.0443428061 0.0314471148 -0.0071411879 0.0464721519 -0.0092608619 -0.0199494426 0.1044798500 -0.0219304415 -0.0138012794 0.0980467661 -0.0301949506 -0.0210034536 -0.0654163482 0.0263968484 0.0255847805 -0.0164124424 -0.1091453285 0.2797445837 -0.1070837117 0.1186847823 -0.1743045294 0.2272502556 0.0486382011 -0.0415556452 0.0058151903 0.0605974068 -0.0315075291 -0.0247235093 -0.0146794598 0.1789401765 -0.0605198269 0.2396271635 0.0046737672 0.0028680486 -0.0303603822 -0.0243277440 -0.0006645889 -0.0621645834 0.3152480726 -0.0120269790 0.1654107437 -0.0144404496 -0.0332642538 -0.0632113390 -0.3194346636 0.0117597116 0.0411823162 -0.0281694222 -0.0028276528 0.0193433757 0.0407999718 0.0309825414 0.0575267921 -0.2518995089 0.1783193822 0.1383590405 0.0844053406 -0.1913586704 -0.2554386187 -0.1658768487 0.0680901485 -0.0293987189 0.0090261736 -0.0289881406 -0.0656234158 -0.0030378130 0.0542536898 0.1105415609 -0.0093820012 -0.0434362411 0.2283181957 0.0050039695 -0.0018928826 0.0069914238 -0.0133597082 0.0121118175 -0.0098503901 -0.0252504032 0.0137497884 -0.0013353374 0.0241615395 -0.0284386462 -0.0255987031 -0.0058902333 0.0013156820 -0.0050118738 0.0213241126 0.0130371420 -0.0321842523 -0.0056860690 -0.0030852937 0.0179170879 0.0018930591 0.0029029826 0.0034422327 -0.0228734141 0.0187119269 0.0284055996 0.0261255513 -0.0279798919 -0.0422165574 0.0040940216 -0.0000228920 0.0032949003 -0.0021654595 -0.0025277432 -0.0030899302 -0.1005808310 0.0090386152 -0.0692648079 0.0512860919 -0.0266597765 0.0205321971 -0.1168534382 0.0324150486 -0.0368023062 -0.1236882109 0.0292174661 -0.1463711640 0.0876894321 0.1658217929 0.2158269668 -0.0549052689 0.0355265031 -0.0393033585 0.1252506894 -0.0802756934 -0.1179248190 -0.1858324434 0.0181405186 0.2400912728 -0.0003096149 -0.0203724108 0.0234454902 0.1661432346 -0.1043943352 -0.0507820723 0.2071030062 -0.1357061903 -0.0541994163 -0.0135768858 -0.0276603079 -0.0121428879 -0.0966562314 0.2540272651 -0.0812120179 0.0322420475 -0.2422028846 0.0673813219 0.0268647282 0.0602220824 -0.0565942367 -0.0907376775 -0.0687853260 0.0226363912 -0.1262596586 -0.1109953490 0.0460563902 -0.2089053513 -0.1767543751 0.0343940691 0.0843309610 0.0007993787 0.0104333891 0.0983945288 -0.0010234871 0.0161459734 0.1734406430 -0.0063869446 0.0644202518 0.0427016369 0.0092451848 -0.0107880751 0.0530590489 0.0060544590 -0.0136122703 0.0708323091 0.0080910724 0.0049735376 -0.0606485050 0.0218009268 0.0121526778 -0.1950470170 0.0570243552 0.0596280102 -0.1341527373 0.0553091842 0.0492517887 0.0234834432 -0.0297258602 -0.0171507127 -0.0179867119 -0.0143637337 -0.0072052232 0.0334551750 -0.0691183693 -0.0904977852 0.0039239921 -0.0344970562 -0.0497504529 -0.0005773546 -0.0022249747 0.0028867481 -0.0024117706 0.0726767405 0.0235937329 0.0320104649 0.0530372195 0.0685175437 0.0465664522 -0.0656493958 -0.0003400420 0.0775359999 -0.0646276039 -0.0921632801 -0.0242022183 0.0118726827 -0.0071356657 0.1263961514 -0.1170739109 -0.1121539235 -0.0755289446 0.0518556101 0.0432482098 -0.0566670313 0.0847742978 0.0313819651 -0.1031236977 0.0515389740 0.1359418579 0.0256186066 0.0193622456 -0.0065057078 -0.0208098979 0.0664632793 -0.0446833193 0.1178186162 -0.0744276555 -0.1673153056 -0.0066096333 -0.0061067656 -0.0116822003 0.0037081726 0.0051748233 -0.0004550908 0.0013563528 -0.0246304868 -0.0190694938 0.0277585262 -0.0106062936 0.0103261645 -0.0527798083 0.0218321744 -0.0062751608 -0.0635883675 0.0093232494 -0.0738360383 0.0409579674 0.0796661994 0.1093669098 -0.0285604931 0.0138034494 -0.0211047503 0.0544147005 -0.0383885632 -0.0548206944 -0.0872704485 0.0087720328 0.1084287479 0.0008955969 -0.0083028017 0.0129399776 0.0876409145 -0.0580182418 -0.0222980753 0.0845783001 -0.0579820174 -0.0252299387 -0.0090844731 -0.0141795674 -0.0075741621 -0.0413913792 0.1179641836 -0.0353092610 0.0145530785 -0.1331510354 0.0373318079 0.0108926292 0.0325744261 -0.0275082238 -0.0442020345 -0.0361833520 0.0123931538 -0.0606091561 -0.0567450150 0.0232706791 -0.1257328414 -0.1071989947 0.0235876548 0.0410874327 -0.0000246549 0.0034625122 0.0375948886 -0.0000624282 0.0015562235 0.0947979967 -0.0032569045 0.0350137084 0.0248645548 0.0053399969 -0.0032638385 0.0347101857 0.0020350467 -0.0051732188 0.0495648215 0.0025400659 0.0129024077 -0.0342563453 0.0104932747 0.0061217180 -0.1101163731 0.0315067759 0.0330002928 -0.0805485719 0.0310357245 0.0282463617 0.0136739895 -0.0155569544 -0.0087839919 -0.0132191013 -0.0068523666 -0.0023518884 0.0196800021 -0.0419054942 -0.0524645240 -0.0011978406 -0.0168902255 -0.0262611987 -0.0011182395 -0.0002816204 0.0032310133 0.0077564295 0.0388919078 0.0097955610 0.0078764259 0.0357653926 0.0192461774 -0.0786115095 0.1617615466 0.0224602302 -0.2888193755 0.2387518257 0.2231797608 -0.0148955566 -0.0401708297 -0.0176453005 -0.2201181859 0.1359025117 0.1768992561 0.1372035982 -0.1336829923 -0.1259811336 0.2439398054 -0.1076794674 -0.2339323576 0.2088928764 -0.1698270977 -0.1604799417 -0.0235148929 -0.0112825362 0.0562197766 -0.1810402751 0.0611891832 0.2974762663 -0.1272546980 0.0083146927 0.1921820937 0.0049363255 -0.0036207353 0.0135018922 -0.0031328968 -0.0172656631 -0.0044857440 -0.0484866074 -0.0183372774 -0.0261344919 0.1001007888 0.0708914426 0.0470539313 0.1033104055 0.1631779906 0.2934380992 -0.0633064381 -0.0669612816 -0.0488916994 0.0261179467 0.0695825182 0.1941789203 -0.0460593324 -0.1013861035 -0.1281535691 -0.1234373387 -0.0915054704 -0.1888322320 0.0415090685 -0.0794696418 -0.3040167936 -0.0587639718 0.0929429309 0.0592961928 -0.0009925827 -0.0923122874 0.1256891098 -0.4389759389 0.2020867797 -0.0064551275 0.0047534406 -0.0735574477 -0.0302894055 0.0800775072 0.0280870585 0.0205543082 0.0278217110 -0.4674662419 0.1620163481 0.0457882169 -0.0001467683 0.0100890566 0.0194678921 0.0106514634 -0.0028237804 -0.0391305220 -0.0316787391 0.0076125558 0.0902638019 0.0645927198 -0.0123415392 -0.0105704864 0.0062419742 0.0098169761 0.0263628006 -0.0060883756 0.0052458297 -0.0883274826 -0.0079417154 -0.0182602466 -0.0165896094 -0.0068408851 -0.0114215727 -0.0401444846 0.0043015301 -0.0005853626 -0.0731436595 0.0155724025 -0.0649666955 0.0221546220 0.0018524756 0.0084439057 0.0911575168 -0.0074216966 -0.0153602545 0.0457958568 -0.0137952443 -0.0194853139 -0.0121202153 0.0027887659 -0.0046504770 0.0384189927 -0.0190924898 -0.0181142166 -0.0204302124 0.0433798958 0.0569054598 0.0221437292 -0.0006765557 0.0174026116 -0.0047761651 0.0291897050 0.0159426553 -0.0177171366 -0.0143315101 -0.0000732010 -0.0117543150 -0.0732337208 0.0726409600 0.0058505648 -0.0006397051 0.0025798068 -0.0127595562 0.0103545403 -0.0010513300 -0.0093510762 -0.0035661076 -0.0057505273 0.0132738683 -0.0221065680 -0.0141933502 -0.0098200946 0.0001636542 -0.0032711712 0.0189872951 0.0194507815 -0.0286304148 -0.0072839673 -0.0073432384 0.0303813042 0.0082831180 0.0061816207 0.0089560263 -0.0391992314 0.0402752308 0.0275792701 0.0228963177 -0.0394163155 -0.0336524284 -0.0062772906 -0.0023135830 -0.0074532232 0.0025597022 0.0004012262 0.0005330423 0.0161643545 -0.0110941481 0.0043636057 -0.0178834528 0.0300987818 -0.0116569428 0.1018707014 0.0097216051 0.0881630711 0.0544851292 -0.0488505108 0.0742224208 -0.0633859128 -0.1004561568 -0.1031942925 0.0276515638 -0.0464262730 0.0164593923 -0.1280270622 0.0523150413 0.0800380355 0.1325830335 -0.0075522582 -0.1674412247 -0.0107133827 0.0383115898 -0.0234955174 -0.0800799365 0.0280058251 0.0354559213 -0.2119024827 0.1280736004 0.0092262942 -0.0047259136 -0.0160268983 0.0314380028 0.0311804586 -0.2645112997 0.0666867099 0.0390587002 -0.0162289270 -0.0005404224 0.0096079798 -0.0013805869 0.0097978283 -0.0281685042 -0.0220464679 -0.0025354351 0.0576115714 0.0331489196 -0.0112935993 -0.0756021005 -0.0478953765 0.0048479280 -0.0010778014 -0.0109888089 -0.0292143612 -0.2340147288 0.0197699951 -0.1365009699 0.0876716536 0.0225221683 -0.0156835267 0.1325259552 0.0229001304 0.0281114760 0.1543582530 0.0090214113 0.0040775288 0.2502379507 -0.0154753787 0.1322203471 -0.1247087068 0.0260140258 0.0714822244 -0.2095111465 0.1446622543 0.1102531834 -0.4449277561 0.1258486258 0.0952186464 0.0303200183 -0.0557946569 -0.0609720994 0.0608021406 -0.1390505954 -0.0780327647 0.0314542132 -0.0922722407 -0.0421154916 0.0355410284 -0.0543374121 -0.0361821017 -0.0032969092 0.0079316022 0.0151252872 0.0231061050 0.0276496014 -0.0391491617 0.0665759595 0.1841318052 -0.2194265613 -0.0069398186 -0.0075537607 -0.0093797230 0.0414823252 -0.0352735070 -0.0059041993 0.0270879560 0.0007144059 0.0097026497 -0.0193762467 0.0393690439 0.0228313006 0.0091399515 0.0078911005 0.0147964339 -0.0383134009 -0.0311817921 0.0557739809 -0.0035955368 0.0245405475 -0.0380200148 -0.0149143562 -0.0069671411 -0.0163101366 0.0660506411 -0.0637670680 -0.0514666487 -0.0347681457 0.0665063655 0.0480005345 0.0131751836 0.0000563936 0.0077114923 -0.0034164537 0.0036979702 -0.0002326338 -0.0213482147 0.0137579015 -0.0134790777 0.0064824362 -0.0177523413 0.0127046928 -0.0619492461 -0.0154875871 -0.0707829361 -0.0133537331 0.0481535097 -0.0241694815 0.0448461310 0.0598910255 0.0457865336 -0.0082546490 0.0299293367 -0.0178358717 0.0883201659 -0.0367305383 -0.0694078123 -0.0707377026 -0.0043929391 0.0735902075 -0.0031912568 -0.0266214066 0.0167573589 0.0176079702 0.0134684238 -0.0236659255 0.1211646428 -0.0710398844 0.0192221030 0.0161221005 0.0208511088 -0.0157670596 -0.0231095592 0.1859457113 -0.0505786291 -0.0219597498 0.0861548968 -0.0217854414 -0.0190613139 -0.0251878033 0.0095309381 0.0895507429 0.0373707282 -0.0565505850 0.0171140285 -0.0911945009 0.0327435693 0.2122209453 0.2693010771 -0.0310681429 -0.0875451487 0.0403081682 0.0050313093 -0.0546290269 -0.0151652742 -0.1302379886 -0.3461560270 -0.0290230952 -0.0693590833 0.0773867633 -0.0264487664 -0.0057388972 0.0688897496 0.0216244641 0.1166354301 0.0486025812 0.0454237372 -0.0860506053 -0.0454475990 0.0601040812 0.0960480897 0.0360735601 0.1060862866 0.0740917448 -0.2090918964 0.0968074796 0.0624920610 -0.0188842798 -0.0642664769 -0.0738285200 0.2029895571 -0.1683067276 -0.1361171105 -0.0499260921 0.0971886608 0.1610384090 0.1664416111 -0.1091081148 -0.0309340343 0.0060687547 -0.0203452928 -0.0392268107 -0.0201706801 -0.0176140922 0.0640324126 -0.1268133483 -0.2910741872 0.3641411833 0.0093373065 0.0043624529 0.0117924839 -0.0391468677 0.0345323749 -0.0025317886 -0.0351286007 0.0052556338 -0.0088566622 0.0302213504 -0.0478547746 -0.0326779999 -0.0138055872 -0.0037449663 -0.0174563012 0.0405646471 0.0417039850 -0.0642629274 0.0052916984 -0.0249490147 0.0410536509 0.0181681249 0.0054537973 0.0199449337 -0.0682123707 0.0674277290 0.0511844608 0.0355265708 -0.0825328583 -0.0507687284 -0.0170238937 0.0019887807 -0.0111758820 0.0034099950 -0.0053104993 0.0010254615 0.0284254494 -0.0079753311 0.0211827581 0.0339751403 -0.0086999994 0.0079275252 -0.0504986535 0.0336545162 0.0125291862 -0.0637263163 -0.0009037346 -0.0775492831 0.0371000024 0.0728095309 0.1133473777 -0.0358680034 0.0128690905 -0.0250017365 0.0514103135 -0.0419352844 -0.0601326153 -0.0905941719 -0.0092327614 0.0673028380 0.0131668665 -0.0064623809 0.0311273896 0.0656873871 -0.0555149643 0.0210199298 0.0473163846 -0.0419727094 -0.0194799935 -0.0016337237 -0.0047823901 -0.0378141684 0.0375885212 0.1441606861 -0.0155536434 -0.0636671255 -0.0394053620 0.0253784857 -0.0045321497 0.0017086446 0.0130834137 0.0443697824 0.0034831990 0.0026987787 0.0164740523 -0.0096167939 -0.0010973987 -0.0657487840 -0.0856576617 0.0209092020 -0.0328060836 0.0352096419 -0.0371670602 0.0843003331 -0.0019955995 -0.0445317098 -0.1360796744 -0.0152783159 -0.0436413806 -0.0021512679 -0.0267803917 0.0399187379 0.1184414533 -0.0178132157 0.1654159528 0.0552255013 0.0094899153 0.0426272139 -0.0092276426 0.0248673833 -0.0237047779 -0.1008076415 -0.0442520702 0.0024581599 0.0861729982 0.0214281064 0.0519036482 0.0041923549 -0.0182860154 0.0142317053 -0.0280657464 0.0672816023 0.0290738829 0.0069340714 0.0193882068 -0.0358923754 0.0284704683 -0.0487225676 -0.0699220356 -0.0009236089 0.0042711760 -0.0019713516 0.0104081767 -0.0089214646 0.0103228293 -0.0924155972 -0.0506839155 0.0301238827 -0.0410100418 -0.0238869622 -0.0279317494 0.1632442658 -0.1346495445 -0.0353869421 0.0814329022 0.0464830996 0.0556126772 -0.0741113862 0.1776745847 0.0852560116 0.0640244966 0.0390572779 0.0375709290 -0.1175860494 -0.1543445233 0.1771151339 0.0281723388 0.1111495381 -0.2468770281 -0.0894257151 -0.0422216550 -0.0490111669 0.2601732955 -0.2997327499 -0.1486417795 -0.1577608887 0.3070111324 0.2284715221 0.0857143487 -0.0064318558 0.0396835582 -0.0190584443 0.0150358209 -0.0035934958 -0.2766590371 0.0833714798 -0.1931100594 -0.0020236602 0.0137868513 -0.0607635833 0.0532275964 0.0630778282 0.1552747279 -0.0971981764 -0.1616860614 -0.0889444472 -0.1145736810 -0.1093821058 -0.0193242099 -0.0465008842 -0.0424173746 0.1153105090 -0.2420200290 0.1616894335 0.3896386128 0.0765136594 0.1287914699 0.1103688912 0.1505901748 0.0402246852 -0.0541183045 0.4297059680 -0.3546949399 -0.0213191179 -0.0947269948 0.0488938980 -0.2319414925 -0.1278311019 0.0222036890 -0.0445437850 -0.0355111397 0.0076394262 0.0198466565 -0.0725944526 -0.2057936626 0.0332015182 0.0652831982 -0.0058537765 0.0080650433 0.0370595359 -0.0103184961 0.0007572402 -0.0175414851 -0.0477369393 0.0087364780 -0.0171107496 -0.0412853223 0.0119037562 -0.0244237397 0.0363940439 -0.0283580936 0.0944974768 -0.0028290421 -0.0419301555 -0.1404450209 -0.0214628464 -0.0350347160 -0.0066268896 -0.0275533368 0.0292067055 0.0788504995 -0.0115237531 0.1438443725 0.0238908459 0.0146858977 0.0102041093 -0.0019408050 0.0231633583 -0.0182214118 -0.0578744482 -0.0407954286 -0.0034615936 0.0839608617 0.0176364690 0.0417232841 0.0002805289 -0.0153561523 0.0109005127 -0.0139345190 0.0498331595 0.0198904186 0.0003403393 0.0306572094 -0.0148751321 0.0293090370 -0.0426246261 -0.0572721803 -0.0098174195 0.0026620644 -0.0047964788 -0.0286725685 0.0087284191 0.0042118392 -0.0017085276 -0.0489036855 0.0810913923 0.0081555049 0.0045276027 0.0032077076 -0.0297430036 0.0236808065 0.0101167185 -0.0094461080 -0.0152676215 -0.0122563900 0.0093186362 -0.0315193858 -0.0113253385 -0.0139647732 -0.0097612604 -0.0036169306 0.0173182026 0.0292972767 -0.0259523356 -0.0136293960 -0.0204638697 0.0530935849 0.0192566727 0.0094647020 0.0061263233 -0.0404231509 0.0554204110 0.0136362567 0.0272378811 -0.0578721996 -0.0417118505 -0.0193260881 0.0032147785 -0.0072764677 0.0043466205 -0.0026774584 0.0006047121 0.0502220678 -0.0178900030 0.0350127299 0.0059108551 0.0004130661 -0.0176447461 0.0020277670 0.0244384861 0.0456153605 -0.0436644273 -0.0485686531 -0.0449206996 -0.0262677197 -0.0170259699 0.0179905945 -0.0227987193 -0.0078082679 0.0314240191 -0.0573087497 0.0420480151 0.1136138630 0.0008929945 0.0403023420 0.0553122449 0.0551909963 0.0084122212 -0.0084766381 0.1550024663 -0.1234950882 -0.0034150103 -0.0149725593 0.0026967060 -0.0787442593 -0.0404266576 0.0127293848 -0.0235217957 -0.0053224719 0.0589469301 -0.0016237690 -0.0487608475 -0.0241814482 0.0015424321 0.0066189311 -0.0199224727 0.0190099858 -0.0656941907 0.0067153541 -0.0416216187 -0.0394312424 -0.0879357046 0.0690008928 0.0791512866 0.2116363904 -0.0278002466 0.0396430993 -0.0660840316 0.1167241799 -0.1205098227 -0.0170183654 0.1260395346 0.2012954260 0.0016360276 0.1388656534 0.0057273758 0.0472410150 -0.1209200327 -0.2747186931 0.0485752251 -0.3509771588 -0.1467030128 0.0122732886 -0.1826307990 0.0341598204 -0.0396732485 0.0855446354 0.2722233236 0.1367363473 0.0174107564 -0.1950593855 -0.0403439115 -0.1230536274 -0.0256388623 0.0287430701 -0.0537327298 0.1391683934 -0.2014974695 -0.1116661848 -0.0452937049 0.0107195733 0.1574749121 -0.0028657986 0.0819738403 0.1628080880 0.0009100419 -0.0034957133 -0.0140734806 0.0297931301 0.0250455801 0.0354379039 -0.0471261075 -0.0020955071 0.0479844033 -0.0196619951 -0.0178177774 -0.0033894362 0.0850922520 -0.0659306919 -0.0443731711 0.0089826171 0.0561937330 0.0367068425 -0.0048839476 0.0723690480 0.0111729491 0.0301339080 0.0351710788 0.0023394054 -0.0265558034 -0.0601662167 0.0342610813 0.0333594243 0.0614843671 -0.1479295192 -0.0460006497 -0.0294913102 -0.0034679248 0.0854456665 -0.1303668890 -0.0225874526 -0.0678244752 0.1239839940 0.1084351403 0.0446974242 -0.0061296522 0.0093826694 -0.0098191536 0.0073402961 -0.0002174375 -0.1308830762 0.0389749111 -0.1002363203 0.0214871835 -0.0072427029 0.0012190932 -0.0323742953 0.0222834185 0.0119654588 -0.0430336738 -0.0075451747 -0.0536385172 0.0199157860 0.0424556444 0.0720764516 -0.0273837324 0.0091643217 -0.0095910957 0.0261734590 -0.0176700749 -0.0137298735 -0.0586521327 -0.0078736054 0.0366666902 0.0230209212 -0.0050533822 0.0220884358 0.0510444612 -0.0440470286 0.0240377547 0.0312982824 -0.0304116775 -0.0272044774 -0.0060004833 0.0094971472 -0.0346582733 0.0410422379 0.0928913320 -0.0038438050 -0.0690412425 0.0344425073 -0.0022077272 -0.0127491310 -0.0194762882 0.0180315529 -0.0074886460 0.0387703294 -0.0047532707 0.0939354605 0.1204838646 -0.0306779515 0.0485759005 0.0693290544 -0.0155083243 -0.0023105781 -0.0246999269 0.0069169389 -0.0813582745 0.0054389066 0.0241549517 0.0637385987 0.0251830703 -0.0045026267 0.0121001160 0.0227233722 -0.0078025587 -0.0143973398 0.0061849060 -0.0759612872 0.0093298917 -0.0200540099 0.0293700484 -0.0072733719 -0.0183575831 0.0118151489 0.0228857398 0.0289132035 0.0050899408 -0.0770453170 -0.0088286105 -0.0213733896 0.0042209164 0.0096159687 -0.0071693282 -0.0003999742 -0.0342440046 -0.0101767952 0.0054856386 -0.0313592078 0.0026498688 -0.0267734237 0.0300477621 0.0349899319 0.0019419662 0.0105678455 0.0073437002 0.0036358421 -0.0519715329 0.0008695601 0.0162473905 -0.0160558305 -0.0402877925 0.0107597758 0.0705212847 -0.0725016462 -0.1453023163 0.0791352771 0.2607089991 0.2132927132 -0.2926479679 -0.1054695707 -0.2325105816 0.0345413950 0.2123591375 -0.0041171875 -0.1628661803 0.1175531599 -0.1367328260 -0.0845564989 0.2954623686 -0.2068379794 -0.0953588066 0.3413198968 0.0481404207 0.1110603656 -0.1437199031 0.1224473563 0.0702206879 -0.2237219861 0.0975811075 0.0604418748 -0.2217625356 -0.0335221456 0.0177685362 0.0835071411 0.0082216951 -0.0097669152 -0.0223207530 -0.1679799180 -0.0375473980 -0.0464428553 -0.0403701143 0.0146955210 -0.0021768245 0.0691845969 -0.0416331823 -0.0144779069 0.0837580122 0.0135675446 0.1041101590 -0.0362905357 -0.0772911031 -0.1361091809 0.0528407680 -0.0190687620 0.0144130524 -0.0468194941 0.0288731658 0.0174475353 0.1149793246 0.0179115491 -0.0720042490 -0.0479770229 0.0109145122 -0.0395309549 -0.1063125386 0.0889403169 -0.0411370973 -0.0690060882 0.0647189720 0.0620002719 0.0127569189 -0.0204188578 0.0762573635 -0.0759741224 -0.2239758116 0.0210898276 0.1367286670 -0.0258890347 -0.0108366440 0.0216655545 0.0377970162 -0.0317047159 0.0171708615 -0.1130397155 -0.0259916095 -0.2424326364 -0.4442354980 0.1640712572 -0.1575840440 -0.1342624570 0.0384578616 0.0008237719 0.0610865488 0.0451428855 0.2387819093 -0.0351256979 -0.0205401069 -0.1558801727 -0.0970782285 0.1096669601 -0.0334325820 -0.0630267754 -0.0430028490 -0.0873994812 0.0069666153 0.1067996563 -0.0750783525 0.0864153902 -0.2041049629 0.0441682874 0.0543410088 0.0157603101 0.0540236407 -0.0127570736 0.0075152465 0.1613562590 0.0216834502 0.0189536763 -0.0339991501 -0.0274820880 -0.0113315945 0.1018528951 0.0006794898 -0.0392425182 -0.0533291674 0.1368056967 0.0967944862 0.1214506406 -0.0814060331 -0.0452262565 0.0000756340 -0.0331645310 -0.0341262627 0.0135836889 0.1657787044 0.0234456987 -0.0065564976 0.0621147962 0.1511015295 -0.0024870967 0.0181990833 -0.0262811678 -0.0223438852 0.0056665895 0.0751460933 0.0768521639 -0.0834237722 -0.0247355167 -0.0809664807 0.0355776552 0.0763044026 0.0078690239 -0.0433448816 0.0409171875 -0.0521099247 -0.0507226139 0.1072601355 -0.0564594027 -0.0155388660 0.0769718017 0.0014775742 0.0276891026 -0.0497555063 0.0626361559 -0.0142668956 -0.0765418399 0.0248307272 0.0727713006 -0.0489852958 0.0058129136 0.0010706796 0.0362380487 -0.0023926610 -0.0013696063 -0.0099754521 -0.1221056059 -0.0094968127 -0.0665280190 0.0546058019 -0.0114290683 -0.0079714082 -0.0456650876 0.0670448521 0.0765193499 -0.0862548745 -0.0474092136 -0.1164905947 0.0282129569 0.0800926704 0.1695345942 -0.0694566229 0.0088063225 -0.0146383482 0.0204806564 -0.0447401290 -0.0408446326 -0.1198378482 -0.0752856685 -0.0339526612 0.0587332478 0.0011574091 0.0535549141 -0.0992632013 0.0096870006 0.1657300519 0.0300010362 -0.0392251137 -0.0609189082 -0.0015081966 0.0114635807 -0.0435924040 0.1763931532 -0.1287497172 0.0877778250 -0.2092375032 0.3868039077 -0.0900270942 -0.0413220658 -0.0596245603 0.0493652137 0.0126041867 -0.0481158420 -0.0295104761 0.1250495403 -0.0423510862 0.0254995500 -0.1151763414 -0.0269110804 0.0242578432 -0.0251517833 0.0404448407 0.0275061152 0.0421883286 -0.0141618195 -0.0651661865 0.0817389356 -0.0695570748 0.1847303858 -0.0157538997 -0.0629090453 -0.0335405899 -0.1524159251 0.0061831332 0.0480749884 0.1277465418 0.0689159296 -0.0694177323 0.0369157944 0.0604566762 0.0158029548 -0.0099394249 0.0060111009 0.0281731388 0.0719967417 0.0643854556 0.0577447960 -0.0352859275 -0.0342667120 -0.0082021585 0.1006129299 0.0142661824 -0.0336189245 -0.0492122447 0.1250219835 0.0543253897 0.1232272595 -0.0942765197 -0.0608481818 0.0029874648 0.0212445265 0.0176491848 0.0029637018 0.0168777994 -0.0295755510 0.1702057214 0.3581163696 -0.4047980786 0.0074053401 0.0003781228 0.0105945276 -0.0195122435 0.0200997185 -0.0113481680 -0.0291367237 0.0073867698 -0.0042967937 0.0267257031 -0.0340704294 -0.0257923754 -0.0124891710 0.0011256675 -0.0155065344 0.0049913774 0.0423926018 -0.0223656016 0.0127024164 -0.0202291537 0.0230845469 0.0152043982 -0.0029757432 0.0099376872 -0.0199719770 0.0260030456 0.0050359039 -0.0146322602 -0.0400410853 0.0217728151 -0.0154066917 0.0064023465 -0.0108895301 0.0012326022 -0.0049412580 0.0023202391 0.0937061000 -0.0043765952 0.0681980928 -0.0446073698 -0.0009157117 0.0123283945 0.0231105938 -0.0692975370 -0.0882053769 0.0670545578 0.0567090206 0.0891168243 0.0016501270 -0.0359450981 -0.1242753530 0.0581901395 0.0098674181 -0.0014522199 0.0293438501 0.0405003775 0.0367969932 0.0523917612 0.0469968161 0.0736331285 -0.0446444539 -0.0127627462 -0.0303571249 0.1573055329 -0.0429112373 -0.1633248262 -0.0540700695 0.0421927610 0.0813371606 0.0050874806 -0.0001922631 0.0002458196 -0.1113181303 0.2811979274 -0.0924478277 0.1461709645 -0.3663039832 0.0917758331 0.0085404886 0.0040103395 -0.0060783410 -0.0057211354 0.0138604546 0.0066577831 0.3381082223 0.2938600554 -0.0856991375 -0.1327162407 -0.0365444178 0.0412627772 -0.0270355158 0.0232771218 0.0194788519 -0.0450779087 -0.0014598147 -0.0587349979 0.2490960152 -0.0558207355 0.2407166030 -0.0211994303 -0.0648614785 -0.0369731207 -0.2366298721 0.0100661324 -0.0021950401 0.2362748102 0.0580401058 0.0023481419 0.0473944451 0.0679226803 0.0134485323 -0.0278936701 0.0100265757 0.0349599299 0.0471591827 0.0902650180 0.0798344062 -0.0424777243 -0.0380947913 -0.0039527177 0.1154426035 0.0290768951 -0.0319735636 -0.0546005162 0.1357044729 0.0356000895 0.1375050745 -0.1080977244 -0.0713460004 -0.0016595066 0.0209650261 0.0222862047 -0.0143560810 -0.0665007996 -0.0017889662 0.0387898720 0.0286188288 -0.1017337874 -0.0019418303 -0.0005273109 -0.0022298799 0.0058325710 -0.0056915839 0.0014228377 0.0059286571 0.0001640647 0.0018121008 -0.0053572291 0.0075185687 0.0048009062 0.0036539248 0.0006141122 0.0036968165 -0.0000504257 -0.0090071052 0.0040760320 -0.0060816957 0.0095625240 -0.0142994633 -0.0055849002 0.0018888044 -0.0010852705 0.0069896070 -0.0090200859 0.0065121627 -0.0072320469 -0.0058783887 -0.0020630949 0.0042415329 -0.0044593188 -0.0001337324 0.0010975290 0.0047266380 0.0004304131 -0.0101786579 -0.0060166065 -0.0145215479 0.0326171420 0.0274843414 -0.0236582104 0.0265479137 0.0833179347 0.1259260544 -0.0472887963 -0.0945496620 -0.0538670504 -0.0624282829 -0.0399969222 0.0629745223 -0.0461510951 -0.0414735955 0.0292420514 -0.0996999048 -0.0748294485 -0.1048166212 0.0364887569 0.0225540223 -0.0598443307 0.0173162981 0.0218571272 0.0018009847 -0.2224987466 0.0814372581 0.1458689926 0.2177296174 -0.1225192762 -0.1422527085 -0.0026802956 -0.0043592030 0.0295617690 0.0166778103 -0.2887928010 0.0537157062 -0.0420558455 0.1883089618 -0.0450111460 0.0328136420 0.0838249796 -0.0572939306 -0.0359150343 0.0339870276 0.0395920816 0.0635350635 0.2031803252 -0.0719557895 0.0101105452 -0.0162979248 0.0066243084 0.0250927734 -0.0175771920 -0.0055727047 -0.2074054134 0.0212714283 -0.0797415312 0.1906632144 -0.0027219533 0.0711096828 -0.0120284713 -0.0323221747 0.0051887112 -0.2293471353 -0.0021649832 -0.0888393113 0.1512117223 0.0343447810 0.0390206016 0.0258583165 0.0495201532 -0.0217061819 0.0010928199 -0.0655617702 -0.0222867225 -0.0253571023 0.1073260692 0.1108832287 -0.0203262358 -0.0337490844 0.0214258492 0.0372662227 0.0897000221 0.0214749964 -0.0209718235 0.0922122613 -0.0389908828 0.0743612770 -0.0913067771 -0.0918023360 -0.0029985581 -0.0418415333 -0.0267918106 0.0096729152 -0.0163330348 0.0031274797 -0.1443583883 -0.3085822683 0.3238358369 -0.0229802946 -0.0098572315 -0.0166647798 0.0596080606 -0.0589677056 0.0009001513 0.0480803509 0.0194844624 0.0273641583 -0.0343829928 0.0807709899 0.0313406468 0.0297597255 0.0119236764 0.0202150032 0.0490755761 -0.0890729417 -0.0287818087 -0.0579909128 0.0665410707 -0.0022821233 -0.0116208575 -0.0004523479 0.0002117203 -0.0572205409 0.0156684482 0.1010354728 0.0913696990 -0.0192768038 -0.1257853160 -0.0030941196 -0.0012167283 -0.0022896518 0.0010646970 -0.0003115999 -0.0002825140 -0.0104256506 -0.0109174623 -0.0121300687 -0.0112383425 -0.0056859988 0.0054431994 0.0007847471 -0.0231298352 -0.0289061320 0.0166115499 0.0246768178 0.0199766706 0.0144452180 0.0078142502 -0.0245148759 0.0147881818 0.0093473130 -0.0084495323 0.0232098892 0.0218425119 0.0291504136 -0.0064926453 0.0049506629 0.0340454255 -0.0028256129 -0.0029439853 -0.0009551934 0.0811759869 -0.0353285238 -0.0445399117 -0.0783152631 0.0445336866 0.0378206958 0.0013708149 -0.0036080479 -0.0088539245 -0.0130179180 0.1347946573 -0.0248164866 0.0036524697 -0.0233888629 0.0005466015 -0.0161281870 -0.0446801537 0.0308061941 -0.0462240897 0.0009106397 -0.0076120354 -0.2784928325 -0.1899525693 0.0595323546 0.3464865580 0.2534142076 -0.0848936240 0.0786892708 -0.0220426647 -0.0076986483 -0.3820870241 0.0302113990 -0.2310401671 -0.0390408813 0.0326305330 -0.1264975807 0.0093243091 -0.0247438431 0.0512843746 -0.2615438477 -0.0049850758 -0.1201385508 -0.0377036843 0.0308068168 -0.0307417162 0.0023097134 0.0551185929 -0.0687127602 0.0889560912 -0.2119665103 -0.1196312983 -0.1054554865 0.1697167080 0.1950446862 -0.0004777749 -0.0485966863 0.0578008952 -0.0493587818 0.1973841503 0.0939792343 0.0070232465 0.0898706466 -0.1077720803 0.0458052823 -0.1236817868 -0.1688197908 0.0030440400 0.0139255579 0.0038774739 0.0183830299 0.0264458659 0.0107011835 0.0155763648 0.0719468117 -0.0478232304 0.0159295069 0.0086759320 0.0091235208 -0.0414538008 0.0409040651 0.0051819578 -0.0266974110 -0.0199865780 -0.0212910056 0.0172040748 -0.0536647875 -0.0155700290 -0.0191292906 -0.0098735019 -0.0098367966 -0.0374300740 0.0539023876 0.0281164813 0.0508135145 -0.0490839488 -0.0150840346 0.0016020745 0.0015697833 -0.0009181320 0.0488930717 -0.0199243191 -0.0848658625 -0.0512897842 0.0340734544 0.0758820054 0.0103381211 -0.0001214523 0.0050776468 -0.0027304781 -0.0008784455 -0.0006665457 -0.0324918753 0.0216788339 -0.0143604158 -0.0072755803 -0.0234634329 0.0150592680 -0.0426661871 -0.0386409520 -0.0745322323 0.0084312268 0.0572439578 0.0034732847 0.0492505707 0.0422235108 -0.0008330036 0.0126327480 0.0294856083 -0.0175708942 0.0644144582 0.0497515178 0.0863796452 -0.0377669664 -0.0468315583 -0.0240822562 0.0022682769 -0.0130219756 0.0060415734 0.0957965581 -0.0365341407 -0.0494734857 -0.1290106035 0.0699416928 0.0762718731 -0.0089877819 0.0134214550 -0.0132958441 0.0212156522 -0.0123336716 0.0099976690 -0.0061063658 -0.0327050916 0.0086359518 -0.0067572545 -0.0317875142 0.0133139558 0.0000093846 -0.0121976248 -0.0116579339 -0.0573382744 -0.0750273007 0.0196529174 0.0803651882 0.0769438212 -0.0163312512 0.0084478951 0.0042129574 -0.0011526636 -0.0212022277 0.0007290454 -0.0365761674 -0.0560937481 0.0051589904 -0.0386539440 0.0047904596 -0.0002437585 0.0094982501 0.0037498309 0.0004412761 0.0097963742 -0.0443813785 -0.0026803536 -0.0175094610 -0.0061712567 0.0008192439 -0.0087738398 0.0145472112 -0.0274100844 -0.0180182985 -0.0062185655 0.0073185889 0.0124470149 0.0045154313 -0.0021031396 0.0062849438 -0.0187404877 0.0183634144 0.0134860514 0.0060987065 -0.0033091018 -0.0112659793 -0.0063360759 -0.0046383927 -0.0137040356 0.0014261138 0.0118312521 0.0074280960 -0.0087471332 0.0071788786 0.0032327549 0.0666086155 0.1021770751 -0.0934408660 -0.0764664777 -0.0362918400 -0.0472494010 0.1884962290 -0.1899154572 -0.0071690041 0.1360288336 0.0864693329 0.0980066701 -0.0976150576 0.2598396119 0.0890972925 0.1006107950 0.0353278329 0.0537559180 0.1589113999 -0.2625286164 -0.0944618070 -0.2541106649 0.2395084062 0.0476623231 -0.0160793053 -0.0042963100 -0.0048522429 -0.2254116192 0.0874574227 0.3669086968 0.2701711676 -0.0808440268 -0.3691035750 -0.0287917825 0.0015546881 -0.0171816678 0.0036279936 -0.0056408786 0.0018619157 0.0682965989 -0.0144814962 0.0491188144 0.0103442812 -0.0772169374 0.0442651124 -0.1917846668 -0.0727775610 -0.2081772352 -0.0282019901 0.1566051703 -0.0608189344 0.1497057701 0.1354912453 0.0737306389 0.0003501860 0.0859472407 -0.0388894035 0.1753247495 0.1458400090 0.2942011870 -0.1089453972 -0.2013335103 -0.2532312446 0.0208152401 -0.0272340659 0.0189609837 0.1385577722 -0.0573732236 -0.0474522385 -0.3293557733 0.1814066808 0.1821862059 -0.0421316400 0.0328445724 -0.0157717762 0.1176803747 -0.4677945244 0.1168618609 -0.0631142746 -0.0326556951 0.0289926766 0.0409947036 0.0352556194 -0.0154150286 -0.0063559532 0.0138153277 0.0164790934 0.0232113060 0.0699161348 -0.0220438257 -0.0479459331 -0.0582134385 0.0115024181 0.0000409567 -0.0088893507 -0.0022957071 -0.0254246253 0.0037653368 0.0144057824 0.0691176165 -0.0020810086 0.0300218687 -0.0050665026 -0.0030106140 -0.0047372573 -0.0480489957 0.0031711731 -0.0226927056 0.0522769760 -0.0032110950 0.0291565286 0.0088581783 0.0073680730 -0.0007932193 -0.0023505367 -0.0012070433 0.0021880217 -0.0148817766 0.0203700092 0.0179931931 -0.0063645392 -0.0045906929 0.0022384054 0.0157582376 0.0103510350 -0.0009141084 -0.0065012281 0.0130101426 -0.0046555655 0.0192733220 -0.0154231030 -0.0104350720 -0.0057977690 -0.0234889185 -0.0180182580 0.0027727487 0.0032208498 -0.0066155451 -0.0791770129 -0.1453617708 0.1532031026 0.0144071209 0.0068487254 0.0072657337 -0.0323277538 0.0334499813 0.0020182417 -0.0210884488 -0.0203262101 -0.0195698537 0.0161580826 -0.0471862643 -0.0150508266 -0.0212109645 -0.0045663257 -0.0078915949 -0.0222376745 0.0426165678 0.0078533974 0.0588914232 -0.0497016090 -0.0116501647 0.0015148469 0.0009184193 0.0035436025 0.0427460402 -0.0165889489 -0.0714458875 -0.0416337857 0.0119068119 0.0576074574 0.0050602943 -0.0014609048 0.0024950090 0.0002653424 0.0022899419 -0.0004184343 -0.0139868499 -0.0057009918 -0.0149776735 0.0017000574 -0.0013883333 0.0001494218 -0.0028968045 0.0004697171 0.0000561768 -0.0039334069 -0.0005830463 -0.0049647516 0.0024763716 0.0029904892 0.0052128442 -0.0017190182 -0.0003339859 0.0015363301 -0.0079607187 0.0066932658 0.0124829939 -0.0037533309 -0.0138294711 -0.0165205938 0.0020640168 0.0001315307 -0.0020947788 -0.0179108267 0.0115719738 0.0055055880 0.0133568935 -0.0080385063 -0.0107410348 -0.0008975105 0.0035921261 0.0008435949 -0.0004983380 0.0064644604 0.0011748430 0.0103786928 -0.0042237344 -0.0025475586 -0.0004271076 -0.0050843538 -0.0018793415 -0.0082654783 -0.0094922674 0.0005106486 0.0005184681 0.0047356700 -0.0082639171 0.0613056907 0.0602230078 -0.0070774921 0.0047985812 0.0094882104 -0.0039177832 -0.0221007522 0.0039418338 -0.0413859777 0.0130629184 -0.0068577697 0.0150860526 -0.0034039253 -0.0096728163 0.0021758857 0.0269975888 -0.0034244143 0.0475556268 -0.0033401174 0.0011470947 -0.0077182373 -0.0029095752 -0.0020636210 0.0043947096 -0.0457748362 0.0262397965 0.0215283291 0.0678956566 -0.0353136021 -0.0339556310 0.0007617493 0.0075257475 -0.0073464919 0.0042169602 -0.0272438189 -0.0120369674 0.0008848922 -0.0158215281 0.0090466101 -0.0055681884 0.0162419061 0.0179432293 0.0003834696 0.0022966378 0.0013734796 -0.0046351521 0.0007415551 0.0065889713 0.0104061343 0.0345626636 -0.0304027364 0.0303596466 0.0522902634 -0.0228999321 -0.0310909669 0.0526434868 0.1056131845 0.1026208545 -0.1827757134 -0.0776799240 -0.0341270419 -0.1369920992 0.0020433488 -0.0363245804 -0.0056188526 0.0881870182 0.0227450865 -0.0426743600 0.0150657914 0.4147420680 -0.1358813357 -0.5555017293 -0.0871270058 0.0099942968 0.0641215337 0.0887285107 -0.0980231369 -0.0926390266 0.3285263107 -0.0676948808 -0.4588360886 0.0208157043 -0.0101093851 -0.0500309560 -0.0036805101 0.0027618626 0.0085426566 0.0769947386 -0.0051045320 -0.0119999202 -0.0008919186 -0.0008437214 0.0004257983 -0.0012041812 -0.0012838347 -0.0017876283 0.0017757456 0.0036178026 0.0015072360 0.0017365770 0.0013898514 -0.0015724608 0.0010025862 0.0011997229 -0.0015728413 0.0044061947 0.0026233222 0.0053916811 -0.0005397661 0.0033568058 0.0053642735 0.0015707222 0.0014052843 0.0003784130 0.0167696701 -0.0135363843 -0.0012270386 -0.0225392642 0.0146826416 0.0094262874 -0.0009125939 -0.0043336755 0.0002027316 -0.0019608672 0.0093085333 -0.0012613212 -0.0106777698 0.0227277437 -0.0073446661 -0.0014188783 -0.0060831810 0.0043761736 -0.0362105574 0.0028817737 0.0221854758 -0.1615524061 -0.0433556398 0.0039297121 0.2733717503 0.1609790043 -0.0523962394 0.0436134040 0.0163009604 -0.0326122251 -0.2811330041 0.0329202935 -0.2372975628 0.1831005400 -0.0205775685 0.0752816821 -0.0379521643 -0.0608292523 0.0174650619 0.0301858850 -0.0258994074 0.1932221632 0.1324769276 0.0027388100 0.0582878964 0.0058270063 -0.0018091534 0.0271876815 -0.3880616730 0.2132654123 0.1799398091 0.4512518232 -0.2071577722 -0.2026123930 -0.0089914418 0.0445817575 -0.0519116205 0.0711506969 -0.1749952142 -0.0944617087 -0.0106389217 -0.0784829481 0.0648006963 -0.0032565072 0.0914302662 0.1220234839 0.0006272904 -0.0000855688 -0.0020416094 0.0120438260 0.0099566123 0.0040578427 -0.0218638910 -0.0207710466 0.0337260711 -0.0033960565 -0.0061836007 0.0025226650 0.0015262037 -0.0050932585 -0.0116552251 -0.0133403281 0.0223719484 0.0087897346 0.0025895704 0.0175113443 0.0017734172 0.0044975653 -0.0008459289 -0.0113879151 -0.0033256177 0.0061665284 -0.0009536108 -0.0541665286 0.0157663198 0.0733320357 0.0102479240 -0.0003869609 -0.0081848159 -0.0081688692 0.0126387154 -0.0019199728 -0.0409847935 0.0215372560 0.0625468861 0.0014910317 0.0009956309 0.0068855143 -0.0011828897 -0.0023365770 -0.0008603860 -0.0252381151 0.0221143710 -0.0008734989 0.0325949267 -0.0439270970 0.0179055305 -0.1281476448 -0.0012580978 -0.0628533659 -0.0639806683 0.0459169366 -0.0905098125 0.0695488357 0.0648250317 0.1031780212 -0.0304737647 -0.0021653632 0.0218990099 -0.1031273031 0.1854158059 0.4031727202 -0.0090951010 -0.2516006011 -0.4524804104 0.0209148103 0.0272251822 -0.0598596925 -0.3028216953 0.1993737785 0.0710026328 0.1520417296 -0.0797532045 -0.1978091581 0.0156656715 -0.0166091346 0.0409518174 -0.1535925377 0.2991117352 -0.0917513238 0.1385559357 -0.0928815302 -0.0033073229 -0.0057403222 -0.0007795015 -0.0083205061 -0.0121675867 -0.0151337409 -0.0059152094 0.0825488110 0.0577473591 -0.0251446098 0.0117400137 0.0684107944 0.0103220073 0.0082511990 0.0263127930 0.0159125402 -0.0627799202 0.0067948050 -0.0961554472 -0.0052703745 -0.0259714693 0.0590358405 0.0104763608 -0.0122309660 -0.0037485527 0.0881421356 0.0010956612 0.0986084442 -0.1486201902 0.0115140940 -0.1195223991 -0.0129107950 -0.0061482016 -0.0033604787 0.0490281209 -0.0419964865 -0.0279640541 -0.0042399958 -0.0143365454 -0.0150665371 0.0081020735 0.0030349282 0.0056813296 -0.0283109058 0.0043375767 0.0140601383 0.0104692632 -0.0151298851 -0.0135850888 -0.0207292768 0.0068904995 -0.0086615857 0.0008230339 0.0070501945 0.0066104487 -0.0022962038 -0.0078454064 0.0098815107 0.0210281350 0.0330053329 -0.0313271579 -0.0011595774 -0.0027689536 0.0015578228 -0.0013877239 -0.0008200050 -0.0048166437 -0.0075264898 0.0121019808 0.0043338254 0.0012413581 0.0081234109 0.0016953269 0.0048245405 -0.0008952776 -0.0049340183 -0.0123243791 0.0056195111 0.0146285661 -0.0251880857 0.0112123765 0.0201162592 0.0010636650 0.0007145050 -0.0054301498 0.0012266772 -0.0030012240 0.0111986486 -0.0234753196 0.0034062944 0.0257249567 0.0022830309 -0.0038310935 0.0063921867 0.0008591126 0.0036613588 -0.0016708282 -0.0211130716 -0.0127149616 -0.0152095922 0.0072224399 -0.0150381654 0.0066088205 -0.0366867431 -0.0043782761 -0.0194307578 -0.0109919958 0.0222890334 -0.0193342499 0.0265766260 0.0273485017 0.0307698186 -0.0072875382 -0.0027465454 0.0005248616 -0.0349538219 0.0737102933 0.1578994536 -0.0036687272 -0.0705797453 -0.1251180394 0.0110880632 0.0138058112 -0.0206174105 -0.0866543295 0.0594757878 0.0216691500 0.0044683022 -0.0028318512 -0.0679650497 0.0108662680 -0.0238996198 0.0157135055 -0.0709916600 0.2065530464 -0.0509602791 0.0307891927 0.0299188383 -0.0256450595 -0.0125290815 -0.0243708493 0.0086566217 0.0392442812 0.0384956229 0.0095007338 -0.2558769984 -0.2168231624 0.0950692946 0.0326933814 -0.1557789472 -0.0456845979 -0.0243082347 -0.0713658799 -0.0505223019 0.2083335898 -0.0224593991 0.2762863962 -0.0080360003 0.0772441689 -0.1857947359 -0.0353038360 0.0354494583 0.0099136606 -0.2575539559 0.0043415003 -0.2627526082 0.4375744066 -0.0528997533 0.3709655489 0.0432418239 0.0169528334 0.0083541762 -0.1557380638 0.1297582298 0.0869017833 0.0062102544 0.0464085623 0.0487626617 -0.0245468638 -0.0093541592 -0.0174588892 0.0816383019 -0.0106305976 -0.0414485422 -0.0329599712 0.0511461779 0.0474121486 0.0597142237 -0.0189842701 0.0288692003 0.0016447190 0.0123210051 0.0098503910 -0.0043642449 0.0128806168 -0.0123896413 -0.0008941309 -0.0128387190 0.0147503587 -0.0006495144 0.0014693930 -0.0017285707 0.0030004562 -0.0022363378 0.0051304747 0.0076056935 -0.0053120321 -0.0004227955 -0.0028745383 -0.0013232726 0.0009289050 0.0010464595 -0.0001862602 0.0054573460 0.0049318294 -0.0047665736 -0.0003447043 0.0074053771 0.0023039923 -0.0246095332 -0.0013133185 -0.0021410843 0.0016886276 -0.0139084594 0.0074724829 0.0021471933 0.0281401932 0.0091685241 -0.0269786012 -0.0024230408 0.0016209113 -0.0033893832 -0.0004392836 -0.0019985230 0.0008297926 0.0137709551 0.0093648492 0.0119812539 -0.0003861790 0.0002583102 -0.0000551888 0.0016395025 -0.0007935224 -0.0001037846 -0.0004206412 -0.0006675824 -0.0000431799 0.0001294669 -0.0004222701 -0.0019168487 0.0007095612 0.0004909329 0.0004067058 0.0014134913 -0.0019238564 -0.0048152915 0.0010385756 0.0002952237 -0.0002137001 -0.0020795435 0.0007704728 0.0012999205 0.0106105706 -0.0069234542 -0.0030699119 0.0008364948 -0.0003685832 0.0018692965 -0.0000743945 0.0004646479 -0.0017328314 0.0043552347 -0.0134928004 0.0020152423 -0.0045822010 -0.0087751169 0.0062670603 0.0031105761 0.0020836815 0.0032879876 0.0019557045 0.0008400786 0.0015090595 -0.0085043207 0.0042203319 -0.0073851227 -0.0043315849 0.0030811754 0.0050698923 -0.0005180953 -0.0005659684 -0.0007808443 -0.0058042954 0.0004554939 -0.0026120485 0.0081914600 -0.0001649284 0.0034028052 -0.0003922109 -0.0007647300 -0.0002371023 0.0007819077 -0.0002169202 0.0023172534 0.0032583470 0.0001862727 0.0009895705 -0.0006170516 0.0003869452 0.0004691916 0.0010080540 -0.0003095567 -0.0000634043 0.0039772780 -0.0015523545 -0.0015460438 -0.0000697172 0.0003486997 0.0000827740 0.0012283738 -0.0020885916 -0.0005353899 0.0002872915 -0.0012062397 -0.0013930750 0.0002901697 -0.0000704947 -0.0008851359 -0.0000663844 -0.0019298440 -0.0022200887 0.0014593468 -0.0004339692 -0.0017483340 0.0005103398 -0.0083820359 0.0070363371 0.0346178991 -0.0085203172 0.0396296897 -0.1122965767 0.0953556381 -0.0243322882 -0.1066890497 0.0831697357 0.0092742831 0.0799550429 -0.0455169251 -0.0312289948 0.0423282893 0.0137636097 -0.0288419908 -0.4737138189 0.0914362969 0.5646338349 0.1814978514 -0.0310945138 -0.2017493950 0.0039651263 -0.0360688616 -0.0876477734 -0.2745092270 0.0676069820 0.4564572060 0.0544615825 0.0506170394 -0.0989180764 -0.0338092663 0.0157942975 0.0202907977 0.0034001209 -0.0079879571 -0.0027224482 -0.0152514724 0.0177352416 0.0436982371 -0.0042632274 -0.0005080321 0.0005144484 0.0080918362 -0.0034024421 0.0057329126 0.0158066435 0.0099470857 0.0152662052 0.0044270354 0.0097521603 -0.0009065097 0.0033188709 -0.0037627309 -0.0111881675 -0.0057071061 0.0174195066 0.0295924402 -0.0067025800 0.0143192563 0.0416984714 0.0049074522 0.0062319427 0.0015127673 0.0128173651 -0.0153859860 0.0091436177 -0.0474705945 0.0269482786 0.0043337537 0.0030287084 -0.0220775106 0.0052467022 -0.0190527309 0.0573311300 -0.0128273834 -0.0303988071 0.0782084211 -0.0241350265 -0.0050057400 0.0007058140 0.0032530226 -0.0112170492 -0.0002138304 0.0388691598 -0.1717845995 -0.0783351958 0.0292306159 0.3158777325 0.0830358681 -0.0624854080 -0.0544934418 0.0109162716 -0.0618364721 0.1519585648 -0.0041521522 0.0591913268 0.4522067873 -0.0236567433 0.2434619532 -0.0522503819 0.0017302046 -0.0676528794 0.3890141245 -0.0243600629 0.2189520384 0.2134777930 0.0068630821 0.0806206249 -0.0255308566 -0.0003953104 0.0293210654 0.4009846147 -0.1220680402 -0.1239930426 -0.1351779990 0.0315944825 0.0251759978 -0.0075522908 0.0065418153 0.0375345444 0.0617634943 -0.0327223859 0.0157184363 0.0208100499 -0.0787526727 -0.1497928809 0.0565617151 -0.0606953165 -0.1152922341 0.0012125214 -0.0013457829 -0.0016447605 0.0082334977 0.0142125294 -0.0004696679 -0.0267625183 -0.0178439622 0.0323859580 -0.0003801696 -0.0002464654 -0.0007529439 -0.0009423337 -0.0004597231 0.0020590994 0.0006548623 0.0020464131 0.0007056680 -0.0020812918 0.0029738404 0.0024547371 0.0007988729 -0.0011576826 -0.0000465841 0.0017451329 -0.0026488733 -0.0015333030 -0.0049683804 0.0004949433 0.0082928217 0.0010993412 -0.0001920559 -0.0000252349 -0.0088995207 0.0104932648 -0.0127761901 0.0091514615 0.0200298729 0.0004410826 0.0029568734 0.0007476786 -0.0023460181 -0.0028780459 -0.0052930571 0.0015805406 -0.0054770474 0.0491651888 0.0144835560 -0.0227619483 -0.0097174052 0.0002577343 0.0318681899 -0.0145285046 0.0402360789 0.0950569426 0.0686113088 0.0825802374 0.0301838986 0.0703559642 0.0158395641 0.0120078245 -0.0156084202 -0.0581120252 -0.0102178996 0.0976757555 0.1896213492 -0.0291745873 0.0797947152 0.1939840417 0.0323979472 0.0288678213 0.0033966446 0.0400466596 -0.0636298303 0.0566009406 -0.2595421788 0.1484958613 0.0275192654 0.0159514641 -0.1110608674 0.0269128397 -0.1077657376 0.2914078479 -0.0727391430 -0.1547310867 0.3982049520 -0.1232657708 -0.0143574229 0.0002284886 -0.0116375957 0.0495881360 0.0702413725 0.0001659422 -0.1392586782 -0.0464807079 0.0164350501 -0.3510521395 -0.2795323326 0.0489880215 0.0034032610 -0.0077721024 0.0237859998 -0.2558549380 0.0178059082 -0.1063168410 0.1376586372 -0.0249725940 0.1172679184 0.0227851445 -0.0142514686 -0.0004192516 0.0103270804 0.0096490481 0.0614859222 -0.1817627828 0.0029444050 -0.1391577062 0.0057288782 -0.0090469274 -0.0070181496 -0.0460276910 -0.0177203767 0.0078087423 -0.0354298026 -0.0044474795 -0.0184301189 -0.0002151998 0.0026326229 0.0021387408 -0.0025342638 0.0079246682 0.0041409651 -0.0000046669 0.0048770258 -0.0128474968 -0.0150944131 0.0097131216 0.0094445944 0.0014164408 0.0100151354 0.0142617046 0.0047339617 0.0028221536 -0.0428884443 -0.0677849423 -0.1589524646 0.1240703797 -0.0012848360 0.0030895489 -0.0018730040 0.0120714259 -0.0067298528 0.0062057769 0.0136429389 -0.0139227953 -0.0016365630 -0.0011443549 -0.0115716783 -0.0055451804 -0.0037554547 0.0008817429 0.0102428988 0.0204245615 -0.0002074506 -0.0162206270 0.0138320206 0.0015452148 -0.0416113223 0.0041768416 -0.0056225071 -0.0004460846 -0.0217100847 0.0136720907 0.0072435004 0.0269232481 0.0032922603 -0.0239966939 -0.0088497634 0.0095703154 -0.0050543499 0.0000449470 -0.0057193680 0.0012950847 0.0385504522 0.0003958382 0.0263334895 -0.0241342160 -0.0117920384 -0.0036625167 0.0426320405 -0.0112763659 0.0647118023 0.1096789854 0.0740111472 0.0913434828 0.0334852848 0.0897301471 0.0335072986 0.0086120441 -0.0199177231 -0.0607623186 -0.0091476930 0.0980615217 0.2032301322 -0.0272927097 0.0862500514 0.1977699337 0.0289503266 0.0226691777 0.0049553132 -0.0100897229 -0.0420525618 0.0772500457 -0.1838741107 0.1094818395 0.0261848536 0.0062908383 -0.0857517857 0.0263432851 -0.0878233447 0.1322698346 -0.0454366672 -0.1314444215 0.2894357949 -0.0757843961 0.0049763382 0.0569843927 -0.0196844847 -0.0870701248 -0.1145493255 0.0188984807 0.3756878777 0.2699356667 -0.1131852349 0.2787963588 0.2876339267 -0.0041401187 0.0126671873 0.0216855036 -0.0058530287 0.2813262330 -0.0108554938 0.1126361596 -0.2776712516 0.0033866162 -0.1471600273 -0.0062640419 0.0124311242 0.0110191700 -0.0824385578 0.0015416753 -0.0865829312 0.0998941658 -0.0078009268 0.0970062316 -0.0107649357 0.0105442943 0.0009332645 0.0044191591 0.0255133477 -0.0010684625 0.0753657075 -0.0068433867 0.0136215022 0.0073177972 -0.0049074417 -0.0084406132 -0.0335052813 0.0018999314 0.0010164469 0.0006443006 0.0087231609 0.0479578614 -0.0073977982 0.0036415564 0.0064926998 0.0005674098 -0.0165188793 -0.0109404858 0.0223983790 0.0174777062 0.0069593460 -0.0169483113 0.0070495607 0.0194172327 0.0011563255 -0.0023886607 0.0016950589 -0.0123315637 0.0069969311 -0.0042957565 -0.0115218047 0.0130095510 0.0018777347 0.0007704576 0.0111189306 0.0058401401 0.0062581537 -0.0020649904 -0.0083659999 -0.0245533342 0.0067922307 0.0276544118 -0.0139652234 0.0029458603 0.0229434110 -0.0065655058 0.0074091785 0.0015079597 0.0294800635 -0.0226314413 0.0069159056 -0.0170433958 -0.0255703281 -0.0014150523 0.0085757902 -0.0024383337 0.0007770563 -0.0027907372 -0.0024844751 0.0002021201 -0.0212696818 0.0256904724 -0.0068606668 -0.0323882647 -0.0142718222 -0.0258522909 0.1025696200 0.0229068132 0.2146092139 0.1792610876 0.1173216923 0.1298884727 0.0452629887 0.1800283781 0.1057730993 -0.0182992876 -0.0292837123 -0.0830050911 -0.0262035072 0.0744979903 0.1672925505 -0.1070378493 0.1551342941 0.4294035904 0.0928108380 -0.0679962749 -0.0120806949 -0.4724125517 0.2931838728 0.1882607519 -0.0854712830 0.0206025707 0.0433465171 -0.0215584599 0.0899759561 -0.0030646356 -0.0494367185 -0.1266012401 -0.0110950942 0.1046289349 -0.3195997935 0.1224698061 0.0136598224 -0.0169864059 0.0005094553 0.0084065051 0.0133770116 -0.0026802265 -0.0561671959 -0.0457274745 0.0210987412 0.0258901048 0.0026158312 -0.0113470142 -0.0046138639 0.0000306089 -0.0053726409 -0.0144744656 -0.0010006256 -0.0190293694 0.0559255493 0.0051012996 0.0212883870 -0.0062913326 0.0025747982 -0.0007040236 0.0367055619 0.0043086368 0.0432390225 -0.0404457160 -0.0165027717 -0.0020911094 0.0268527821 -0.0113617217 -0.0073640368 -0.0715383100 0.0241399294 0.0287062430 -0.0940160838 0.0331354986 0.0231197322 -0.0050919036 -0.0073366840 -0.0049053440 0.0004547530 0.0431779413 0.0010337710 -0.0127679063 0.0452690134 0.0264040318 -0.0092598400 0.0085578554 0.0411290779 -0.0028196810 0.0024769836 0.0009047746 -0.0104990444 -0.0083940627 0.0130486515 0.0156821370 0.0207262846 -0.0142952671 0.0011253701 -0.0008628259 0.0005773405 -0.0031819860 0.0021685722 -0.0014985055 -0.0036232665 0.0024608874 -0.0003713465 0.0011103725 0.0003552125 0.0004603439 -0.0011858849 0.0013975404 -0.0006190497 -0.0038453449 -0.0001339837 0.0017255327 0.0041627333 -0.0015291762 -0.0013356106 0.0002959536 -0.0016705430 -0.0016830754 -0.0015132629 -0.0023616296 0.0054190512 -0.0087304286 0.0021618853 0.0112303677 -0.0020675337 -0.0033994102 0.0061441513 0.0033705731 0.0077332101 -0.0025141770 -0.0103050058 -0.0610009644 -0.0265120315 0.0038679912 0.0028233232 0.0048139107 -0.0106748300 -0.0068641450 -0.0348966525 -0.0260038584 -0.0192217337 -0.0166152330 -0.0052007017 -0.0263626563 -0.0196787995 0.0059684821 0.0024244085 0.0098094354 -0.0080316903 -0.0027963587 -0.0200533358 0.0123712920 -0.0301885198 -0.0583515818 -0.0194233865 0.0145718217 0.0050584645 0.0889393431 -0.0589393714 -0.0301572886 0.0300177034 -0.0111665099 -0.0108657671 0.0037924306 -0.0157830965 -0.0002676392 0.0146392761 0.0089264933 0.0059033112 -0.0220434572 0.0579188491 -0.0204983403 -0.0017746182 0.0076764658 -0.0000179436 -0.0133656088 -0.0194732816 0.0183986218 -0.0318943568 0.0201807938 -0.0288040170 0.1463047239 0.1030513768 -0.0083685658 -0.0153768859 0.0184164183 -0.0256669755 0.0741730162 0.0021669312 -0.0141817815 0.1397039807 -0.0058316217 0.0779481560 -0.0323585735 0.0206876848 0.0046000633 0.1956827189 0.0063773214 0.1667555577 -0.2163754287 -0.0557039576 -0.0244008114 0.1392300085 -0.0601402608 -0.0410417832 -0.3826775775 0.1429821954 0.1529076546 -0.4908658124 0.1800625190 0.1378809810 -0.0183497291 -0.0477891997 -0.0347443683 -0.0446411606 0.2612206151 0.0146771892 -0.0696149039 0.2750202390 0.1920443937 -0.0789756713 0.0590678353 0.2463177576 0.0006430156 -0.0032655200 -0.0032649945 0.0054765176 0.0050171977 0.0046044714 -0.0072683196 0.0105300058 -0.0026084965 0.0017290779 -0.0018296668 -0.0010727007 -0.0118117228 0.0049511118 0.0044388751 -0.0061630260 0.0111059954 0.0006828677 -0.0042597212 0.0086356369 0.0091836389 0.0021654093 -0.0022249820 -0.0022404787 -0.0083804703 0.0002483832 0.0102758456 -0.0070336247 -0.0002330159 0.0139578924 -0.0007652707 0.0032416530 0.0012181371 -0.0037192060 0.0099048786 -0.0147782110 0.0093896894 0.0130368682 -0.0066115232 0.0069155897 -0.0011958355 -0.0086172712 -0.0054529186 -0.0092047802 0.0045152317 -0.0057161378 0.1159054559 0.0339751810 -0.0021578380 -0.0000874553 0.0006418555 0.0077133214 -0.0070869189 -0.0050671045 0.0032674659 -0.0038061800 0.0057275734 0.0030208677 0.0037466654 -0.0032405922 0.0049314461 -0.0021230507 -0.0012121057 -0.0056421238 0.0093015728 0.0138488568 0.0079911956 -0.0063350520 -0.0143885974 -0.0127697240 0.0120495380 0.0064673088 0.0580815650 -0.0415010325 -0.0128748875 0.0254559702 -0.0112037448 -0.0118657487 0.0043972164 -0.0094670793 0.0003799060 0.0045086667 -0.0099381132 0.0004823088 -0.0283751943 0.0594590784 -0.0137247011 -0.0024181020 -0.0010590228 -0.0102512963 -0.0052376215 -0.0000977910 0.0021272650 0.0061527088 -0.0185164901 0.0260428084 0.0785995774 0.0148999474 -0.0226399993 -0.0008466264 0.0026052783 -0.0054206730 0.0138288101 -0.0020252649 -0.0103910353 0.0185928226 0.0067920240 -0.0002459159 -0.0095309118 0.0024159394 -0.0037227840 0.0378507457 0.0021818371 0.0367263516 0.0031286892 -0.0137868253 0.0198636449 0.0127493166 -0.0051848119 -0.0021462493 -0.0222858058 0.0123443611 0.0115982242 -0.0469313756 0.0176521090 0.0138648472 -0.0017693341 -0.0050603376 -0.0032198757 -0.0030788904 0.0260853450 0.0013438964 -0.0063211572 0.0265849858 0.0174004222 -0.0069540350 0.0048371275 0.0237091563 0.0010342391 0.0016478544 0.0032101650 -0.0052199233 -0.0046246142 0.0039365587 0.0238029366 0.0169983986 -0.0112515117 -0.0242130743 0.0254594292 0.0154488937 0.1460457850 -0.0579758954 -0.0574602382 0.0757435896 -0.1401348764 -0.0060666894 0.0527973786 -0.1028006315 -0.1148388385 -0.0129906053 0.0158623751 0.0147785356 0.0507045813 -0.0146181126 -0.0643850852 0.0598580534 -0.0054471338 -0.0895679352 0.0093313531 -0.0272285462 -0.0183166663 0.0047169629 -0.0614436390 0.1222150506 -0.0742336877 -0.0622551367 0.0684419691 -0.0462453394 0.0160926108 0.0734451318 0.0370709013 0.0607207877 -0.0361925411 0.0025107527 -0.8646518254 -0.2682361170 -0.0393701817 -0.0209769502 0.0051155207 0.1106287669 -0.0580568267 0.0802169728 0.1390215008 0.0963956559 0.1269994054 0.0980206535 0.1771684744 0.0302736154 0.0388685350 -0.0635103951 -0.0936229230 -0.1127943413 0.2347109957 0.4575360736 0.0244472198 0.0175620469 0.0820991224 -0.1122927694 0.0873255634 0.0648283473 0.2083984431 -0.1994704419 0.0110478098 0.5299942012 -0.2654785463 -0.1647447893 0.0206792884 0.0254503812 -0.0373839601 0.1663015711 -0.2164890808 0.0718674874 -0.0391554463 -0.0081838045 0.0268642896 -0.0030497885 0.0037526765 0.0116419889 0.0129577570 0.0129720701 -0.0075226137 -0.0512819060 -0.0412614741 0.0116162451 -0.0291407061 -0.0103136731 0.0023391209 0.0014778094 -0.0037792467 0.0018025262 -0.0312845771 0.0020933481 -0.0053671119 0.0006691846 -0.0004223242 -0.0008885159 -0.0002968602 -0.0012969144 -0.0001947624 -0.0036734289 -0.0027070005 -0.0076399511 0.0087276014 0.0047198874 -0.0012511039 -0.0026547090 0.0012969390 0.0012903202 0.0084191019 -0.0035348959 -0.0030411702 0.0145016383 -0.0062830928 -0.0058841821 -0.0009848894 0.0042684295 0.0030036735 0.0086105429 -0.0245811431 -0.0028329224 0.0022640874 -0.0144797541 -0.0131558472 0.0067506760 -0.0051099229 -0.0207085688 0.0006266976 -0.0078497860 -0.0086804087 -0.0062295042 -0.0114279244 0.0104033818 0.0129361121 0.0413770549 -0.0480240278 0.0008609652 -0.0011613242 -0.0002935579 -0.0076598334 0.0037775016 -0.0000095622 -0.0035385748 0.0056800764 0.0002190671 -0.0009788070 0.0070422285 0.0043771251 0.0005692741 0.0000208442 -0.0034732170 -0.0057860723 -0.0097665212 0.0010611511 0.0035695129 -0.0068244554 0.0221516365 -0.0013779523 0.0016632416 0.0038989011 -0.0006485793 0.0069822091 -0.0206529107 0.0086633035 0.0112376721 -0.0032893505 0.0042935965 -0.0014468629 -0.0057983601 -0.0028942260 -0.0041604194 0.0025201853 0.0005347005 0.0601088280 0.0179306493 -0.0001923773 0.0007043630 -0.0000512688 0.0018727441 -0.0017627033 -0.0035256204 -0.0010443209 -0.0046212869 0.0004139787 -0.0012470817 -0.0020851128 -0.0017413826 0.0014075354 0.0007486576 0.0011609204 -0.0021383621 -0.0010991712 -0.0072787390 -0.0004438071 -0.0039376550 -0.0022638736 -0.0016617768 0.0024835759 0.0014378034 0.0178833499 -0.0117786457 -0.0043524553 -0.0054390133 0.0031795254 0.0001029848 0.0014658713 -0.0040553085 0.0008365225 -0.0028598905 -0.0027162327 -0.0021309206 -0.0141999799 0.0285648396 -0.0054796842 -0.0004749987 -0.0033841356 -0.0060558891 0.0030353294 0.0095147267 -0.0011957391 -0.0140769243 -0.0307036275 0.0295951157 0.0062380831 -0.0340810867 -0.0152458475 -0.0012227795 -0.0011756243 -0.0008406409 -0.0120911863 -0.0000557798 -0.0075852108 0.0194849654 0.0025296063 0.0065949985 -0.0005357210 -0.0000527926 -0.0013989682 0.0076952058 0.0024004811 0.0129005096 -0.0051603412 -0.0055152403 0.0009288402 0.0021733867 -0.0012041159 -0.0002097290 -0.0033121984 -0.0007305833 0.0015877341 -0.0103943899 0.0023001187 -0.0001071125 -0.0010499172 0.0001476358 0.0005401568 0.0044495433 0.0006579952 -0.0006055217 -0.0006155594 0.0008946148 -0.0033185504 0.0011515115 -0.0004350966 0.0005999471 0.0004338857 0.0024202246 0.0030648517 -0.0053743989 -0.0021108852 0.0008865409 0.0045961574 0.0043855825 -0.0043294020 0.0723335213 -0.0853735520 -0.0354806091 -0.4285461391 0.1724101812 0.1178345007 -0.2311486906 0.4150357330 0.0222732206 -0.1153934918 0.3165851830 0.3103209480 0.0216863721 -0.0062398673 -0.0359136972 -0.0776152884 0.1012206050 0.1030453766 -0.1143770304 0.0575006825 0.0517091566 -0.0529591547 0.0306233260 0.0652996869 0.2166555891 -0.1630625228 -0.0870829461 0.0480258651 -0.1938595378 -0.1545948753 0.0005414906 -0.0101318051 -0.0027368714 0.0122547209 0.0286806376 -0.0084466733 0.0442544363 -0.3172204489 -0.1094688481 -0.0027419865 -0.0049681343 -0.0054768083 0.0020339786 0.0064890982 0.0288177334 0.0204066328 0.0187223249 0.0087481872 0.0049969674 0.0213755153 0.0168472321 0.0004843393 0.0013345689 0.0027170791 0.0042039411 -0.0011664897 -0.0002394129 0.0045464975 -0.0025952511 -0.0127386556 -0.0030846924 0.0010326452 -0.0004890603 0.0073044537 -0.0088741143 -0.0019532073 0.0121641501 -0.0028026051 0.0036649648 0.0005216958 0.0017214241 -0.0009361043 0.0024897926 -0.0042594403 0.0002979909 0.0013283212 -0.0048813274 0.0020814571 -0.0000635661 -0.0035704699 0.0006244082 0.0018777271 0.0129765128 0.0056112139 -0.0280303989 -0.0418363486 0.0420884170 0.0523252108 -0.0415243362 -0.0285437743 -0.0276981924 -0.0035250522 -0.0153257570 0.0411804404 -0.0128743548 0.0159948879 0.1671156186 0.0076824379 0.0761668560 0.0338003694 -0.0171253828 -0.0113788357 -0.1322018148 0.0365765552 0.0158994333 0.0569577967 -0.0396449984 0.0222112312 -0.0867828325 0.0351521042 0.0295176657 0.2325062545 0.0057019227 -0.0746134568 0.2727819028 -0.0710261881 0.0000502134 0.0853551246 -0.0917347604 -0.0653009623 -0.3054638689 0.3421875570 0.0748853730 0.0110372137 0.4113288842 0.2175351899 -0.4371842350 0.1780786325 0.3090717302 -0.0000938498 0.0011348601 0.0011222842 -0.0002222215 0.0012211049 -0.0019975914 -0.0051362279 -0.0095455004 0.0099580566 0.0038575239 -0.0032747154 -0.0040435984 -0.0153828177 0.0034683459 0.0149775462 -0.0069394100 0.0187352240 -0.0003566074 -0.0101944049 0.0070551584 0.0162530659 -0.0048159125 0.0020783878 0.0056215973 0.0147966825 -0.0038815941 -0.0177685244 0.0103441466 -0.0022793597 -0.0145396899 0.0042034141 -0.0049947793 -0.0037532138 -0.0234733188 0.0179310709 -0.0046893161 0.0027905519 0.0277560306 0.0142611609 -0.0003271704 0.0007627532 0.0015285288 -0.0002694218 -0.0006935824 -0.0001776481 -0.0034955477 0.0052717962 0.0017397384 -0.0034578812 -0.0061047993 -0.0097672636 0.0046866591 0.0100052922 0.0413571033 0.0309441895 0.0181432002 0.0141243019 0.0019540226 0.0293632585 0.0297618163 -0.0001232516 0.0044117011 0.0079033788 0.0070557298 -0.0112101662 -0.0227746814 0.0046423278 -0.0063886622 -0.0195896414 -0.0001507071 -0.0006022008 -0.0022950793 0.0090513941 -0.0072865343 -0.0050355696 -0.0092340217 0.0074115034 0.0083639262 0.0018001686 -0.0009085314 0.0006105482 -0.0150794599 -0.0063686049 -0.0108128261 -0.0143543745 0.0026957895 0.0104610686 0.0016855712 -0.0017199176 -0.0023310871 0.0029019029 0.0129901228 -0.0010177151 -0.0127561288 -0.0393073408 0.0430038084 0.0056210267 -0.0557590427 -0.0234510782 -0.0063412868 -0.0019181961 -0.0025268786 -0.0052659464 -0.0021208601 -0.0041356171 0.0416933698 0.0041142469 0.0172526617 0.0073778329 -0.0019030134 0.0007986844 -0.0182886375 0.0066289115 0.0050952574 -0.0170092054 -0.0073794959 -0.0084453922 -0.0052838199 0.0015337898 0.0011432824 0.0070589808 -0.0026941969 -0.0033200897 0.0145203969 -0.0057692466 -0.0039017138 0.0044826259 -0.0045350091 -0.0026514134 -0.0113970203 0.0164498514 0.0033797642 0.0012919983 0.0239975929 0.0034363448 -0.0277143078 0.0107981139 0.0154903582 -0.0002345086 0.0007619997 0.0010427846 -0.0040271393 -0.0010951796 0.0005407531 -0.0048147362 -0.0013385590 -0.0000105478 -0.0642022619 0.0501802458 0.0686579861 0.2291891792 -0.0463757694 -0.2475767777 0.1056787662 -0.2825494677 0.0148854867 0.1731057411 -0.0925236848 -0.2628669398 0.0916850882 -0.0414140737 -0.1105708452 -0.2748232309 0.0699994190 0.3277221458 -0.2037520857 0.0428878731 0.2924448447 -0.0789735814 0.0699881034 0.0852181546 0.3086014498 -0.2107606651 -0.0894923037 0.0589524798 -0.2817418960 -0.2475302300 0.0181160816 -0.0203320435 -0.0301562940 -0.0012717918 0.0070898961 0.0049063840 0.0452600126 -0.0049309858 -0.0145963017 -0.0415994141 -0.0783039195 -0.1118933053 0.0420565955 0.1270534419 0.5119749413 0.3668569327 0.2602762783 0.1587959469 0.0403802127 0.3573331888 0.3434394280 -0.0068245139 0.0395445965 0.0863403292 0.1306136208 -0.1270785855 -0.1790436726 0.1138839962 -0.0249448204 -0.2808328351 -0.0223773507 0.0022263253 -0.0230998615 0.1157673668 -0.1005841311 -0.0638746101 0.0071457813 0.0312572076 0.0681765620 0.0130007817 -0.0096920670 0.0024590685 -0.0723994997 0.0104736243 -0.0589752532 -0.0533098575 -0.0012183337 0.0449124297 -0.0006751457 0.0049325099 -0.0013830601 0.0026670645 0.0018746883 -0.0017735588 -0.0096898680 -0.0027134269 -0.0039465654 -0.0063393769 0.0079826177 0.0037260895 0.0020869208 -0.0004396520 0.0016204057 -0.0061626313 -0.0000776825 -0.0042259479 -0.0088723519 0.0021980693 -0.0067981067 -0.0049869057 0.0012961688 0.0006028816 0.0254095279 -0.0100700789 -0.0085492561 0.0067460358 0.0148916575 -0.0055714546 0.0053610600 -0.0023552232 -0.0008878712 -0.0098194702 -0.0016428758 0.0039736932 -0.0208416917 0.0050191600 -0.0005157076 -0.0047965895 0.0039741100 0.0028644849 0.0177350582 -0.0099483784 -0.0039225038 -0.0009331187 -0.0220880052 -0.0109236289 0.0254843012 -0.0087882371 -0.0089533086 0.0005841782 -0.0006281593 -0.0003305796 -0.0014705954 -0.0057713086 0.0056674159 -0.0017495191 0.0131363507 -0.0164593221 0.0041504680 -0.0030817306 -0.0048501915 -0.0139920139 0.0018844056 0.0187140781 -0.0070205164 0.0195840717 -0.0009202074 -0.0127956826 0.0043106294 0.0181133896 -0.0058428421 0.0015918384 0.0080457401 0.0224136036 0.0034464005 -0.0225016757 0.0074980302 0.0010862515 -0.0262023733 0.0052049983 -0.0046291085 -0.0055055953 -0.0215779367 0.0154014919 0.0038021817 -0.0023712826 0.0213152898 0.0161313960 -0.0002284886 0.0012430909 0.0010805970 -0.0005396146 -0.0013879216 -0.0001894499 -0.0041052649 0.0111432677 0.0034665479 -0.0004485972 -0.0010478398 -0.0011726396 0.0001530649 0.0020523856 0.0075770412 0.0036167398 0.0048264314 0.0009769533 0.0011743589 0.0037387627 0.0025643471 -0.0011539315 -0.0007086731 0.0011491123 0.0094493726 -0.0042605005 0.0038920872 0.0097052801 0.0075420162 -0.0101013518 -0.0014813403 0.0016400209 -0.0002318586 0.0032203737 -0.0056198885 0.0005520610 0.0045668431 -0.0005051236 0.0002831813 -0.0003682723 -0.0023718142 0.0016542512 -0.0000135731 -0.0090091860 0.0019275218 -0.0020573748 0.0067208607 -0.0018478252 0.0040213582 0.0059272186 -0.0042742176 0.0116897616 -0.0152585559 0.0247360153 -0.0970287872 -0.0066882611 -0.0404639794 0.1665743965 0.1058166930 0.0027819065 -0.1289690825 0.0035676618 -0.0552391672 0.3701829594 -0.1016133348 0.0154282095 0.4259494180 0.1244116716 0.1099186953 0.1386935255 -0.0114378798 0.0749111107 -0.4362935039 0.0795928456 -0.1282443697 -0.4124578792 -0.0664561886 -0.1935241093 -0.0158106412 -0.0023560804 -0.0277953497 -0.1911133231 0.0111697776 0.0284877926 0.0910415432 -0.0342628197 -0.0197151406 -0.0097033335 0.0267974938 0.0236718668 0.0978815982 -0.1351702633 -0.0210472917 0.0138199337 -0.0520282335 -0.1519332257 -0.0021727328 -0.0132341349 -0.1144971139 -0.0005072010 -0.0024654581 -0.0018626583 -0.0002797687 0.0045028816 0.0078266828 -0.0048172337 0.0186180643 -0.0044988722 0.0010076492 -0.0011067390 -0.0009891343 -0.0050191033 0.0012037228 0.0040024304 -0.0027223766 0.0066629324 0.0001322240 -0.0027610306 0.0028505560 0.0048913728 -0.0013485068 0.0010192714 0.0005897659 0.0028186445 -0.0056184185 -0.0059703731 0.0052074746 -0.0028121457 0.0012424918 0.0011497369 -0.0048092179 -0.0008019486 -0.0214397328 0.0174021592 -0.0191630879 0.0075993519 0.0370032528 0.0135154272 0.0012210821 -0.0009768946 0.0051030927 0.0004927403 0.0019507186 -0.0018024490 -0.0136367535 -0.0244195869 -0.0140718605 0.0004334142 -0.0000014897 -0.0002480319 -0.0085557286 0.0044240550 0.0006376723 0.0056150889 0.0039582333 0.0036826274 -0.0060595866 -0.0055070091 0.0040907605 -0.0022625586 -0.0021864117 -0.0010013564 0.0203738207 -0.0067114496 0.0118348018 0.0174806933 0.0203234389 -0.0081374775 -0.0026978660 0.0024882146 0.0011097089 0.0060820862 -0.0073943606 0.0005513071 0.0110834465 -0.0040127791 -0.0019248510 0.0016205075 -0.0001331478 0.0011473124 -0.0049226822 -0.0211322106 -0.0033077493 -0.0123719917 0.0133557681 0.0036281963 0.0023414198 -0.0079892288 -0.0155372408 -0.0572108948 0.0470729846 -0.0165609901 0.4141364893 -0.1917382308 0.4599866817 0.3015172300 -0.4377583784 -0.2886262059 -0.0024242461 0.0099220358 0.0190901309 0.0471379588 -0.0488980961 -0.1315999101 0.0025560976 0.0992460488 -0.0683331127 0.0092921910 0.0020059135 -0.0121506049 -0.0647897154 0.0726904825 0.1393419399 -0.0897095778 -0.1242195792 0.0557691192 0.0071141850 0.0007869544 -0.0022280708 -0.0294279424 -0.0393827550 0.0047177874 -0.0279022184 -0.0021444016 -0.0352330270 -0.0031418050 0.0056985794 0.0054064113 0.0140207465 -0.0296253203 -0.0027117060 0.0008497525 -0.0132292450 -0.0150878661 0.0111912402 -0.0085429886 -0.0300410620 -0.0011603623 0.0051729909 0.0087045760 -0.0022707089 -0.0020100596 -0.0003796985 -0.0032062966 -0.0231037001 0.0258198609 0.0038718189 0.0004873112 -0.0056294284 0.0093866080 -0.0089493465 0.0198427992 -0.0039932767 0.0018309397 -0.0079132766 -0.0174463324 -0.0193447253 0.0135519536 -0.0125713955 0.0042747333 0.0183526460 0.0407857886 0.0113973790 -0.0382045291 0.0185898446 0.0018894668 -0.0589736516 0.0104592391 0.0170134023 -0.0263493200 0.0811744715 -0.0832900894 0.1696842503 -0.1140801096 -0.1582318701 0.0299117912 0.0022428322 -0.0007831312 -0.0057988026 -0.0034142972 -0.0062509592 0.0040890788 -0.0086780367 0.1085902088 0.0295270327 -0.0003778697 -0.0005833614 0.0004601271 0.0011972224 -0.0002593159 0.0027098356 -0.0015584032 0.0043494369 -0.0019414155 0.0037828862 0.0021572580 -0.0036494912 -0.0003456362 -0.0006682915 -0.0007372793 0.0033571457 0.0006023015 0.0064574701 0.0027541813 0.0035402201 -0.0006691105 -0.0009338661 -0.0007169731 0.0013939378 -0.0003041222 0.0094826600 -0.0058345940 0.0048399183 -0.0073953133 -0.0097737959 0.0004314765 0.0032085964 -0.0017352963 0.0028278815 0.0004641376 -0.0004590771 0.0026564511 -0.0122006687 0.0057875329 -0.0025736144 -0.0037007686 0.0076300245 0.0168862112 -0.0139917239 0.0088327326 -0.1603671428 0.0432936289 -0.1378043685 -0.0804157458 0.1264919596 0.0860681627 -0.0053706985 -0.0026770621 -0.0160251422 -0.0132799108 0.0283029996 0.0760057073 0.0269183539 -0.0576938100 0.0563425714 0.0004964271 -0.0035820954 0.0155599567 0.0378788214 -0.0550895161 -0.1075285892 0.0281147057 0.0977740941 -0.0675224141 -0.0044014538 -0.0018201293 -0.0010182931 0.0034841096 0.0273977199 -0.0000167002 0.0197504979 -0.0000602538 0.0228666107 0.0016144625 -0.0021810282 -0.0027299788 -0.0070938190 0.0148224455 0.0014111757 -0.0002077060 0.0041987098 0.0051406871 -0.0058306489 0.0054208435 0.0164081325 0.0006229621 -0.0000740304 -0.0011325839 0.0043146609 0.0071976057 -0.0056401263 -0.0059251344 -0.0083199901 0.0100962375 0.0071883799 0.0019024541 -0.0109937822 0.0280718717 -0.0199517578 0.0275008891 -0.0090343281 -0.0104608913 -0.0216216708 -0.0359798132 -0.0390019773 0.0271018542 -0.0275663129 0.0096019990 0.0379840632 0.0881352184 0.0160711030 -0.0892212573 0.0368063917 0.0003671714 -0.1007170065 0.0188319857 0.0612598384 -0.0616194706 0.3253643356 -0.3077869968 0.4647501214 -0.3322603013 -0.5277682008 0.0531694533 -0.0010200467 -0.0021690255 -0.0060219294 -0.0025400838 -0.0054521771 0.0048594184 -0.0186776523 0.1407557034 0.0384915967 -0.0019692551 0.0011437636 0.0001869230 0.0154095985 -0.0157554717 -0.0215901937 0.0038787184 -0.0278489858 0.0137669685 -0.0011235575 0.0122995239 0.0148438241 -0.0003373589 0.0003616847 -0.0020078643 0.0134342994 0.0025797010 0.0179086210 0.0056684108 0.0080068776 -0.0012955533 0.0011450029 -0.0032367957 0.0102415086 0.0228723103 0.0695876720 -0.0538199576 -0.0414739214 -0.0234336237 -0.0763697223 0.0038474877 0.0008464826 -0.0006988485 -0.0228432785 -0.0045487859 -0.0178104725 -0.0249548074 -0.0039806292 0.0221410653 -0.0018748946 0.0003916159 0.0064468435 -0.0170313804 0.0172474074 -0.0005703656 0.1365422042 -0.0680043647 0.1637437586 0.1453539653 -0.1481462327 -0.1113050751 -0.0189845148 0.0134294177 -0.0315202792 -0.0292298913 0.0762339470 0.1443071708 0.0194002613 -0.1434557115 0.1430709655 -0.0087066350 -0.0203943276 0.0769140555 0.2440931054 -0.2737618208 -0.4732544648 0.0778726276 0.4859320963 -0.3598628427 -0.0056836418 -0.0104497542 -0.0103270464 -0.0290932069 0.0919112144 0.0109517070 0.0414279326 0.0079032214 0.0805316098 0.0025805062 0.0021604892 -0.0140296336 -0.0937941291 0.0418829755 0.0150561837 -0.0062571121 -0.0712810545 0.1040328196 0.0719670476 -0.0047654061 0.0429980561 0.0007350305 -0.0015685574 -0.0010747769 0.0003844880 0.0007664209 -0.0054318939 -0.0014424022 -0.0138414259 0.0106236561 -0.0008176584 -0.0006287635 0.0007595985 -0.0063831911 0.0031991196 -0.0010112161 0.0048639492 0.0026404870 0.0044110732 0.0059262284 0.0072915407 -0.0044975454 0.0024766380 0.0001084229 -0.0035291024 -0.0097937785 -0.0087532822 0.0074571417 0.0025920068 -0.0030074709 0.0114358547 -0.0015593688 -0.0083929962 0.0068840336 -0.0438639246 0.0392948767 -0.0508644365 0.0413765322 0.0632034654 -0.0076548661 -0.0012795094 0.0019092478 0.0004755691 0.0005252286 0.0001537022 -0.0005986762 0.0068393795 -0.0225168742 -0.0037586047 0.0101305917 -0.0191810714 0.0095263899 -0.1345205059 0.1250858660 0.1918584571 -0.0530594937 0.3067803341 -0.1426768505 0.0585508554 -0.0934181117 -0.1926597508 0.0152763973 -0.0014878879 -0.0005517018 -0.1415249053 0.0376190448 -0.0705535696 -0.0865836950 -0.0939496270 0.0676061395 -0.0022075112 0.0115199171 -0.0524414611 -0.1350637130 -0.3442914382 0.2801548084 0.1912157589 0.1263662978 0.3994413561 -0.0409258033 -0.0089453396 0.0017243725 0.2459784146 0.1325339585 0.1890627352 0.2878877926 -0.0004959099 -0.2353455123 -0.0033798427 0.0047726177 0.0038002943 -0.0035335104 0.0034464152 0.0005340535 0.0248830755 -0.0062025912 0.0250375686 0.0191546805 -0.0268109846 -0.0172694006 -0.0031696740 0.0004446512 -0.0013822476 0.0035270437 0.0008549562 0.0033969554 0.0074586995 -0.0018495112 0.0061542148 -0.0021837615 -0.0019473348 0.0103095404 0.0362726094 -0.0392305861 -0.0693333485 0.0131846694 0.0679216567 -0.0478664023 -0.0002274034 -0.0011072351 -0.0005871276 -0.0053873054 0.0046826414 0.0020333816 0.0009860303 -0.0002442345 0.0026543101 -0.0004073059 0.0003380812 -0.0015630255 -0.0045558780 0.0093600072 0.0006652513 -0.0003677322 -0.0120291874 0.0071868459 0.0124715356 -0.0003132749 0.0102966993 0.0007016481 -0.0017243323 -0.0020547227 0.0012217653 -0.0006484916 -0.0023380045 0.0026700801 -0.0105350133 0.0085552362 -0.0003025624 -0.0019758818 0.0001635181 -0.0159403194 0.0104886694 -0.0131957987 0.0117641445 -0.0069848247 0.0029346263 0.0116998144 0.0248189373 -0.0054459782 -0.0018301704 0.0075624838 -0.0019299947 -0.0210960529 -0.0691624044 -0.0044282932 0.0454441580 -0.0294135243 0.0451739980 -0.0005096524 0.0008173530 0.0004758585 0.0040119123 -0.0035784804 0.0037534072 -0.0008595547 -0.0074158554 -0.0032193188 -0.0011664956 0.0011521987 0.0001327555 0.0000726703 0.0001611384 -0.0001898314 0.0049934736 -0.0133916681 -0.0020073393 -0.0033655916 0.0117049942 -0.0067077903 0.1209084119 -0.0907381578 -0.1176214691 0.0035969806 -0.2113205424 0.0602600816 -0.0042030744 0.0860873876 0.1043952568 0.0327944158 0.0230469854 0.0090183684 -0.3076002281 0.1195021443 -0.1233291044 -0.2209137578 -0.2866394279 0.0553485853 0.0075097509 0.0095753509 -0.0307655268 -0.0505712340 -0.1890205607 0.1445241518 0.0703342013 0.0896680069 0.2072847947 0.0275726304 -0.0002916265 -0.0009168792 -0.1999779597 -0.0734425286 -0.1538562245 -0.2215008715 -0.0023639186 0.1762163086 0.0080143350 0.0290451391 -0.0063458358 0.0121733701 0.0081775062 -0.0055647897 -0.0397965046 -0.0162080504 -0.0089372335 -0.0340711524 0.0153311681 0.0178462465 -0.0148178816 -0.0132925982 0.0458784435 0.1186581643 -0.1675764335 -0.3151002148 0.1125683157 0.3027601587 -0.1997622811 -0.0246320794 -0.0036887544 0.0066260052 0.0993786552 -0.0732346292 -0.0999902749 0.0746125819 0.1196757970 -0.0555743849 0.0017697868 -0.0047491510 0.0009215019 0.0269670811 0.0530031384 -0.0007874777 0.0177535597 0.0060393482 0.0443660808 0.0030506909 -0.0003891614 -0.0017035115 -0.0273980308 -0.0226685488 0.0026712124 -0.0023560598 0.0216294745 0.0243413013 -0.0214636010 0.0011073380 -0.0204014785 0.0001007060 -0.0115694295 -0.0083483905 -0.0132041833 -0.0221038687 0.0268727557 0.0362153747 0.0579982240 -0.0504892471 0.0011589075 0.0026305622 -0.0009468394 0.0244264861 -0.0149836350 0.0149445639 -0.0221833610 0.0081504167 -0.0086305377 -0.0213092156 -0.0337495380 0.0139686244 0.0011304122 -0.0052184872 0.0022099844 0.0185873556 0.0531949153 0.0006386336 -0.0347321689 0.0233649728 -0.0354154943 0.0009451349 0.0010919957 -0.0026099958 0.0024689629 -0.0029254596 0.0101401436 -0.0096513138 -0.0038132113 0.0076844930 0.0015855812 -0.0045146260 -0.0002266017 0.0001637900 0.0013589281 0.0005392558 -0.0092848245 0.0238196662 0.0036599852 -0.0000371560 -0.0078053233 0.0043370654 -0.0566622848 0.0477230474 0.0767573386 -0.0090198826 0.1282673912 -0.0415008253 0.0163933154 -0.0392200231 -0.0733548641 -0.0173482746 -0.0129917807 -0.0051547433 0.1717812570 -0.0655203847 0.0706232834 0.1224519489 0.1600277524 -0.0242223834 -0.0014457692 -0.0084850787 0.0263816938 0.0511209020 0.1684919715 -0.1290387682 -0.0928869492 -0.0649227051 -0.1823193318 -0.0214834602 -0.0087201086 0.0040479478 0.1370136771 0.0562080707 0.1113831903 0.1511959225 0.0225503615 -0.1349178975 0.0004612901 0.0053145091 -0.0029937989 0.0056472777 -0.0016582695 0.0016047641 -0.0245907373 0.0244812759 -0.0389339849 -0.0599388380 0.0167499747 0.0345225697 -0.0129166304 -0.0137272285 0.0570116285 0.1353967722 -0.1981398272 -0.3796622197 0.1329926328 0.3553566203 -0.2303181053 -0.0286726504 -0.0033335067 -0.0033798765 0.1062154101 -0.0533613419 -0.0419929697 0.0608123917 0.0800764311 -0.0346826153 -0.0024687089 -0.0273847718 -0.0170750817 0.0996468116 0.2897285828 -0.0175534949 0.0825027572 0.0528609791 0.2811116486 0.0043140657 0.0052071120 0.0007207586 -0.0928673589 -0.1002910813 0.0108143718 -0.0103868068 0.0332932985 0.0799283958 -0.0311866705 -0.0167703328 -0.1055780198 -0.0005655896 -0.0008136941 -0.0005609581 0.0011250652 -0.0005397597 0.0000585882 -0.0142377848 0.0008866552 -0.0052862803 -0.0023514587 -0.0058011158 0.0008416801 -0.0578669801 0.0337106531 -0.0267142260 0.0572064828 -0.0174441553 0.0216102363 0.0494184336 0.0753311495 -0.0341564103 -0.0058895961 0.0116842778 -0.0018353510 -0.0332854071 -0.1191510394 -0.0107574862 0.0833832229 -0.0560896161 0.0734579208 -0.0004124944 0.0032778402 -0.0003164757 0.0147236974 -0.0103861908 0.0059111319 -0.0077802958 -0.0180105299 -0.0030245252 -0.0000814046 0.0011347661 -0.0009833343 -0.0003823276 -0.0007420084 0.0001704371 0.0046183092 -0.0017525801 0.0008011166 0.0004020132 0.0016869719 -0.0023679922 0.0135767830 -0.0103658659 -0.0171132708 0.0057442229 -0.0331545482 0.0117420522 -0.0057783666 0.0116895628 0.0238021632 0.0076741273 0.0054773442 0.0030623284 -0.0717909457 0.0242743122 -0.0371638865 -0.0506184379 -0.0671998366 0.0100875082 -0.0000657301 0.0027356517 -0.0104422200 -0.0205933598 -0.0671892546 0.0504836094 0.0390989905 0.0249820561 0.0746123235 0.0072170985 0.0049416893 -0.0018737848 -0.0437425421 -0.0207633740 -0.0366862571 -0.0480099771 -0.0107429791 0.0455398946 -0.0012871169 -0.0088485387 0.0005848261 -0.0059582495 0.0032482179 -0.0018310396 0.0272533778 -0.0111590109 0.0296843273 0.0215659350 -0.0258335021 -0.0220997331 0.0160414865 0.0095623044 -0.0232351119 -0.1104698024 0.1081739358 0.1844307027 -0.0779486219 -0.1971822867 0.1314679472 0.0110825771 0.0018438673 -0.0132308658 -0.0495483133 0.0579540377 0.1063498456 -0.0733359087 -0.1047030096 0.0364817378 -0.0102844353 -0.0530855450 -0.0391265622 0.1302150806 0.5346701127 -0.0251639069 0.1551029649 0.0935266621 0.5140680735 0.0037018831 0.0119623265 0.0195461126 -0.0369951937 -0.2569145946 -0.0058341446 -0.0104825950 0.1394703117 -0.0066550012 -0.1521846542 -0.0205568680 -0.2495453553 0.0002138801 0.0031574569 0.0028213546 0.0013409567 0.0031028023 -0.0047254279 0.0019862982 -0.0140932142 0.0146678982 0.0016445441 0.0037386379 -0.0001154501 0.0377719329 -0.0209103754 0.0131413323 -0.0395117373 0.0089692297 -0.0156843351 -0.0323756549 -0.0473191115 0.0234475087 0.0042013960 -0.0075218901 0.0007534600 0.0198159903 0.0762758460 0.0086212962 -0.0541740818 0.0363192684 -0.0458840606 -0.0000151871 -0.0022921968 0.0008669656 -0.0098939806 0.0073506274 -0.0061863501 0.0071742665 0.0124243199 0.0001737169 -0.0000901143 -0.0000530363 0.0003278609 0.0001105279 0.0001058743 -0.0000230000 -0.0009458633 0.0000431792 -0.0002050875 0.0125603406 -0.0012896654 0.0096593914 -0.1539730577 0.0766329191 0.0108981789 0.0083528025 0.1157791484 -0.0241622025 -0.0600731120 -0.1373756982 -0.0481154986 -0.0236145967 -0.0160161664 -0.0123127918 0.2072685312 -0.0686933405 0.1082326104 0.1423608552 0.1940014459 -0.0350596015 -0.0039104499 0.0061790569 -0.0092101791 -0.0361999010 -0.0723670907 0.0644237204 0.0614023133 0.0156169476 0.0721383665 0.0064250021 0.0043759093 -0.0005143807 -0.0278249831 -0.0294237926 -0.0244705553 -0.0375149346 -0.0043300071 0.0353429023 0.0004974152 -0.0085995759 -0.0089926367 0.0034277628 -0.0027210198 0.0003598140 -0.0179179979 0.0068421636 -0.0201575092 -0.0153051877 0.0194578342 0.0146750586 -0.0053576553 -0.0030978526 0.0112926340 0.0396859128 -0.0459746256 -0.0827075603 0.0376540993 0.0817714019 -0.0498197115 -0.0060490550 -0.0012221093 0.0026409626 0.0318922010 -0.0228579722 -0.0315452034 0.0215950888 0.0381115065 -0.0196911000 -0.0013952317 0.0006158203 -0.0007794632 0.0113881857 0.0020647824 -0.0048479125 0.0016893768 0.0030530647 0.0083877913 -0.0008222710 0.0002449572 -0.0060017982 -0.0379312353 0.0402353473 0.0085511510 -0.0023780597 -0.0511101347 0.0473605056 0.0570136005 -0.0066255372 0.0321666868 0.0005811977 0.0046884357 0.0055356280 -0.0012427308 0.0011911229 0.0019973859 -0.0027412684 0.0082976333 -0.0068694056 0.0175300570 0.0261082133 0.0019511280 0.2743864896 -0.1313538684 0.0146284796 -0.3403428475 0.0179787211 -0.1578516362 -0.2562424592 -0.3049943032 0.2152504538 0.0269396294 -0.0338676576 0.0001276038 0.0891456957 0.3680088628 0.0518851498 -0.2767130825 0.1877726315 -0.2064133580 -0.0028387370 -0.0075587555 0.0064152317 -0.0278909974 0.0183541153 -0.0172198268 0.0305196992 0.0341709855 -0.0088691081 0.0000784137 -0.0015675497 0.0004490779 0.0004639382 0.0012473312 0.0002285895 -0.0025565127 -0.0040131300 -0.0028788127 0.0181055226 0.0096350680 0.0097155709 -0.1707057271 0.0514096839 -0.1031162139 0.0372014355 -0.0059426228 0.0376823930 -0.1325324970 -0.1655069583 0.0467365345 -0.0381209269 -0.0156614782 -0.0158938253 0.3049927932 -0.0953734268 0.1591941261 0.1949378523 0.2643177138 -0.0776111186 -0.0020314256 0.0144502005 -0.0339535109 -0.0930197622 -0.2150136721 0.1806518922 0.1365345351 0.0746237901 0.2267375596 0.0287330229 0.0073038343 -0.0023809435 -0.1749598442 -0.0646528487 -0.1397059490 -0.1887845259 -0.0230637427 0.1676435854 0.0020545852 0.0041451459 -0.0030679642 0.0068163226 0.0038932904 -0.0044932324 -0.0335867251 -0.0220513773 -0.0001250090 -0.0040222673 0.0156572645 0.0034163816 -0.0009812963 -0.0007667587 -0.0011037318 -0.0071092247 0.0016545625 0.0014912056 0.0126370691 -0.0021960787 0.0073677881 0.0017137293 -0.0002744872 -0.0005337531 -0.0010523148 0.0022666869 0.0040986485 -0.0040059767 -0.0041357457 -0.0009710104 -0.0047638438 -0.0027924665 -0.0060838924 0.0240844816 0.0428849218 -0.0112811836 0.0166510915 0.0122303839 0.0539813603 -0.0023473567 0.0021277653 -0.0070882514 -0.0547783797 0.0482253470 0.0122275318 -0.0038752608 -0.0806743238 0.0667865890 0.0885342228 -0.0136813677 0.0351322103 0.0001709054 -0.0016038438 -0.0012272281 -0.0060679113 -0.0093530035 0.0150389467 0.0099138025 0.0494057874 -0.0504465392 -0.0220988942 -0.0161245332 -0.0058467049 -0.1901527979 0.0537726790 0.1386369650 0.3343154028 0.0771080050 0.1918187008 0.2200902986 0.1369246080 -0.2372612399 -0.0124612192 -0.0084216056 0.0023400768 0.0024197405 0.0290748589 -0.0037509939 0.0137320836 -0.0194016898 -0.0292759741 0.0028478806 0.0019216836 -0.0032475808 0.0107616325 -0.0055788513 -0.0043890575 -0.0161718215 -0.0045207928 0.0120862988 0.0007866819 0.0001328966 0.0002353352 0.0000719247 -0.0003817167 0.0001356437 -0.0047132328 0.0102512419 0.0006788289 0.0018380243 0.0095602299 0.0015747385 0.0139804573 -0.0359138745 -0.0977706783 0.0129815795 -0.1152073603 0.0500092963 -0.0437258515 -0.0013674907 0.0752325466 -0.0218945117 -0.0021267256 -0.0040756621 0.1535763064 -0.0493547795 0.0699304508 0.0891314156 0.1188931628 -0.0556473530 0.0016347817 0.0057626061 -0.0199301568 -0.0491749172 -0.1101693022 0.0921078880 0.0556435266 0.0471108207 0.1222562203 0.0097555789 -0.0015195797 0.0003723560 -0.0699952830 -0.0034470516 -0.0532808258 -0.0634108448 -0.0067594304 0.0547913025 0.0018480345 0.0145882812 0.0012868204 0.0050214852 0.0069017446 -0.0044981023 -0.0208427778 -0.0248411462 0.0132661242 0.0032945965 0.0003496698 -0.0056983929 0.0007777034 -0.0000845881 -0.0040639229 -0.0204272967 0.0148730321 0.0239355373 0.0022660605 -0.0250304934 0.0212815462 0.0045815207 0.0002237243 -0.0024012437 -0.0185099797 0.0151716628 0.0225038677 -0.0143015335 -0.0252234418 0.0106347585 -0.0050009355 -0.0020606365 -0.0056931822 0.0208824511 0.0349949699 -0.0109537197 0.0162785948 0.0097999654 0.0453959099 -0.0027478507 0.0022395815 -0.0060586006 -0.0437608211 0.0468513495 0.0102649241 -0.0029193013 -0.0778085025 0.0549504211 0.0843988510 -0.0123873520 0.0353517200 -0.0004403564 -0.0060555168 -0.0057190636 -0.0060945454 -0.0120822088 0.0149247397 0.0110498124 0.0424261547 -0.0448713931 0.0272663183 -0.0007636288 0.0216183720 0.0357730883 0.0970188160 -0.4506367847 -0.3136562878 -0.2838277986 -0.2506820448 -0.1312893652 0.1798319655 0.2566941144 -0.0041810519 0.0405372256 0.0077285384 -0.0543379301 -0.3650729884 -0.0534607243 0.2121776654 -0.1237001173 0.1984667853 -0.0004733000 0.0022590510 -0.0032591987 -0.0052662254 0.0034513048 0.0206379167 0.0072798370 -0.0088651091 -0.0145415251 -0.0010016287 0.0004876326 -0.0015654916 0.0000481116 -0.0003138972 -0.0002138135 0.0042295013 -0.0018261600 0.0020947166 -0.0096003171 0.0005525795 -0.0034256504 0.1176263522 -0.0545510504 0.0049301945 -0.0240039414 -0.0653009054 0.0001402590 0.0610994078 0.1003303135 0.0057367451 0.0083349533 0.0066672192 0.0067019605 -0.0915477511 0.0266550232 -0.0505804008 -0.0604560310 -0.0829964592 0.0111212686 0.0005033429 -0.0023251139 0.0033772410 0.0123310296 0.0236171000 -0.0215340054 -0.0146319196 -0.0085257720 -0.0239042693 -0.0093004540 -0.0016713902 0.0008056528 0.0570544100 0.0189166729 0.0448157170 0.0639051560 0.0056377762 -0.0547483914 -0.0001491109 -0.0040527556 -0.0020209809 -0.0007627986 0.0003123102 0.0035405326 -0.0149154610 0.0055484302 -0.0091942294 0.0007524571 0.0046069569 0.0043955042 -0.0042399874 -0.0008233543 -0.0043726167 0.0068361508 0.0005898028 0.0101046211 0.0532386373 -0.0039945310 0.0298104739 0.0214565006 0.0008660433 -0.0121834928 -0.1028641350 0.0762681478 0.1035984747 -0.0631272180 -0.1220297227 0.0552488947 -0.0280976531 -0.0043133992 -0.0261100898 0.1070997842 0.1300696229 -0.0601338063 0.0824131662 0.0392053141 0.1869516371 -0.0172691891 0.0125318275 -0.0364465352 -0.2310528422 0.3000429047 0.0560521817 -0.0139051457 -0.4700133358 0.3016478642 0.5070786211 -0.0670172795 0.2382698527 -0.0002157770 0.0020303096 0.0020341311 0.0020620566 0.0032595896 -0.0043304305 -0.0063422265 -0.0185536372 0.0200378082 -0.0026910938 0.0019345634 -0.0044163829 0.0143209007 -0.0262650338 0.0776220631 0.0245924131 0.0508832056 0.0283749602 -0.0002643240 -0.0527311521 -0.0232846517 0.0012771993 -0.0033336592 -0.0030761189 0.0001583492 0.0359533333 0.0090621156 -0.0218844504 0.0124605687 -0.0139221779 -0.0004995764 0.0006567768 0.0006606851 0.0054773317 -0.0047048573 0.0009505138 -0.0040081590 -0.0048250540 0.0019530449 0.0005777357 -0.0008020282 0.0001629515 -0.0001774348 0.0002528169 0.0000476763 -0.0015369287 0.0018595625 -0.0005220555 -0.0267402714 0.0157960909 0.0022114795 0.3681430711 -0.2232313520 -0.1479483525 -0.0796979093 -0.3527981137 0.0593070598 0.1324086495 0.2876759326 0.0960207628 -0.0422875724 0.0072174009 0.0049894744 0.2336730522 -0.0885352291 0.0710267804 0.1190466727 0.1572154763 -0.1151806895 0.0041841848 -0.0006534947 -0.0249540712 -0.0675202522 -0.1113261837 0.0992700834 0.0472303130 0.0570996226 0.1467111791 -0.0252510303 -0.0102628276 0.0049050653 0.1431802651 0.0883005022 0.1141275592 0.1905161543 0.0036768441 -0.1546058716 0.0008295432 0.0115087171 -0.0039637478 0.0016643103 0.0043102237 -0.0018535295 -0.0019115359 -0.0071179146 0.0076610633 0.0015272649 -0.0031982334 -0.0039313024 0.0007325883 -0.0002581160 0.0004907973 -0.0067919225 0.0013812620 -0.0013867072 -0.0053274670 -0.0007836080 -0.0021472570 -0.0039081520 -0.0001752969 0.0020826852 0.0220049484 -0.0145441138 -0.0180746292 0.0106015054 0.0226741612 -0.0112577385 0.0046393234 0.0000599471 0.0034002203 -0.0148501159 -0.0145517758 0.0088720319 -0.0136433577 -0.0036343179 -0.0219267889 0.0031766740 -0.0017319104 0.0051229505 0.0242683296 -0.0491149221 -0.0066272134 0.0013342024 0.0709605435 -0.0356050637 -0.0760406628 0.0085383944 -0.0415442229 -0.0000724257 -0.0031807125 -0.0024734948 -0.0026756691 -0.0079582788 0.0082976439 -0.0069293531 0.0117224645 -0.0159664857 -0.0020181088 0.0118925331 -0.0204052785 0.1098350626 -0.1219548918 0.2802610236 -0.0086880569 0.1945231264 0.0519931734 -0.0792773512 -0.2506534014 -0.0080974969 0.0041117358 0.0149408136 -0.0220132277 -0.0706985538 -0.0971413014 0.0239269285 0.0578899230 -0.0417737897 0.1047441665 -0.0055163821 0.0025270902 0.0079804551 0.0151289637 -0.0122347510 -0.0064729244 0.0004510042 -0.0155578295 -0.0073385659 0.0010014022 -0.0018066731 -0.0016677624 -0.0000329171 0.0017190436 -0.0000433448 0.0042936865 -0.0130629263 -0.0046403887 -0.0185558899 0.0054968542 0.0018774919 0.2397875678 -0.1302951499 -0.0458681403 -0.0664320835 -0.1711046570 0.0073163223 0.1166903988 0.1920098403 0.0148536430 -0.0173780826 0.0051898445 0.0052003664 0.0755425262 -0.0331721950 0.0133897017 0.0342667657 0.0443127430 -0.0495973393 0.0005836437 -0.0019507275 -0.0088907589 -0.0269453185 -0.0380406009 0.0347857577 0.0243119251 0.0164805801 0.0548320845 -0.0188225142 -0.0020081678 0.0021084351 0.1193901999 0.0448185976 0.0916418318 0.1429255786 0.0008012788 -0.1133282853 -0.0019112226 -0.0108948160 -0.0059087224 -0.0035387857 -0.0043485107 0.0032522011 0.0145697688 0.0189702384 -0.0104126957 0.0002957350 0.0028494521 0.0041658833 -0.0010365429 0.0003797278 0.0018948721 0.0142811060 -0.0086012219 -0.0126229961 0.0023573865 0.0139308296 -0.0094816643 -0.0021725516 -0.0002027857 0.0016789787 0.0126788374 -0.0099993771 -0.0150143614 0.0071845799 0.0165889661 -0.0089535301 0.0015245582 0.0004346914 0.0015747129 -0.0052032234 -0.0091148667 0.0029825216 -0.0054539767 -0.0021238394 -0.0115055264 0.0010486599 -0.0007515516 0.0013461377 0.0079329933 -0.0125105800 -0.0020050594 0.0005429972 0.0213104829 -0.0112097179 -0.0229423303 0.0031447273 -0.0101314727 0.0005908961 0.0059559547 0.0062187426 0.0043650522 0.0070142664 -0.0085399946 -0.0156488823 -0.0314383658 0.0317917598 -0.0034000464 -0.0178555264 0.0311065785 -0.1708467495 0.1699731210 -0.3584093778 0.0727843546 -0.2563274107 -0.0315540488 0.1541778604 0.3514122507 -0.0436340137 -0.0007500771 -0.0479682213 0.0372580986 0.1615549362 0.3774408236 -0.0118513414 -0.2333386583 0.1561130782 -0.2993884156 0.0093846532 -0.0061601467 -0.0121890249 -0.0269050626 0.0205001184 0.0063428647 -0.0007430696 0.0324384531 0.0168161936 -0.0002111468 0.0035913435 0.0034268676 -0.0012785040 -0.0039839671 0.0003977338 -0.0101994674 0.0222153850 0.0038289680 0.0003267602 -0.0003220888 -0.0011469422 -0.0037475474 0.0030380968 0.0026963219 0.0049738737 0.0017154146 0.0023056568 -0.0034949310 -0.0004887079 0.0056493319 0.0017395388 0.0010737438 0.0009958847 -0.0132066592 0.0028918470 -0.0108103065 -0.0090377171 -0.0124832949 0.0019703550 -0.0002511390 -0.0003354926 -0.0006712964 -0.0015775307 -0.0035845624 0.0022615445 0.0032921981 0.0011149784 0.0054761554 0.0003319507 0.0015011440 -0.0006482367 -0.0005798672 0.0004189159 -0.0013913560 0.0002723731 -0.0046084544 0.0026966873 -0.0011323993 -0.0039887588 0.0027949651 0.0011114148 -0.0000250926 0.0053197019 -0.0328941031 0.0023381529 -0.0151388262 0.0062246822 0.0129387261 0.0065951120 -0.0035766943 -0.0019548115 -0.0103110030 0.0027955083 0.0114906278 0.0344045121 0.0572836140 -0.0216712568 0.0411526052 -0.0039822548 -0.0010679846 -0.0036072949 -0.0336085563 0.0147849815 0.0169671277 0.0113917986 -0.0238634741 0.0299035291 0.0335509434 0.0295285290 0.0080677576 -0.0843539331 -0.2017424006 0.0236911405 -0.1207897473 0.0162395852 -0.1642280268 0.0389147574 0.0246410017 -0.0104900711 -0.5664123001 -0.3564547780 0.0841373606 -0.0245976374 0.0149205609 0.5015931209 -0.0119502267 -0.0892990604 -0.4208815965 0.0001409331 0.0011450849 0.0005904971 0.0020079728 0.0034320138 -0.0044466519 -0.0040508889 -0.0102952382 0.0099314352 0.0000645626 -0.0000039531 0.0000699782 0.0002528037 0.0003419699 -0.0020238860 -0.0011179535 -0.0013780189 -0.0010356885 -0.0004273947 0.0008409469 0.0009371021 -0.0000512285 0.0000551565 0.0001653289 0.0006511850 -0.0004287755 -0.0007813837 0.0000305651 0.0000289844 0.0001628267 0.0000066152 0.0005408978 -0.0001920877 0.0036870332 -0.0033189846 0.0029345290 -0.0018913149 -0.0047486040 -0.0004530537 -0.0002668350 0.0003251525 0.0001490247 0.0000570834 -0.0000181059 -0.0001080379 0.0006220534 -0.0024423424 -0.0002678190 -0.0221779537 -0.0187925395 0.0359097264 0.2768928616 -0.0667303855 0.2379732139 -0.3167317098 0.2182171981 -0.3091240592 0.3984296273 0.1713429845 -0.4994795062 -0.0204201811 -0.0096630188 0.0195716557 0.0544565305 -0.0636975114 -0.0195735912 0.0589565050 0.0641089384 -0.0375974390 0.0088554524 0.0023964981 -0.0046067250 -0.0118846664 0.0078671529 0.0061058506 -0.0016475466 0.0012387869 -0.0175151714 0.0300998371 0.0029428030 0.0006133836 -0.1951528416 -0.0740578104 -0.1485151470 -0.2355530433 0.0202164232 0.1787391483 0.0030038439 0.0106180910 -0.0036669486 0.0035823501 0.0042917527 -0.0033716236 -0.0111272692 -0.0156442943 0.0081851233 0.0025242531 0.0016354849 -0.0036407725 0.0009476578 -0.0000088338 -0.0015093021 -0.0106422872 0.0070964648 0.0104671376 -0.0047778667 -0.0113558097 0.0061313891 0.0002413367 0.0001984658 -0.0006899025 -0.0022669914 0.0030284797 0.0056604633 -0.0006784298 -0.0051907047 0.0039077732 0.0003939671 0.0001277668 0.0000243579 -0.0006383792 -0.0007666965 0.0002541410 -0.0014817051 0.0005718587 -0.0003649278 0.0004438214 0.0002095191 0.0000760065 -0.0051618771 -0.0052940032 0.0006410992 -0.0002927346 0.0021941259 0.0043038171 -0.0022156867 -0.0008180444 -0.0058187459 -0.0002454380 -0.0044649649 -0.0026423080 -0.0058881146 -0.0102138222 0.0124023689 0.0127720065 0.0348146958 -0.0344514640 0.0004916473 0.0000656607 -0.0007494124 -0.0009744304 0.0006222093 -0.0000409563 -0.0017509344 0.0000017000 -0.0019799011 -0.0025649641 0.0011569456 0.0033220063 -0.0011429216 0.0034856220 -0.0006705413 -0.0078173962 -0.0338454876 -0.0038293222 0.0219069839 -0.0145516336 0.0201019487 -0.0003928547 0.0006222582 -0.0000947221 -0.0020921738 0.0024061925 -0.0015309321 -0.0005122823 0.0035801658 0.0015843982 0.0007888741 -0.0051503183 -0.0003111385 0.0007059385 0.0024799008 0.0004225302 -0.0033124884 0.0080399750 0.0011190108 -0.0038602230 0.0007705868 -0.0003674525 0.0726158355 -0.0369782643 -0.0082835517 -0.0215950341 -0.0523060397 -0.0002387243 0.0397799496 0.0666781040 0.0079479027 -0.0056343553 -0.0004454550 0.0048193580 0.0039265101 -0.0035738698 0.0090263741 0.0117825680 -0.0025890414 -0.0459312826 -0.0148269610 0.0065448407 -0.0161030676 -0.0419311143 -0.1148213602 0.0780490956 0.1831696734 -0.0109583625 0.1046098289 0.0321114932 0.0632025412 -0.0258916919 -0.0968531457 -0.0292230005 -0.1163161660 -0.1023318551 -0.1308066689 0.1735357937 -0.0521942066 -0.2146319053 0.0913702764 -0.0525427408 -0.0654999072 0.0525611544 0.1762235791 0.2330434058 -0.1186845463 -0.0518607156 -0.0625091987 0.0457473995 -0.0074744864 0.0015537723 0.0173581682 0.1213562056 -0.0734222331 -0.1077033201 0.0401433771 0.1161611608 -0.0662345665 -0.0051988429 -0.0002611140 0.0017482167 0.0320205248 -0.0184136639 -0.0216151710 0.0044783492 0.0299379156 -0.0207879011 0.0012341646 -0.0013987181 0.0006246481 -0.0011621103 -0.0008935390 0.0019512176 -0.0062362685 -0.0004645390 -0.0027885706 -0.0017435062 -0.0012882791 0.0003475066 0.0240746842 0.0146784609 -0.0034576458 0.0007252335 0.0029280298 -0.0201365866 -0.0014539163 0.0039072139 0.0175026737 0.0026188405 0.0713500487 0.0476303563 0.0949371416 0.1627998040 -0.2182505414 -0.2087057238 -0.4718873841 0.4337978661 0.0008655294 0.0005059610 -0.0026921398 0.0094593858 -0.0070061012 0.0063635587 -0.0173831973 0.0099134052 -0.0075849371 -0.0180995894 -0.0088234441 0.0176408799 0.0011408801 0.0140482397 -0.0069798948 -0.0404348888 -0.1330791243 -0.0052587728 0.0725652196 -0.0477084167 0.0907831272 -0.0030117238 -0.0036533239 0.0107699874 0.0056840530 -0.0015721919 -0.0301207380 0.0373481272 -0.0106769011 -0.0400967325 -0.0108218911 0.0257608219 -0.0019477820 -0.0003293773 -0.0105929083 -0.0018620991 0.0580781158 -0.0810059618 0.0048763289 -0.0022425868 0.0004139581 -0.0007997226 0.0085865157 -0.0025678059 0.0001110569 0.0072641182 -0.0024184331 0.0077624622 0.0025046970 0.0076893702 0.0046753875 0.0081731679 -0.0005284833 -0.0018254170 -0.0493403545 0.0211704726 -0.0148759435 -0.0244278819 -0.0312490504 0.0141813344 -0.0049655661 0.0126952714 0.0066449284 0.0553631796 -0.0779228282 0.0121647405 0.0234102058 0.0067718052 0.0182197715 -0.0119236524 0.0133853353 0.0462498956 0.0027004766 -0.3034663922 0.0363700875 -0.0169320573 0.2998239024 -0.1138484961 0.0652072032 -0.2993382407 -0.5338505794 0.0131112664 -0.0125961176 -0.0183628884 -0.0251674174 0.0192462888 -0.0951557040 0.0245483371 0.1847409416 0.0502874107 -0.0000323956 0.0110460756 -0.0043700561 0.0458450916 0.0058872743 0.0375651075 -0.0374606769 -0.0266515747 0.0064265415 -0.0070358240 -0.0008188280 0.0052522321 0.0499201916 -0.0400369430 -0.0785736526 0.0633986404 0.0748090867 -0.0384409765 -0.0001494951 0.0010865891 0.0041014074 0.0106027282 -0.0048534345 -0.0008201473 -0.0055029030 0.0014870726 -0.0048836304 0.0005368050 -0.0011919127 -0.0003957432 -0.0047317878 -0.0019061311 -0.0005780748 -0.0008372770 0.0090828955 0.0059400056 -0.0061373497 -0.0010600971 -0.0034165018 -0.0137728433 0.2103146482 0.2484370205 -0.0649532332 -0.0155247493 0.1609687352 0.0568346588 0.0131483036 0.1844871953 0.0029296173 0.0012080221 0.0019227072 -0.0215365991 0.0155301532 -0.0062209157 0.0015084734 -0.0031605160 -0.0023750902 0.0073164432 0.0040769852 -0.0083723522 -0.0049445706 0.0105174121 -0.0085376189 -0.0721148739 -0.1431121683 0.0404831449 0.0900405817 -0.0669279072 0.0599648613 -0.0036692993 0.0153623924 -0.0155289565 -0.0452167630 0.0467734454 -0.0000179126 -0.0602453035 0.0732048379 0.0808736852 0.0201440777 -0.1425862745 0.0123646746 0.0111665488 0.0775851859 -0.0020148319 -0.1601064831 0.1972371827 0.0189116890 0.0006633120 -0.0027662058 0.0033210480 0.0078484627 -0.0044209189 0.0028312527 -0.0123357783 0.0088753410 -0.0144711849 0.0200634025 0.0137712008 -0.0208630514 0.0023208746 0.0007540252 0.0007729765 -0.0270923740 0.0141052158 -0.0047924947 -0.0148672508 -0.0231740863 -0.0014214711 -0.0017604731 -0.0014890998 -0.0018889590 -0.0078259570 0.0077902266 -0.0013080579 0.0091734727 -0.0021642915 0.0007831720 -0.0015688344 0.0044140298 0.0155039479 -0.0243580969 -0.0851669919 -0.0038694852 0.0067095430 -0.0319087202 0.0125939910 0.0287348498 -0.0387073999 -0.1527587662 0.0007206226 -0.0017393808 -0.0104820277 -0.0122520444 -0.0119357034 -0.0143896406 0.0132297705 0.0595615236 0.0142364528 0.0007950466 0.0027600642 -0.0011185010 0.0134466955 -0.0016470316 0.0122567217 -0.0088715330 -0.0058366051 0.0018323649 -0.0000496406 0.0001153888 0.0006173075 -0.0040988234 -0.0043185194 -0.0176241562 0.0108370841 0.0103079668 -0.0057379281 -0.0008500623 0.0008604579 0.0010633562 0.0053055808 -0.0017148232 -0.0027021953 0.0037066535 -0.0015154446 -0.0018108931 0.0007161782 -0.0000943724 -0.0000547072 -0.0037263811 -0.0001279323 0.0005892856 -0.0004210237 -0.0001642155 0.0015972925 -0.0014956413 0.0005686384 -0.0009676939 -0.0050434447 0.0425230682 0.0587956689 -0.0088324116 -0.0296118164 0.0805413349 0.0189765052 0.0727095461 -0.0026300626 -0.0033702571 -0.0078213236 0.0057727525 0.0155472211 -0.0160047247 -0.0047060499 -0.0218823204 0.0353819002 0.0082417202 0.0040752078 -0.0078005142 -0.0029568205 0.0009346453 0.0147694126 -0.0112401573 -0.0231991450 -0.0044127240 0.0015641489 -0.0187767935 0.0334800361 0.0538613504 -0.0058359222 -0.0509769870 0.0133976789 0.1790268533 -0.1727784004 -0.1015929485 0.0324450328 -0.1075343628 -0.0410773113 0.1015759111 0.6383662187 -0.0013612888 -0.1055151426 -0.4044553766 0.0114170231 0.2357702116 -0.3265212714 -0.2922205481 0.0001197376 -0.0001468711 0.0004050692 -0.0000499596 -0.0005865485 0.0003220712 0.0019003137 -0.0004892876 -0.0026126564 -0.0023340322 0.0025347794 -0.0020472294 -0.0001344779 0.0000436287 -0.0000437401 0.0001654762 0.0004347604 -0.0002205875 0.0009436462 -0.0006937804 0.0004360212 -0.0001136142 -0.0001593825 -0.0001148161 0.0006457316 0.0010883640 0.0012731419 0.0002092473 0.0003964263 -0.0001660692 0.0003634140 0.0002874129 0.0006490867 -0.0000155201 -0.0002541478 0.0000546334 -0.0033177267 -0.0055785618 -0.0054456430 0.0003196588 0.0000900001 -0.0002193546 0.0000567923 -0.0000487104 0.0010651498 0.0021823887 -0.0019590772 -0.0010352533 -0.0054024251 -0.0014132705 -0.0083805857 -0.0001277997 -0.0001940459 0.0001704765 0.0000386897 0.0008813112 -0.0003452858 -0.0000069163 -0.0000301793 -0.0003047725 0.0000056639 -0.0000052838 0.0000483046 0.0004274636 0.0010407456 -0.0002734092 0.0003927365 -0.0006903118 -0.0006496488 0.0000391483 0.0000184016 0.0001198679 -0.0001880813 0.0001234889 -0.0010935075 -0.0001549656 -0.0004123238 0.0001089922 0.0000412884 -0.0000234446 0.0000348850 -0.0001319752 0.0000258100 -0.0003105648 -0.0004277343 -0.0000611523 -0.0000114763 0.0001044765 0.0003288993 -0.0000962705 -0.0001810085 0.0000601868 0.0001791440 -0.0004297443 0.0005378674 0.0010317552 0.0004250060 -0.0075678742 -0.0063461823 0.0003437641 -0.0000960119 -0.0005766934 0.0023251496 0.0035468640 0.0010336242 -0.0023471597 -0.0028070615 0.0058094209 -0.0037450846 0.0010999455 -0.0024100300 -0.0001226882 -0.0000247679 0.0004319298 0.0042969708 -0.0010939565 0.0042020944 -0.0048721863 -0.0031165387 0.0012680735 0.0045919157 -0.0056695455 0.0059235367 0.0413073619 0.0351473143 0.0062509673 -0.0979286180 0.0414705802 -0.0890319345 0.0473569587 0.0253632820 -0.0640578170 -0.0000786128 0.0015152667 0.0003703876 -0.5531683118 -0.3241782885 0.7477521664 0.0000184987 -0.0001437321 -0.0001356991 0.0007390608 0.0014680350 -0.0006209179 -0.0015125868 0.0004426010 0.0018060107 0.0006518748 -0.0003258052 0.0005006796 0.0001377777 -0.0000932490 0.0000550962 -0.0002981052 0.0002391339 0.0000052494 -0.0013994651 0.0007996492 -0.0005928949 -0.0000951597 -0.0003438897 0.0003300581 -0.0012624436 -0.0010444492 -0.0017453252 0.0021757271 0.0050349549 -0.0022913265 -0.0005502874 -0.0001055539 0.0001530215 0.0030682554 -0.0009387512 -0.0043814329 0.0022977514 0.0016844174 0.0034255208 0.0008523811 -0.0004334097 -0.0012798399 0.0337672379 -0.0326702496 0.0557573503 -0.0779228228 0.1486872627 0.1673209215 -0.3204393786 0.2507725746 -0.8378611990 0.0068133777 0.0109659929 -0.0100532330 -0.0503596244 -0.2022141113 0.0672858990 -0.0326143556 0.0681999567 0.0640870343 0.0000088426 -0.0006023510 -0.0001559505 0.0017479644 0.0102757402 -0.0042856404 -0.0012846207 0.0007730802 0.0006785082 0.0000875636 -0.0000907774 0.0002840646 -0.0008107758 -0.0001611593 -0.0025771574 -0.0008198852 -0.0001884270 -0.0002484581 0.0001266243 -0.0001021425 0.0002686143 -0.0004880575 0.0005160815 -0.0026297747 -0.0007798380 -0.0000704476 0.0000860503 0.0003091031 0.0009447496 -0.0002092766 -0.0001078511 0.0004202321 0.0003053717 -0.0005032533 -0.0014892527 0.0002965896 -0.0041559201 0.0067261668 0.0063314428 0.0000810991 -0.0000047782 -0.0000857885 0.0003805683 0.0005621045 0.0002092797 -0.0002516132 -0.0006526353 0.0012822632 -0.0004262321 0.0000049371 -0.0007698322 0.0003039565 0.0002471174 0.0004435492 -0.0028157884 0.0011300335 -0.0035044207 -0.0012204857 -0.0028773833 -0.0012127097 -0.0056561677 0.0039677651 -0.0056228367 -0.0116897696 -0.0106970628 -0.0016974879 0.0779359053 -0.0353026501 0.0687706033 0.0010693332 0.0004315329 -0.0001311472 -0.0001128241 -0.0002443843 -0.0001524572 -0.0093968632 -0.0028826341 0.0026637325 0.0000431822 0.0001589674 0.0002056404 -0.0010684109 -0.0022508175 0.0008707466 0.0020001761 -0.0006249218 -0.0023387543 -0.0013951376 0.0009850809 -0.0009112290 -0.0001982952 0.0001246031 -0.0000852720 0.0003438703 -0.0000477770 0.0000087634 0.0019408153 -0.0012069192 0.0008616167 0.0000861348 0.0004325225 -0.0004979156 0.0020585416 0.0018707391 0.0028199065 -0.0029396036 -0.0070089342 0.0031352266 -0.0000233380 0.0000398098 0.0000898287 0.0006320390 -0.0000245315 -0.0007488032 -0.0000728995 -0.0003836512 -0.0002967810 -0.0000150727 -0.0000629077 0.0004108940 -0.0034069973 0.0036001362 -0.0054675087 0.0101422761 -0.0175561713 -0.0195081282 0.0320881955 -0.0264843693 0.0856373169 -0.0018544375 -0.0031386446 0.0028219813 0.0137418421 0.0538394549 -0.0181586109 0.0081876689 -0.0165818622 -0.0159070410 -0.0000732274 0.0000889069 0.0000381371 0.0000643402 -0.0010472346 0.0005794331 0.0006326005 -0.0006610739 -0.0006889919 -0.0000518995 -0.0000558114 -0.0000789973 0.0004621336 0.0000023292 0.0012513936 0.0003578396 0.0008298883 -0.0001885469 -0.0000974496 0.0000266546 -0.0000530014 0.0000910384 -0.0000961347 0.0003872346 0.0009585414 0.0000682106 0.0000676238 -0.0000664568 -0.0003205457 0.0000969575 -0.0000681835 -0.0000883341 -0.0001075989 -0.0001110652 0.0005829321 0.0002118248 0.0000113672 -0.0030600380 -0.0025583082 0.0015315925 -0.0011420429 0.0002995454 0.0084481532 0.0138639961 0.0026795205 -0.0028917301 -0.0060039051 0.0117787705 -0.0167422292 0.0034797231 -0.0188977378 0.0015230292 -0.0000488175 0.0030134823 -0.0300856757 0.0099244775 -0.0281812205 -0.0025708505 -0.0082158352 -0.0025280134 -0.0470385332 0.0365971570 -0.0465573313 -0.1143538223 -0.1201019378 -0.0377005466 0.6902712450 -0.3103866397 0.5960546698 0.0060337504 0.0029245961 -0.0106103295 0.0000075140 0.0001401269 0.0002810559 -0.0795186569 -0.0414205465 0.1094971792 -0.0000047378 -0.0002917723 -0.0003413567 0.0017111698 0.0035532181 -0.0013872069 -0.0036424985 0.0011230428 0.0041940595 0.0019838566 -0.0013948828 0.0011854399 0.0002697066 -0.0001409351 0.0000657582 -0.0006141021 -0.0002471044 0.0004979885 -0.0026284789 0.0016840433 -0.0010549949 -0.0002751870 -0.0012512453 0.0012093607 -0.0044039256 -0.0037784724 -0.0058722076 0.0074521101 0.0185253783 -0.0083442084 -0.0004605573 -0.0001723543 0.0000424736 0.0027761193 -0.0005405124 -0.0037080654 0.0025917351 0.0019934454 0.0037038525 0.0002933895 -0.0001575549 -0.0007232025 0.0098770462 -0.0089130432 0.0137245949 -0.0244597918 0.0427816433 0.0459148886 -0.0844343542 0.0622272099 -0.2080727136 -0.0293620685 -0.0455316203 0.0450491166 0.2187307641 0.8082371800 -0.2719606191 0.1346692520 -0.2637743040 -0.2561045057 -0.0007335265 0.0020071606 -0.0015074570 -0.0075360210 -0.0255593785 0.0091581356 0.0040946372 -0.0024757632 -0.0015667497 0.0017537386 0.0041420954 0.0011429383 -0.0061397926 0.0043517858 -0.0276937862 -0.0107665255 -0.0504827654 0.0182792032 0.0001559744 -0.0002031873 -0.0016662971 0.0037631956 -0.0033267725 0.0217130082 -0.0076348020 -0.0007020239 -0.0016023460 0.0012605059 0.0057643856 -0.0019642324 -0.0001234350 0.0002143977 0.0002513109 -0.0003592458 -0.0004311420 -0.0004206860 -0.0020084947 0.0054382055 0.0060293915 -0.0005006004 0.0004061968 0.0000562999 -0.0029884404 -0.0050822027 -0.0011183391 0.0021579487 0.0020813239 -0.0050163886 0.0062906286 -0.0016380906 0.0055731717 0.0000417669 -0.0000316327 -0.0000380895 0.0004888117 0.0000329975 -0.0000189213 0.0002095503 0.0005240935 0.0000006883 0.0015759971 -0.0013495852 0.0015321154 0.0048939525 0.0049439204 0.0020802620 -0.0253927203 0.0113423696 -0.0209697671 0.0001817447 0.0001091848 0.0009020880 -0.0001558134 -0.0003026119 -0.0000882496 0.0029314605 0.0026841200 -0.0072951348 0.0013053775 0.0000090245 -0.0002377704 -0.0015774191 -0.0046874351 0.0045878335 -0.0039277684 0.0023839012 0.0050790157 -0.0096022746 0.0073585703 -0.0057375278 -0.0157863291 0.0086365998 -0.0068208565 0.0035315373 0.0203328514 -0.0083459272 0.1828993910 -0.1325728419 0.0845122808 -0.0048022281 -0.0455123180 0.0524653632 -0.2301817112 -0.1988306106 -0.2942150217 0.2867187984 0.7445120115 -0.3250272307 0.0065289284 0.0008483913 -0.0047798704 -0.0589343358 0.0024249941 0.0916803474 -0.0202171678 -0.0165606148 -0.0332602026 0.0004352604 0.0008639397 -0.0004032738 -0.0003829807 0.0003450313 -0.0006865748 0.0005107149 -0.0008811845 -0.0011614869 0.0035494322 -0.0027694856 0.0092611189 0.0005811855 0.0006539663 -0.0008957020 -0.0039787837 -0.0140580207 0.0046350218 -0.0030899908 0.0060111501 0.0058393242 -0.0000361642 -0.0001160262 0.0001068082 0.0005224490 0.0018147059 -0.0004054352 0.0002462609 -0.0004929186 -0.0004656372 -0.0003282847 -0.0005229211 -0.0003315404 0.0019200696 -0.0006715582 0.0061835321 0.0018444764 0.0067144560 -0.0023930871 -0.0000853555 0.0000061152 0.0000492946 -0.0000953152 0.0000881769 -0.0007319700 0.0009935106 -0.0000345666 0.0001189828 0.0001106456 0.0000322698 0.0000753165 -0.0000950484 -0.0002703927 -0.0000802902 0.0000704608 -0.0002166837 0.0001851267 -0.0002730011 0.0009055544 0.0006874381 0.0006857461 -0.0005388353 -0.0001630949 0.0041635724 0.0069948420 0.0016019835 -0.0034217937 -0.0030555171 0.0076840684 -0.0085191293 0.0022397787 -0.0073650829 -0.0000516423 0.0000239064 -0.0000120352 0.0001432412 0.0002432409 0.0003814486 -0.0001966745 -0.0002442100 -0.0001222519 -0.0003086715 0.0003198924 -0.0003261351 -0.0013146118 -0.0013561453 -0.0004334868 0.0055442440 -0.0025128274 0.0045464591 -0.0001460261 -0.0000993707 -0.0001356895 0.0000651136 0.0000995566 0.0000417361 -0.0001925334 -0.0003146951 0.0007752811 -0.0003192662 -0.0004248049 -0.0004257308 0.0032440302 0.0070451228 -0.0027569158 -0.0043585486 0.0014073640 0.0049642821 0.0047298389 -0.0035797543 0.0025859850 0.0013651664 -0.0004248738 0.0003811667 -0.0020665814 -0.0048866383 0.0020114184 -0.0138452263 0.0100199020 -0.0061910094 -0.0000325247 0.0005008465 -0.0006833599 0.0035729234 0.0029094804 0.0043428748 -0.0032473628 -0.0088423105 0.0037475310 0.0003850512 0.0001018037 -0.0000921547 -0.0026179963 0.0003120152 0.0034238179 -0.0020393696 -0.0011750370 -0.0025170141 -0.0000594039 0.0000372109 0.0000339843 0.0001450248 -0.0001926861 0.0001843537 -0.0005848747 0.0009033913 0.0010590578 -0.0011942895 0.0010412170 -0.0032027238 -0.0002617627 -0.0002294993 0.0003962751 0.0017237162 0.0057447709 -0.0018130530 0.0015579566 -0.0029804867 -0.0029398722 0.0000869176 -0.0001705506 -0.0002318288 -0.0000735958 -0.0001694391 -0.0000533469 -0.0013253650 0.0023464582 0.0025610025 0.0013478380 0.0023647630 0.0010722366 -0.0073981580 0.0024834106 -0.0229001935 -0.0084869162 -0.0304294620 0.0105190710 -0.0002851280 0.0000103541 0.0000270416 -0.0004980248 0.0001720401 -0.0013866309 0.0043862149 0.0004809465 0.0006044859 -0.0004107676 -0.0009351845 0.0002661442 0.0000762056 0.0000014808 0.0000098352 0.0000534208 -0.0000332423 -0.0000028067 -0.0001969324 0.0004591547 0.0001509646 0.0384356758 -0.0341527147 -0.0099289684 0.2572146996 0.4343203212 0.1000631109 -0.1981457743 -0.1736925737 0.4417085143 -0.5083224189 0.1382774689 -0.4313309152 -0.0028616152 0.0008255715 -0.0005803576 0.0198487094 -0.0080528483 0.0159125487 0.0054408568 0.0063221618 0.0003514596 0.0016350602 -0.0008547270 0.0017602135 -0.0008380923 -0.0018877875 -0.0011294322 -0.0197688009 0.0097173335 -0.0198043539 -0.0006450008 -0.0000704899 0.0007296972 0.0000462905 -0.0000548520 -0.0000510044 0.0075153042 0.0030245508 -0.0099563285 0.0005034091 0.0011419767 0.0008398318 -0.0077027932 -0.0165679805 0.0065826024 0.0105309617 -0.0033187182 -0.0117823916 -0.0086686073 0.0066197759 -0.0044947984 0.0003555081 0.0000838948 -0.0000570078 -0.0015073628 -0.0035720146 0.0014317187 -0.0028943778 0.0021748239 -0.0011602812 -0.0000016074 -0.0003946846 0.0005405707 -0.0025934893 -0.0022778076 -0.0032047512 0.0027183663 0.0070892276 -0.0030390051 0.0002559461 0.0000566762 -0.0001604159 -0.0021398467 0.0001413683 0.0031751430 -0.0008906233 -0.0006991601 -0.0014226886 -0.0000420946 -0.0000435682 -0.0000006908 -0.0006972115 0.0005416718 -0.0005961403 0.0019200128 -0.0038177472 -0.0042802989 0.0058229372 -0.0035223495 0.0129119494 0.0016558317 0.0017074758 -0.0030854806 -0.0097469965 -0.0410910010 0.0156763215 -0.0092904184 0.0181226293 0.0178599899 0.0014653273 -0.0056560093 -0.0039941044 0.0071113650 0.0194067079 -0.0089435095 -0.0285607224 0.0515723054 0.0553355097 0.0317085083 0.0552277460 0.0244389237 -0.1735410953 0.0582167108 -0.5315369164 -0.2006893126 -0.7133868227 0.2470204954 -0.0120788838 0.0038577339 0.0034527295 -0.0251620792 0.0116477932 -0.0929467623 0.1956739396 0.0187454770 0.0249829539 -0.0266571508 -0.0788572180 0.0234720510 0.0000500531 0.0000237289 -0.0000121495 0.0000358927 0.0000322303 0.0000586201 0.0000694478 -0.0004229509 -0.0005287159 -0.0015827521 0.0014238896 0.0004019116 -0.0106804276 -0.0180244366 -0.0041482359 0.0081737540 0.0071320855 -0.0181828612 0.0210837990 -0.0057526116 0.0178587601 0.0001158419 0.0000066940 0.0000183609 -0.0006925352 0.0002700948 -0.0004472525 -0.0004657907 -0.0007022236 -0.0000976123 -0.0001854155 0.0001625561 -0.0002005247 -0.0006112465 -0.0004790521 -0.0001508121 0.0031267835 -0.0014213036 0.0026442741 -0.0001032904 -0.0000763994 -0.0000601965 0.0000375097 0.0000670484 0.0000095093 0.0000080374 -0.0001182742 0.0003125413 0.0135225010 0.0350827107 0.0282050057 -0.2383308617 -0.5103000822 0.2020333742 0.3489443113 -0.1084787179 -0.3882328487 -0.2682940357 0.2055036146 -0.1383565047 0.0314402601 -0.0102867387 0.0064466892 -0.0471542051 -0.1221670019 0.0527638323 -0.3292423963 0.2409249416 -0.1419959277 -0.0026220984 -0.0082550923 0.0043909224 -0.0036073638 -0.0040097074 -0.0033938305 0.0372575427 0.1002808325 -0.0437015351 -0.0007182284 -0.0004260361 -0.0012313655 -0.0013822483 -0.0001633001 0.0033118345 0.0079578270 0.0053938254 0.0085979505 0.0000558615 0.0001514722 -0.0001427008 0.0000790641 -0.0000873671 0.0001072303 -0.0002927557 0.0005449761 0.0005803673 -0.0007615319 0.0005656557 -0.0018126260 -0.0000585127 -0.0002699535 0.0000933934 0.0008227006 0.0031356039 -0.0012012159 -0.0000996904 0.0002161284 0.0002706836 -0.0000552957 0.0002514747 0.0001343769 -0.0002485203 -0.0013367159 0.0005302443 0.0010904246 -0.0018070941 -0.0020587100 -0.0008505633 -0.0013139886 -0.0008509943 0.0051625156 -0.0017744028 0.0159117088 0.0048567134 0.0174438601 -0.0060240096 0.0004950263 -0.0000926785 -0.0002379208 0.0012270196 -0.0004370527 0.0045256250 -0.0077427510 -0.0005743319 -0.0009867685 0.0006076211 0.0020119690 -0.0005640291 -0.0000258692 -0.0000275975 0.0000113364 -0.0001014037 0.0001947439 0.0002022948 -0.0002538581 -0.0024397423 -0.0023283596 0.0001516012 -0.0001560987 -0.0000441878 0.0011698469 0.0019742266 0.0004539553 -0.0008459599 -0.0007165938 0.0018731361 -0.0021053289 0.0005847884 -0.0017932605 -0.0000122806 -0.0000400174 0.0000013869 -0.0001267483 0.0000636843 -0.0001507585 0.0003076187 0.0005077699 0.0000585349 0.0000978770 -0.0000275877 0.0000799914 -0.0000108405 0.0000899179 0.0000882221 -0.0011136226 0.0005189633 -0.0009210661 -0.0001776850 -0.0001988684 0.0001988300 -0.0000069144 0.0000584666 -0.0000113689 0.0016183500 0.0009957778 -0.0022326986 0.0150744646 0.0160571629 0.0144833999 -0.1286454963 -0.2810396668 0.1076820356 0.1470598185 -0.0495819790 -0.1686737321 -0.1910942667 0.1459031202 -0.1009661370 -0.0597998381 0.0112538227 -0.0119346403 0.1194406317 0.2867059122 -0.1181553245 0.5799656574 -0.4224953281 0.2533412294 0.0084731001 0.0175607176 -0.0059217241 -0.0233502956 -0.0151182713 -0.0253702005 -0.0752344652 -0.1943216851 0.0891799442 -0.0081860217 -0.0029654697 0.0013964758 0.0528376413 -0.0022829082 -0.0805465261 0.0482470506 0.0351868514 0.0665199971 -0.0000903486 -0.0002193646 0.0001323889 0.0002028691 -0.0002092649 0.0003052071 -0.0005895939 0.0012597607 0.0013335899 -0.0016095964 0.0013487921 -0.0044999217 -0.0005320678 0.0011838572 0.0010420549 -0.0003366008 -0.0011770849 0.0006877939 0.0067528819 -0.0128422908 -0.0131212495 0.0001609679 -0.0001954612 -0.0004015040 -0.0007063425 -0.0018336129 0.0002918848 -0.0020036076 0.0037466592 0.0039339464 0.0003277238 0.0007741964 0.0005387461 -0.0023515294 0.0006782846 -0.0080571117 -0.0021856031 -0.0089925468 0.0028198711 0.0023935566 -0.0031827644 -0.0016124761 0.0088350066 -0.0048691662 0.0377526753 -0.0504556015 -0.0041338984 -0.0056637817 0.0141760906 0.0462103118 -0.0137386309 0.0000275900 0.0001441798 0.0000169422 0.0000918229 -0.0003801425 -0.0004157269 -0.0001154084 0.0026161913 0.0038532895 0.0007378724 -0.0007272023 -0.0002291171 0.0054372654 0.0092302327 0.0021356458 -0.0040211810 -0.0034886945 0.0089362550 -0.0102014760 0.0028432312 -0.0085628136 -0.0000480356 0.0000530000 -0.0000219363 0.0006860335 -0.0004831181 0.0004474230 0.0001354444 -0.0000679148 0.0000136185 0.0002695976 -0.0001766291 0.0002704221 0.0004303126 0.0005026146 0.0002233115 -0.0041333764 0.0019260857 -0.0034541735 -0.0000683569 -0.0001333779 0.0002488117 -0.0000570607 0.0000323067 -0.0000523022 0.0015913107 0.0010572730 -0.0025437878 0.0013511679 0.0013386230 0.0012475742 -0.0110776593 -0.0242113329 0.0092474198 0.0124507746 -0.0042084196 -0.0142836480 -0.0169136643 0.0129556895 -0.0089364315 -0.0047628563 0.0012147231 -0.0011038983 0.0083026138 0.0202613305 -0.0082196541 0.0475697428 -0.0347586928 0.0208097899 0.0005648130 0.0013670020 -0.0007006976 -0.0000982900 0.0003210720 0.0002275853 -0.0064595907 -0.0166594745 0.0075454489 -0.0010505678 -0.0003749924 0.0001710579 0.0068086209 -0.0003543922 -0.0101830616 0.0059651049 0.0043726949 0.0083380660 0.0000229549 0.0000733698 0.0000365806 -0.0002844000 0.0009466314 0.0023613985 0.0092826847 -0.0172631708 -0.0171239899 -0.0054448298 0.0041318624 -0.0129451698 0.0021214915 -0.0143155658 -0.0051341451 0.0234481272 0.0837452252 -0.0304344357 -0.0473453247 0.0887651966 0.0929506069 -0.0008081114 0.0030752767 0.0028448877 -0.0042598340 -0.0063774737 0.0027045772 0.0168767181 -0.0319601109 -0.0338604851 -0.0057776720 -0.0148109419 -0.0039138822 0.0281643967 -0.0081859421 0.0914978607 0.0481556808 0.1745984660 -0.0575705384 -0.0275448243 0.0369386218 0.0202265775 -0.1082030549 0.0573537861 -0.4559418150 0.5895062579 0.0468364656 0.0659770977 -0.1646389013 -0.5335867814 0.1589339079 -0.0000494574 -0.0000354192 -0.0000018642 -0.0000758939 -0.0000609700 -0.0000597737 -0.0000326196 0.0015039951 0.0009939208 0.0002307432 -0.0002552487 -0.0000851994 0.0019286793 0.0032550055 0.0007481066 -0.0013658416 -0.0011704144 0.0030090599 -0.0033295734 0.0009201985 -0.0028012702 -0.0000114553 -0.0000571385 0.0000129628 -0.0001756577 0.0000503064 -0.0002747294 0.0004046385 0.0006991821 0.0001315532 0.0001091511 -0.0001327197 0.0001214298 0.0006532699 0.0006347382 0.0002258243 -0.0022483190 0.0009952773 -0.0017958219 0.0000830427 0.0000635333 0.0000860482 -0.0000378345 -0.0000653165 -0.0000150219 0.0001116833 0.0002105308 -0.0005317551 0.0001594170 0.0002498741 -0.0002599453 -0.0012462675 -0.0028329777 0.0010882381 -0.0013640807 0.0003521363 0.0015116757 0.0006532066 -0.0004567429 0.0004322531 0.0002062505 -0.0001372657 0.0000740415 -0.0002381141 -0.0005907284 0.0005957569 -0.0023305375 0.0018241234 -0.0010976767 -0.0003924779 -0.0004881885 -0.0002055560 0.0031835736 0.0025700906 0.0041204831 0.0015294068 0.0035175704 -0.0017842184 0.0005013801 0.0001808048 0.0001003796 -0.0024859493 0.0000678701 0.0037574282 -0.0032984855 -0.0024198219 -0.0046105457 -0.0000772288 -0.0002342880 -0.0001351392 0.0068401905 -0.0139328681 -0.0214178893 -0.1059852367 0.1983860774 0.2008155341 0.0226690084 -0.0212022896 0.0609856937 -0.0167762538 0.0712305140 0.0373253357 -0.0923872451 -0.3194884851 0.1167767209 0.2987366370 -0.5398164462 -0.5618630533 0.0058700853 -0.0076436432 -0.0100660322 0.0012509000 -0.0116603836 0.0032663481 -0.0697979152 0.1107640608 0.1166516204 -0.0008297555 -0.0077843505 0.0064305561 -0.0150505121 0.0034208417 -0.0477936719 0.0232777695 0.0849319394 -0.0281634982 -0.0078694308 0.0089555148 -0.0023999022 -0.0067000343 0.0035272466 -0.0181881792 0.1293877981 0.0102886096 0.0115901393 -0.0364157795 -0.1178542124 0.0346559195 0.0000587373 0.0001252046 -0.0000567023 0.0002191932 -0.0000469034 -0.0002910335 -0.0001072459 -0.0045368183 -0.0011099538 -0.0000478785 0.0000232932 0.0000425739 -0.0002561382 -0.0004325735 -0.0000970040 0.0003620302 0.0002984479 -0.0007687969 0.0004878686 -0.0001398286 0.0003982255 -0.0000097940 0.0000264735 -0.0000108048 0.0001505540 -0.0000717314 0.0002100036 -0.0001232003 -0.0002602202 -0.0000815544 -0.0001694663 0.0000030152 -0.0001092191 0.0004621850 0.0007456721 -0.0001000850 0.0018857041 -0.0006923003 0.0015395135 0.0001155629 0.0000279011 -0.0001864566 -0.0000193524 -0.0000125524 0.0000145351 -0.0008947942 -0.0004869807 0.0020693834 -0.0008880974 -0.0052796372 -0.0011260108 0.0266476698 0.0581188655 -0.0226049430 -0.0232220288 0.0078371498 0.0284974308 0.0086317109 -0.0073357919 0.0020747770 0.0093843183 -0.0024182524 0.0015116956 -0.0142577867 -0.0347001362 0.0148119480 -0.0910746110 0.0652281977 -0.0372300516 0.0153505531 0.0120594933 0.0200449464 -0.1739949538 -0.1464293812 -0.2338080340 -0.0040430816 -0.0039725931 0.0039752751 -0.0613273495 -0.0195712298 0.0071927909 0.3844256019 -0.0254839053 -0.5590923901 0.3342994781 0.2514361401 0.4791985149 0.0001014429 0.0017505259 0.0007006028 -0.0000437242 -0.0001786094 -0.0013920210 -0.0037687739 0.0065919006 0.0068283920 0.0041001093 -0.0040966653 0.0111943245 0.0001062156 0.0008883718 -0.0000425613 -0.0028231020 -0.0089863337 0.0030067335 0.0014496172 -0.0022555071 -0.0026701128 -0.0003079930 -0.0006292413 0.0004259783 0.0028712829 0.0094144556 -0.0028132002 0.0010160454 -0.0018671217 -0.0016775713 0.0000032953 0.0009034021 -0.0010401100 0.0028705861 -0.0007523879 0.0090179839 -0.0029872400 -0.0101551445 0.0033267048 -0.0001533204 -0.0001910079 -0.0000090127 0.0001607040 -0.0000201645 0.0005208626 0.0008565994 0.0000486198 0.0001197594 0.0007450540 0.0022784438 -0.0005870279 -0.0000037443 -0.0001509298 -0.0004660037 -0.0001686920 -0.0000574392 -0.0000575285 0.0002403108 -0.0024859137 -0.0033123400 0.0000650539 -0.0000933094 -0.0003608534 0.0012568904 0.0022931007 0.0005217967 -0.0015278667 -0.0014022931 0.0034303503 -0.0004403603 0.0002166670 -0.0002525293 -0.0000137796 0.0013170138 -0.0003439332 0.0074885297 -0.0031083642 0.0069537607 -0.0070619403 -0.0130364055 -0.0020561108 -0.0000662973 -0.0000430424 -0.0000013911 -0.0001208089 0.0000964264 -0.0002800548 0.0005022551 -0.0000081561 -0.0000809852 0.0002650526 0.0007725494 -0.0004460665 -0.0000425625 -0.0002414992 -0.0001470734 -0.0026970449 -0.0029941099 0.0043729566 -0.0000190261 -0.0001802131 0.0000140405 0.0008845565 0.0020027041 -0.0007033972 -0.0005615023 0.0002165696 0.0006498315 0.0000265688 -0.0000858426 -0.0000727728 0.0001751681 0.0004448338 -0.0001777573 -0.0019869535 -0.0045753403 0.0020251655 0.0001729031 -0.0001500670 0.0001261321 -0.0017597948 -0.0024800918 -0.0010463919 0.0153667830 0.0126209861 0.0203740974 0.0059751824 0.0167759641 -0.0077332286 -0.0020201275 -0.0004820010 0.0007042716 0.0144360012 -0.0008778503 -0.0210612686 0.0087813167 0.0065836814 0.0126676562 0.0001955506 -0.0001647028 -0.0002516821 -0.0021409340 0.0049961632 0.0071816207 0.0337892871 -0.0660325434 -0.0672786597 -0.0098431002 0.0077103146 -0.0218984563 0.0031206591 -0.0100340418 -0.0056897117 0.0107327630 0.0402579615 -0.0164047115 -0.0459563202 0.0824266922 0.0852387417 0.0290728015 0.0149799067 -0.0433961844 -0.1434010312 -0.5185651707 0.1706311669 -0.2018359455 0.3331831329 0.3435154750 0.0037336590 -0.0313791154 0.0473077550 -0.1497066040 0.0389737005 -0.4548569761 0.0978795709 0.3382354653 -0.1082378687 0.0011646162 0.0032611086 -0.0063930240 0.0186121742 -0.0092314113 0.0747428052 -0.0222963843 -0.0011999927 -0.0041175559 -0.0092107150 -0.0310344295 0.0079772907 0.0001566376 0.0001718673 0.0001621376 0.0000780699 -0.0000473785 0.0001977048 -0.0002576907 0.0010502910 0.0004874033 -0.0000011531 0.0000219704 0.0000347949 -0.0002401760 -0.0004073296 -0.0000940547 0.0001878884 0.0001583532 -0.0004149208 0.0001007397 -0.0000312758 0.0000907480 -0.0000128389 0.0001505502 -0.0000570884 0.0009648993 -0.0003480434 0.0009571887 -0.0008646464 -0.0015394496 -0.0002294323 0.0000872112 0.0001164641 0.0000239462 -0.0009711111 -0.0013314603 -0.0002837237 0.0001914121 -0.0001178819 0.0000349867 -0.0000803247 -0.0000191867 -0.0000533689 0.0000296653 0.0000436757 -0.0000002382 -0.0001054558 -0.0002391719 0.0003626031 -0.0019495093 0.0012788438 -0.0012267289 -0.0019178733 -0.0047025876 0.0000564062 0.0007426133 -0.0002776191 -0.0006948947 0.0203688175 -0.0150353711 0.0104674685 0.0068269518 -0.0126253238 0.0066501267 0.0357563297 0.0797242466 -0.0309989049 -0.1114885745 0.0779834038 -0.0470402923 0.0473169318 0.0596679794 0.0366360375 -0.4444172447 -0.3690603890 -0.5927980827 -0.1263280851 -0.3432803251 0.1592648314 0.0210931974 0.0039223600 -0.0133947145 -0.1784681440 0.0086596012 0.2584325762 -0.0667137984 -0.0474898305 -0.0966495823 0.0002118472 -0.0003909244 -0.0001650346 0.0000130060 0.0001947138 0.0006316749 0.0019856967 -0.0037505247 -0.0038668709 -0.0018019269 0.0014708876 -0.0042827900 -0.0000098415 -0.0002615746 0.0000710007 0.0007754078 0.0032295703 -0.0013785131 -0.0003794186 0.0005304819 0.0005476786 0.0013235382 0.0003595167 -0.0020290206 -0.0061718174 -0.0218257536 0.0074478531 -0.0098757088 0.0163985694 0.0168920371 0.0000279544 -0.0014240215 0.0017952254 -0.0054376399 0.0012722677 -0.0163552587 0.0047333633 0.0159397235 -0.0052157370 -0.0000707846 0.0004452925 -0.0003058929 0.0005625793 -0.0001454310 0.0020805233 0.0018862395 0.0001675324 0.0000757151 -0.0016505381 -0.0053277789 0.0016892981 -0.0001597173 -0.0002307315 -0.0000673618 0.0000147347 -0.0003038204 -0.0002311760 -0.0007108889 0.0040126849 0.0037250533 0.0000101094 0.0002743585 0.0000197346 -0.0015885727 -0.0027800271 -0.0006582841 0.0000958779 0.0000398858 -0.0001214482 0.0012145405 -0.0003393992 0.0008794992 -0.0001030942 -0.0020384970 0.0004636862 -0.0107432483 0.0034246059 -0.0096513147 0.0117877266 0.0210457696 0.0039929105 -0.0000039044 0.0000181484 -0.0000447750 0.0000471387 -0.0001899593 0.0000584227 -0.0000454923 -0.0000144153 0.0002779252 0.0002023948 0.0000536835 -0.0000239569 -0.0000313869 -0.0000893729 0.0000360684 -0.0010479172 -0.0000670483 0.0008538227 0.0000161905 0.0000026762 0.0000554721 -0.0000939596 -0.0002098231 0.0000760446 0.0004435754 -0.0001560122 -0.0005043389 -0.0005646371 0.0004139184 -0.0003036212 0.0000979793 0.0000670774 -0.0000403709 -0.0007571070 -0.0018068029 0.0006112737 -0.0005892252 0.0005715234 -0.0002538825 0.0002470884 0.0002915057 0.0002147943 -0.0023825074 -0.0019660539 -0.0032402654 -0.0005019026 -0.0015414690 0.0006841866 -0.0000406455 -0.0000789088 -0.0000380571 0.0002952922 0.0000579130 -0.0003132539 0.0006170437 0.0004648659 0.0008896334 -0.0002106527 0.0001129067 0.0001021268 0.0056060988 -0.0128385715 -0.0185956012 -0.0892813501 0.1679958248 0.1719664800 0.0233001640 -0.0178854833 0.0552036827 0.0006262338 -0.0054830826 -0.0032736485 0.0082351329 0.0308632751 -0.0117945105 -0.0231428829 0.0384156752 0.0392418515 -0.0240158325 -0.0004542310 0.0374238201 0.0874466754 0.3162339798 -0.1021392017 0.1951197442 -0.3151156983 -0.3303560310 0.0089088956 -0.0334289999 0.0587469759 -0.2005601306 0.0503640542 -0.5868834485 0.1035483286 0.3531061657 -0.1138937299 0.0008606156 0.0044994999 -0.0109167601 0.0294731697 -0.0144338989 0.1182466296 -0.0209110569 0.0014329521 -0.0038197101 -0.0156732858 -0.0434581286 0.0134042096 -0.0001083674 -0.0000173946 -0.0001611835 -0.0001217843 0.0005946592 0.0002920336 0.0028789337 -0.0069421445 -0.0061391954 -0.0000519326 -0.0000687783 -0.0000066203 0.0003489519 0.0006130513 0.0001949308 0.0001464893 0.0001682433 -0.0003190784 0.0001955664 -0.0000733966 0.0001982920 0.0001546876 0.0008379648 -0.0000916847 0.0033442017 -0.0008424918 0.0029370069 -0.0050547676 -0.0089277989 -0.0019188974 -0.0003126159 -0.0002736988 -0.0001138744 0.0024257879 0.0035808139 0.0006819867 0.0008344434 -0.0002831263 0.0008353403 0.0000778190 -0.0000107505 0.0000094581 -0.0000311913 -0.0000030329 0.0000061530 0.0002083916 0.0001456715 -0.0001073486 -0.0002951799 -0.0001087832 0.0003898250 0.0009442694 0.0019650989 -0.0007183926 0.0030357488 -0.0009695684 -0.0035197227 -0.0005294103 0.0006151397 -0.0002903913 -0.0002459424 0.0002114950 -0.0000949557 -0.0001698747 0.0004007290 -0.0003259427 0.0030362951 -0.0023755650 0.0013448423 0.0002200349 0.0004530061 -0.0000107137 -0.0015628185 -0.0011936396 -0.0019731543 -0.0015587172 -0.0047878770 0.0021570022 0.0010202547 0.0005211850 0.0009745064 -0.0017308057 0.0001255522 0.0026314816 -0.0091724310 -0.0067863811 -0.0130521222 -0.0002805235 -0.0006216632 -0.0014235313 0.0197927981 -0.0430371805 -0.0628974704 -0.3072577123 0.5670301424 0.5794196172 0.0711911209 -0.0571507590 0.1822117901 0.0056219185 -0.0233368384 -0.0134484587 0.0303280184 0.0962044428 -0.0334937236 -0.1026527479 0.1818026276 0.1873153925 0.0080211404 0.0082841439 -0.0115610703 -0.0501597166 -0.1738639727 0.0573355350 -0.0435501723 0.0749025348 0.0807626034 -0.0019208167 0.0087102354 -0.0138766753 0.0471002898 -0.0116480030 0.1366775200 -0.0267920948 -0.0914190249 0.0297547741 0.0019822502 -0.0031472354 0.0049524538 -0.0104063709 0.0051818202 -0.0462410027 -0.0242043134 -0.0026530285 -0.0011926538 0.0116173988 0.0347671392 -0.0104187514 0.0001630403 0.0007790648 0.0002788385 -0.0004581007 0.0017013908 0.0017166923 0.0098124543 -0.0222910257 -0.0195425939 -0.0007935566 -0.0017484376 0.0015573344 0.0064463992 0.0109594391 0.0029182626 0.0081721430 0.0075615775 -0.0184665939 -0.0041377047 0.0007010690 -0.0030240825 0.0010207267 0.0103317602 -0.0020290860 0.0503655513 -0.0126708315 0.0452512001 -0.0624517002 -0.1092735489 -0.0223943097 -0.0017252144 -0.0014249062 -0.0006502190 0.0140947785 0.0192942471 0.0035871037 0.0059544160 -0.0025959255 0.0054111831 0.0003975730 0.0002346623 -0.0002813562 -0.0001600597 -0.0000939122 0.0000885968 -0.0010831661 -0.0009845263 0.0032283018 -0.0000739973 0.0001580365 -0.0000103101 -0.0005462245 -0.0012902934 0.0004439534 0.0006101060 -0.0002060242 -0.0007559656 0.0007158789 -0.0004737554 0.0003852104 0.0000662766 -0.0005932992 0.0002834363 0.0022287406 0.0050451761 -0.0020085025 -0.0030593227 0.0021219174 -0.0013047771 0.0009711799 0.0013151630 0.0006356264 -0.0090132769 -0.0071930481 -0.0118352284 -0.0030040167 -0.0087237038 0.0039754078 0.0014050272 0.0004050222 -0.0006385946 -0.0115980611 0.0017637492 0.0169367875 -0.0056861850 -0.0052375144 -0.0094597341 -0.0001719667 0.0004742611 0.0007702220 -0.0030652351 0.0066085758 0.0094417229 0.0465143776 -0.0864110074 -0.0883632373 -0.0101728654 0.0082137636 -0.0260402110 -0.0008709324 0.0034040366 0.0020641498 -0.0041621273 -0.0131667156 0.0046192191 0.0154613231 -0.0273647828 -0.0281603384 -0.0009237263 -0.0012369601 0.0012994640 0.0064703159 0.0224619722 -0.0074214130 0.0042747241 -0.0076567040 -0.0083122296 0.0001515097 -0.0009268011 0.0013241926 -0.0043812749 0.0010658167 -0.0127227790 0.0028845052 0.0098041017 -0.0032306016 -0.0002758874 0.0004809230 -0.0005887091 0.0010750549 -0.0005284278 0.0050046183 0.0038927801 0.0003815778 0.0002070395 -0.0017977750 -0.0054723058 0.0016220064 -0.0000907180 -0.0003577543 -0.0003019764 0.0000208276 -0.0002976134 -0.0004824449 -0.0013725751 0.0038357200 0.0032583919 -0.0074914620 -0.0132536071 0.0093393487 0.0562101824 0.0950640898 0.0238786182 0.0554518190 0.0511301840 -0.1266759164 -0.0150129970 0.0007504354 -0.0094351633 0.0062034888 0.0680645631 -0.0139367915 0.3383209098 -0.0836916694 0.3038842285 -0.4142755623 -0.7220128004 -0.1459569808 -0.0058940698 -0.0053711489 -0.0021430384 0.0562954628 0.0712764402 0.0150091232 0.0185851494 -0.0108945020 0.0164223557 -0.0002780528 0.0013827818 0.0003993724 -0.0004226389 -0.0005934973 0.0003297904 0.0050096535 0.0007856433 -0.0067742778 -0.0293744200 -0.0309691995 0.0454093377 0.1751531591 0.3897073507 -0.1486385334 0.3026153736 -0.1063018776 -0.3358941636 -0.1292650417 0.0869762218 -0.0554323203 0.0052948352 0.0596097348 -0.0266017373 -0.2627641621 -0.5763403614 0.2397496846 0.2015634053 -0.1409509354 0.0838139643 0.0053660286 0.0094899754 0.0005757480 -0.0330156153 -0.0289197373 -0.0463865206 -0.0308721713 -0.0790160285 0.0348785156 0.0022537240 -0.0007686574 -0.0052682606 -0.0344615414 0.0017259275 0.0492855069 0.0103005484 0.0063927089 0.0121114663 0.0000855237 -0.0002207443 -0.0001995263 -0.0000926685 0.0000777359 0.0005261183 0.0014713332 -0.0024771692 -0.0026132012 -0.0012229767 0.0012153231 -0.0034673953 -0.0001790524 0.0002722160 0.0003612515 0.0002798670 0.0005504146 -0.0002620660 0.0021161407 -0.0037558920 -0.0038786247 0.0000588132 -0.0002202895 -0.0001094343 0.0003261387 0.0011739366 -0.0003132125 -0.0010964054 0.0016747841 0.0017557695 -0.0000190903 0.0001360138 -0.0001605462 0.0004811384 -0.0002157280 0.0014960903 -0.0001662404 -0.0011817666 0.0003488016 0.0016203482 0.0014585652 -0.0006329547 0.0013396052 -0.0003167667 0.0047152682 -0.0155778930 -0.0009082486 -0.0018978111 -0.0049642188 -0.0161337980 0.0046731757 -0.0000221846 0.0000507384 0.0000550924 -0.0006209789 0.0018651755 0.0013395898 0.0034713867 -0.0189855726 -0.0163372352 0.0002611046 -0.0000930848 0.0006046736 -0.0007594241 -0.0014131653 -0.0002345431 0.0016863482 0.0014334493 -0.0035483134 -0.0040704769 0.0011270690 -0.0033817020 -0.0000544923 0.0000548450 -0.0000700819 0.0010301256 -0.0001448438 0.0008595559 -0.0002719662 -0.0004369177 -0.0001603598 0.0000292013 -0.0000701433 0.0000277074 0.0004907292 0.0005811640 0.0001951258 -0.0010372528 0.0004796301 -0.0006517993 -0.0000036084 -0.0000135202 0.0002034987 -0.0000254961 -0.0000428808 -0.0000306065 0.0010411126 0.0008162117 -0.0017470929 -0.0004244522 -0.0001600983 0.0004036465 0.0014727298 0.0033026366 -0.0012498702 0.0033276802 -0.0011408828 -0.0037293175 0.0001647064 -0.0002098113 0.0002136716 0.0000189420 0.0003214691 -0.0001475963 -0.0014271080 -0.0030335292 0.0013022868 0.0011830793 -0.0008325058 0.0005299377 0.0000837487 0.0001242377 0.0000594545 -0.0006905837 -0.0005907874 -0.0009441211 -0.0003083282 -0.0007921366 0.0003275374 0.0002856929 0.0002834958 0.0007109193 0.0017486413 -0.0004598724 -0.0022125882 -0.0046961395 -0.0032319114 -0.0063770679 0.0001138213 -0.0001691583 -0.0004328030 -0.0000146383 -0.0000277214 -0.0002275138 -0.0006502554 0.0010054664 0.0009126838 0.0006487672 -0.0004273534 0.0016690253 0.0000144625 -0.0000132416 -0.0000247659 -0.0000122651 -0.0001066364 0.0000378908 -0.0001397964 0.0002529412 0.0002728103 0.0000570380 0.0001319329 -0.0000767234 -0.0005341791 -0.0018578399 0.0006004724 -0.0001243321 0.0002934762 0.0002585659 -0.0000097451 0.0000448079 -0.0000663496 0.0002484981 -0.0000615874 0.0006819181 -0.0001383760 -0.0004595256 0.0001520266 0.0000452679 -0.0000412291 0.0000788088 -0.0001509045 0.0000849856 -0.0007446292 -0.0005431483 -0.0000447317 -0.0000438199 0.0001470362 0.0004462632 -0.0001261281 -0.0000169120 0.0001475311 0.0002026740 0.0000808607 -0.0000764344 0.0001989042 -0.0002682261 0.0003657459 0.0002327366 -0.0463761711 -0.0084499584 -0.0779093946 0.2283797215 0.4083423686 0.0809872516 -0.1997667082 -0.1629969976 0.4078579467 0.5273272955 -0.1469251173 0.4393588471 0.0135223434 0.0057578900 0.0096748710 -0.1123951380 0.0320559701 -0.1045933386 -0.0554452622 -0.0981248552 -0.0173405142 -0.0025661929 -0.0032582112 -0.0006525504 0.0316448965 0.0392137956 0.0075642539 0.0021818455 -0.0023299873 0.0045775752 -0.0004117688 0.0000769295 0.0002924636 0.0000089879 0.0000166517 0.0000382587 0.0025959967 0.0006119177 -0.0029229718 0.0027593975 0.0012314830 -0.0026523933 -0.0106427071 -0.0236355444 0.0087294010 -0.0210971041 0.0072680491 0.0239209810 -0.0013223681 0.0015496350 -0.0012930403 0.0004689431 0.0028007275 -0.0012339506 -0.0126173387 -0.0279668899 0.0114580880 0.0076688334 -0.0053763522 0.0032647832 -0.0000406412 0.0001046531 -0.0002042739 0.0014695113 0.0007723393 0.0016289592 -0.0009273217 -0.0017644611 0.0010282974 -0.0002063546 -0.0008845771 -0.0028597921 -0.0107714989 0.0003831325 0.0152757934 0.0134330336 0.0105670668 0.0188299749 0.0000787247 -0.0001034240 -0.0000826968 -0.0005127001 0.0009355497 0.0005948308 0.0022992527 -0.0076337547 -0.0083425652 0.0011776070 0.0000433449 0.0008190126 -0.0000042283 0.0001412965 0.0000102994 -0.0001781096 -0.0006322923 0.0001984189 0.0005981172 -0.0010103309 -0.0009333895 0.0000556193 -0.0004771853 -0.0001558722 0.0008828136 0.0029090574 -0.0010129719 -0.0017116058 0.0027525690 0.0029160354 0.0000062616 -0.0000155414 0.0000173249 -0.0001123333 0.0000273783 -0.0002253590 0.0000385718 0.0001037009 -0.0000208530 0.0002159571 0.0001901047 -0.0000985211 0.0002357630 -0.0000817211 0.0008525475 -0.0022311857 -0.0001274570 -0.0002519945 -0.0006126380 -0.0020398811 0.0005952716 0.0000317891 0.0000280715 0.0000992438 -0.0002321130 0.0003149307 0.0002908687 0.0005485335 -0.0031207355 -0.0024735661 0.0080534333 0.0061571467 0.0023471700 -0.0442908992 -0.0739731654 -0.0154888932 -0.0109052785 -0.0087089294 0.0277189386 -0.0422502109 0.0128440700 -0.0366731016 0.0076499982 -0.0040155330 0.0063464919 -0.1016263084 0.0279196534 -0.0877147146 0.0139119247 0.0209205686 0.0016056290 -0.0579505310 -0.0587443102 -0.0206311314 0.6006076717 0.7402684245 0.1596275892 0.1035958954 -0.0554255792 0.0905505451 -0.0027215780 -0.0008342066 0.0020930005 0.0001704230 0.0006546420 -0.0001589980 0.0162292812 0.0057629651 -0.0205288462 -0.0472633050 -0.0225252820 0.0461646167 0.1887958859 0.4198298853 -0.1547064800 0.3631279966 -0.1253747636 -0.4103865644 0.0153050655 -0.0221955966 0.0186352192 -0.0092930931 -0.0519929677 0.0229095589 0.2368252390 0.5208355571 -0.2138721656 -0.1385526030 0.0980465746 -0.0590108042 -0.0036651550 -0.0072475034 -0.0003894435 0.0223547319 0.0217185919 0.0326242723 0.0261571084 0.0626637438 -0.0315955413 -0.0003930595 0.0025845631 0.0096347584 0.0436238381 -0.0020178037 -0.0622599359 -0.0386912328 -0.0294443021 -0.0536419024 -0.0001690175 0.0000544007 0.0005078423 0.0000210627 0.0001420866 0.0000095128 0.0003989015 -0.0013931326 -0.0011356819 0.0001404405 -0.0001466879 0.0004925209 0.0000015079 -0.0000073231 -0.0000019089 -0.0000298200 0.0002215510 -0.0001179550 0.0000169521 0.0000866902 0.0000624989 0.0000022976 -0.0007489539 -0.0000348786 0.0019851340 0.0064486629 -0.0022549977 -0.0015248476 0.0023014724 0.0024586047 -0.0002135212 -0.0007977942 0.0003534939 -0.0004384703 0.0002142988 -0.0015029323 0.0023058972 0.0084971908 -0.0027752767 -0.0077662604 -0.0053428072 -0.0000173635 0.0012159849 -0.0018879465 0.0100932526 0.0736444501 0.0048844665 0.0081567442 0.0176899416 0.0610194782 -0.0179065576 0.0000622763 -0.0000215900 -0.0001498661 0.0006663384 -0.0018287634 -0.0015239101 -0.0042837170 0.0204741265 0.0171584275 0.0014810815 0.0015502008 -0.0003085262 -0.0090854794 -0.0156420854 -0.0035681743 -0.0047290328 -0.0039750069 0.0108321425 -0.0038884370 0.0013306127 -0.0034850122 0.0003189892 -0.0001989722 0.0002583854 -0.0045269052 0.0010014104 -0.0037711606 0.0010190417 0.0013680605 0.0001743784 -0.0033255859 -0.0033273917 -0.0011837637 0.0341397792 0.0422206901 0.0091199358 0.0065430597 -0.0034558116 0.0054419530 -0.0004334615 -0.0003332142 0.0001768862 0.0000809824 0.0002208371 0.0000014406 0.0020367632 0.0010572816 -0.0024335528 0.0074486577 -0.0103553283 0.0033537495 0.0252339744 0.0524444498 -0.0199809382 -0.0228835603 0.0065737369 0.0275319774 -0.0870571284 0.0643090633 -0.0468724050 -0.0010068306 -0.0065342615 0.0031125134 0.0291208271 0.0639940126 -0.0264855901 -0.0219586242 0.0151939566 -0.0098556317 -0.0052995459 -0.0054941863 -0.0062160648 0.0619842019 0.0475103531 0.0787737875 0.0059838202 0.0161222646 -0.0066720432 -0.0027837791 -0.0221059854 -0.0757445034 -0.3101578061 0.0158112818 0.4416896361 0.3408718875 0.2501068829 0.4697239336 0.0005356342 -0.0009602891 -0.0017886147 0.0000471446 -0.0002382880 -0.0002672876 -0.0011336867 0.0034439486 0.0030670335 0.0000366251 0.0001611531 -0.0001997404 -0.0001700921 0.0016672848 0.0004825697 -0.0023684232 -0.0102681432 0.0038563587 0.0042376172 -0.0088223348 -0.0090776871 -0.0009437259 0.0163554930 0.0030876484 -0.0342654043 -0.1210341816 0.0420574051 0.0464618907 -0.0728090344 -0.0793045236 -0.0006369882 -0.0006694532 -0.0006693180 0.0037352003 -0.0008927838 0.0103662357 0.0008679281 0.0075504569 -0.0021219706 -0.0257399163 -0.0174188558 -0.0018561200 0.0088440620 -0.0090905008 0.0554235309 0.2412837322 0.0164366884 0.0265337196 0.0575680211 0.1998394557 -0.0600749777 -0.0003092298 0.0004241891 0.0007455684 -0.0001422670 0.0004827314 0.0005726411 0.0010519774 -0.0062395346 -0.0029664048 -0.0177229561 -0.0232663735 0.0127678880 0.1181121064 0.2061131269 0.0495691137 0.0925161136 0.0764481209 -0.2047253797 -0.0001351822 -0.0035892521 0.0035716987 0.0018897490 -0.0044320220 0.0029247094 -0.0444224476 0.0128060172 -0.0405238656 0.0205515433 0.0369579068 0.0075254675 0.0002504170 0.0001450332 0.0000664929 -0.0003457280 -0.0010816366 -0.0008498101 -0.0026222095 0.0012989250 -0.0020745777 0.0005790365 0.0003327973 -0.0003333102 -0.0001769836 -0.0000585850 -0.0002072568 -0.0031203847 -0.0019505065 0.0039988122 -0.0003412366 -0.0061370094 0.0047727890 0.0253759312 0.0546511080 -0.0202930792 0.0162355248 -0.0062381809 -0.0177262315 -0.0351419585 0.0251395480 -0.0183004805 -0.0015933172 -0.0092548862 0.0041598791 0.0417192686 0.0921018212 -0.0380020907 -0.0264256874 0.0183949263 -0.0113518282 -0.0030837046 -0.0035963871 -0.0031104177 0.0333424344 0.0260860696 0.0429322142 0.0063001066 0.0158003120 -0.0071481051 -0.0014020524 -0.0104108867 -0.0356385104 -0.1454679758 0.0074770549 0.2071895901 0.1609400634 0.1179587686 0.2216981374 0.0001178479 -0.0004781014 -0.0009053101 0.0002434534 -0.0007654792 -0.0012320953 -0.0062468474 0.0103476313 0.0104116628 0.0020199611 -0.0011499271 0.0052974455 0.0004690589 -0.0039358449 -0.0012935961 0.0054040873 0.0225766065 -0.0083543569 -0.0108807140 0.0221051291 0.0227713398 0.0022710999 -0.0357448662 -0.0071040017 0.0738081551 0.2612441010 -0.0911727401 -0.1031789889 0.1622495631 0.1765353178 0.0016490315 0.0021478625 0.0013376100 -0.0082698425 0.0019850824 -0.0232943005 -0.0041073794 -0.0241991053 0.0071747902 0.0635901171 0.0420476941 0.0058924830 -0.0248828407 0.0238574189 -0.1497669200 -0.5964420697 -0.0408334318 -0.0652979093 -0.1388510767 -0.4835512157 0.1454527416 -0.0001036332 0.0002611764 0.0003366238 -0.0000587280 0.0000350709 0.0001244391 0.0001762049 -0.0005060323 0.0004496791 0.0015190079 0.0023462734 -0.0016848099 -0.0110067690 -0.0191488554 -0.0047263023 -0.0103003146 -0.0084358819 0.0224847720 0.0033474294 -0.0005974994 0.0023604577 -0.0002000167 0.0004645695 -0.0003057327 0.0047388641 -0.0010682641 0.0042375169 -0.0022921718 -0.0040686478 -0.0008511681 0.0006710723 0.0007403243 0.0002114350 -0.0078009774 -0.0093467401 -0.0019841605 -0.0009240667 0.0005593374 -0.0004542362 0.0002426934 0.0002340711 -0.0001502759 -0.0000892867 -0.0000634300 -0.0000850990 -0.0012867391 -0.0009163608 0.0015956246 0.0036724208 -0.0032767168 0.0003248669 0.0051234478 0.0099948389 -0.0039443353 -0.0152663944 0.0047977361 0.0178435707 -0.0323153204 0.0241503938 -0.0175823546 -0.0001491837 -0.0010600460 0.0005486340 0.0045523105 0.0102641862 -0.0042454357 -0.0042841990 0.0028667597 -0.0019956572 -0.0016810574 -0.0015722646 -0.0021785942 0.0205835844 0.0157462677 0.0260500446 0.0008852568 0.0022329208 -0.0007619055 -0.0006295233 -0.0077356774 -0.0269922330 -0.1128795699 0.0061377045 0.1609465424 0.1192320158 0.0871253460 0.1637764270 0.0001301178 -0.0001708604 -0.0005011347 -0.0000642936 0.0000735852 0.0000819863 0.0007410913 -0.0008426424 -0.0010335197 -0.0000608461 0.0000426221 -0.0000298822 -0.0001148043 0.0007772058 0.0002899773 -0.0010039078 -0.0042950803 0.0016440684 0.0023556506 -0.0046910588 -0.0048066461 -0.0004169946 0.0071370165 0.0013626550 -0.0148961489 -0.0526040698 0.0182836923 0.0203286995 -0.0319229002 -0.0347876441 -0.0003275303 -0.0003652019 -0.0003311573 0.0019167087 -0.0004601494 0.0052778243 0.0006229415 0.0041589569 -0.0012234058 -0.0119817689 -0.0080792994 -0.0008481358 0.0040341722 -0.0041934124 0.0255070147 0.1125463995 0.0076729873 0.0123525186 0.0266579222 0.0926836056 -0.0278682501 -0.0001504027 0.0000445823 0.0002014203 -0.0000064620 0.0000768380 0.0001160546 0.0001527232 -0.0013970499 -0.0004403557 0.0460550485 0.0620145474 -0.0360846414 -0.3100381896 -0.5410010491 -0.1307314726 -0.2523609489 -0.2080705361 0.5568121973 0.0158616132 0.0050822229 0.0030932831 -0.0051493450 0.0122359387 -0.0080144319 0.1226556578 -0.0334492732 0.1113387033 -0.0579800089 -0.1036858197 -0.0211874240 0.0031313438 0.0035085749 0.0010872204 -0.0395786273 -0.0467021517 -0.0084057495 -0.0012915833 0.0010182503 0.0005026674 0.0002458709 0.0007244304 -0.0000869859 -0.0001764721 -0.0003735174 -0.0000097127 -0.0006247829 -0.0009062062 0.0006477693 -0.0027202031 -0.0003601041 0.0017333770 0.0076012390 0.0169823101 -0.0060670142 0.0170692492 -0.0059351468 -0.0194568162 0.0080446727 -0.0064434983 0.0047462302 -0.0004875233 -0.0028588007 0.0012947915 0.0130320859 0.0290729818 -0.0119689418 -0.0075028543 0.0050972241 -0.0031318604 -0.0000192482 -0.0002511225 0.0003245792 -0.0015447726 -0.0010565030 -0.0016406181 0.0017595784 0.0040991514 -0.0021733974 -0.0002027293 0.0004161791 0.0018145793 0.0090364432 -0.0004375746 -0.0128575497 -0.0067109618 -0.0049852954 -0.0090760311 0.0001754617 0.0001473769 0.0004125041 -0.0006540370 0.0016221467 0.0022839268 0.0138426573 -0.0210341316 -0.0216851699 -0.0030422416 0.0019010673 -0.0083750019 -0.0019370561 0.0127641495 0.0044690235 -0.0170252635 -0.0725968268 0.0269422988 0.0387585136 -0.0748648363 -0.0793597047 -0.0056769058 0.0804387101 0.0157815601 -0.1732815087 -0.5917349687 0.2077002062 0.2328487572 -0.3668679694 -0.3956444724 0.0028386842 0.0105112636 -0.0038432184 0.0038229633 -0.0020000969 0.0094857833 -0.0369342037 -0.1171883663 0.0389976499 0.0339581707 0.0204226697 0.0054364873 -0.0195583254 0.0157630610 -0.1051450169 -0.3161936448 -0.0230132623 -0.0338948558 -0.0663772113 -0.2432336694 0.0714349399 -0.0000551952 -0.0001942608 -0.0000894588 0.0004003997 -0.0005570255 -0.0004899279 -0.0021849011 0.0056076715 0.0048700524 0.0002528447 0.0003124076 -0.0000080598 -0.0019324408 -0.0033876716 -0.0007711477 -0.0005537441 -0.0004902510 0.0013190029 -0.0004631796 0.0001476610 -0.0004440884 -0.0000317786 -0.0000179536 -0.0000287352 0.0001783441 -0.0000514358 0.0003251941 0.0001107742 0.0002106919 0.0000606325 -0.0003787343 -0.0003221425 -0.0001561595 0.0035803877 0.0043800139 0.0009340584 0.0015553474 -0.0007644887 0.0010939004 -0.0001599678 -0.0000697383 -0.0000450811 0.0000449671 0.0000603320 0.0000079211 0.0003006179 -0.0000411367 0.0000201118 -0.0006460570 0.0004808346 -0.0000749617 -0.0003156387 -0.0005607276 0.0003701354 0.0022180394 -0.0006661094 -0.0026198187 0.0060137589 -0.0043636311 0.0031505674 -0.0003929244 -0.0009549014 0.0004103477 0.0049745293 0.0113918381 -0.0049380692 -0.0004869529 0.0000349803 -0.0000947082 -0.0002085525 -0.0002468649 -0.0001774540 0.0018927614 0.0016482940 0.0027006359 0.0005544843 0.0011900228 -0.0005585402 -0.0000335825 -0.0001424332 -0.0004463495 -0.0017596370 0.0000539027 0.0025273082 0.0021852506 0.0015714466 0.0030236670 0.0000143789 -0.0000296987 -0.0001403657 0.0002562060 -0.0004789299 -0.0007271947 -0.0041687648 0.0065620405 0.0067646428 0.0012370245 -0.0008014396 0.0027358189 0.0015130284 -0.0041095973 -0.0033223585 0.0030498999 0.0076158588 -0.0027487873 -0.0255045630 0.0425172221 0.0432442784 0.0006713726 0.0023572392 -0.0007836944 -0.0099738470 -0.0279307668 0.0095581503 0.0013989961 -0.0022239351 -0.0014480269 -0.0016255819 0.0085667764 -0.0131390716 0.0400241022 -0.0100759600 0.1254637436 -0.0228095543 -0.0880838157 0.0285704000 -0.0194498016 0.0422027698 -0.0789739225 0.1856646510 -0.0912886039 0.8122453825 0.1876523048 0.0197679270 0.0110123586 -0.1349342677 -0.4341297048 0.1184151513 0.0000060900 0.0000381949 0.0000689121 -0.0000124793 -0.0000420728 0.0000541405 0.0000755261 0.0004128181 0.0001894939 -0.0000177508 0.0000343210 -0.0001211910 0.0000543362 0.0001120412 0.0000040411 -0.0004607483 -0.0003658904 0.0009764017 0.0006361310 -0.0001725594 0.0005147357 -0.0001399761 -0.0000274267 -0.0001129690 0.0012483526 -0.0003293082 0.0011641196 0.0003923652 0.0006967611 0.0001471034 0.0000113132 0.0000249007 0.0000034906 -0.0002148768 -0.0002935678 -0.0000774856 0.0000396053 -0.0000173411 0.0000723652 0.0000569294 0.0000453903 -0.0000516229 -0.0000111643 -0.0000212862 0.0000034102 -0.0004247551 -0.0002613963 0.0006314325 0.0631624465 -0.0636208276 0.0148533048 0.1112934857 0.2205771511 -0.0867146639 -0.2223554862 0.0689236017 0.2556058881 -0.6424836291 0.4739643424 -0.3398778578 0.0040194008 -0.0119095247 0.0056971095 0.0362503452 0.0808942142 -0.0318106411 -0.0832340706 0.0568716964 -0.0382768887 0.0004247394 -0.0000328565 0.0015142969 -0.0090911143 -0.0065090664 -0.0114083089 0.0041586522 0.0081194220 -0.0049013896 0.0026427148 0.0049650310 0.0145914112 0.0476855323 -0.0025244181 -0.0684607370 -0.0783415937 -0.0584457852 -0.1113651241 -0.0000821650 0.0002119057 0.0002931739 0.0000285614 0.0000934581 -0.0000622775 0.0002678338 -0.0011161609 -0.0007342024 0.0002327470 -0.0003171309 0.0009224705 0.0000266114 0.0001314479 -0.0000234782 -0.0004080689 -0.0013777809 0.0004551991 0.0000411300 -0.0000737226 -0.0001673442 -0.0000205960 0.0003578500 0.0000622059 -0.0007615908 -0.0027451916 0.0010355621 0.0010061771 -0.0016328940 -0.0016980457 0.0000395093 0.0001553021 -0.0000879527 0.0000935200 -0.0000420361 0.0004351733 -0.0005420596 -0.0017790409 0.0006201019 0.0003077497 0.0006406464 -0.0005877520 0.0013433579 -0.0005473542 0.0053798828 -0.0029976758 -0.0001916330 -0.0003872527 -0.0019896232 -0.0070436708 0.0020179966 0.0000514220 -0.0001267150 -0.0001328565 0.0003618656 -0.0012948061 -0.0009378690 -0.0042542944 0.0145660436 0.0102801418 -0.0000110023 -0.0000241712 0.0000790232 -0.0000237861 -0.0000341898 0.0000172704 0.0003725572 0.0002947286 -0.0007808253 -0.0001874241 0.0000554021 -0.0001437636 0.0001957050 0.0000299846 0.0001527580 -0.0019574672 0.0005126543 -0.0016687061 -0.0004473024 -0.0008520351 -0.0002404062 -0.0001781295 -0.0001240366 -0.0000624454 0.0017121586 0.0024049739 0.0005609171 0.0010544961 -0.0005214241 0.0005848363 -0.0004540322 -0.0004883040 0.0001104268 0.0001224546 0.0002391536 0.0000659383 0.0018082615 0.0010849556 -0.0020043195 -0.0001359312 0.0001633261 -0.0000647428 -0.0003403152 -0.0007035904 0.0002782314 0.0003344194 -0.0000961331 -0.0003608617 0.0016740066 -0.0012395392 0.0008673195 0.0000053091 0.0000617517 -0.0000223769 -0.0002570736 -0.0005755818 0.0002548331 0.0001761303 -0.0001289294 0.0001017741 0.0000074353 0.0000148168 0.0000217650 0.0000487022 -0.0000943255 -0.0000276093 -0.0000813770 0.0001852031 -0.0000600008 0.0000182034 -0.0001089076 0.0000379256 0.0015934786 -0.0015323172 -0.0014298332 0.0001230298 0.0008659533 0.0010537931 0.0002977971 -0.0003417650 -0.0006992460 -0.0000067657 0.0000363279 -0.0000306464 0.0001688903 -0.0002430508 -0.0001719674 0.0000657429 -0.0002146838 0.0005503526 0.0000054581 0.0000333366 -0.0000013346 -0.0002029914 -0.0005303948 0.0001952309 0.0001229881 -0.0001096106 -0.0001149263 0.0000123723 0.0000471147 -0.0000114534 -0.0001471211 -0.0005178116 0.0002002324 0.0000177862 -0.0000181805 -0.0000463296 -0.0000051945 0.0000368056 -0.0000486796 0.0001478417 -0.0000350446 0.0005000140 -0.0001169679 -0.0003976019 0.0001525979 -0.0000295973 0.0000870931 -0.0001476321 0.0003354311 -0.0001670333 0.0015290332 0.0003175048 0.0000268780 0.0000586086 -0.0002762109 -0.0009219694 0.0002853558 0.0002314395 0.0001882926 0.0003269696 0.0001736895 -0.0004837087 -0.0000961235 -0.0013634577 0.0048646300 0.0040475318 0.0138791508 0.0066889722 0.0108023640 -0.0640676643 -0.1189485155 -0.0274033101 0.0074005929 0.0047761682 -0.0133726610 -0.1150989705 0.0357440339 -0.0920159121 0.0703644569 0.0196039960 0.0536943493 -0.6088464039 0.1698674888 -0.5531705733 -0.2312220832 -0.4071824872 -0.0803656295 0.0098151461 0.0061660379 0.0044847311 -0.0751973087 -0.0891929262 -0.0169092251 -0.0404592872 0.0211507422 -0.0413332822 -0.0000476692 0.0003143346 0.0000070177 -0.0001612128 -0.0001448594 0.0001385461 0.0005808831 -0.0001438177 0.0005368821 -0.0004554082 0.0006824306 -0.0001851549 -0.0026235608 -0.0057318860 0.0020991626 0.0021403789 -0.0004451921 -0.0021787070 0.0067195150 -0.0060880091 0.0039140845 0.0008584072 0.0028252471 -0.0012111184 -0.0137942550 -0.0328823319 0.0136768771 0.0061684648 -0.0053152681 0.0030717049 0.0000057120 0.0001032344 -0.0002914942 0.0012922474 0.0006945745 0.0017166922 -0.0013030079 -0.0014509888 0.0010938931 -0.0002184559 -0.0002098126 -0.0014785039 -0.0024836389 0.0015948884 0.0046521649 0.0068706708 0.0049430566 0.0084618460 -0.0005451965 -0.0026080851 0.0032243075 0.0016340593 0.0001916844 -0.0036738201 -0.0096179831 0.0187662787 0.0187671554 0.0038865072 -0.0074576582 0.0166879488 0.0004380732 -0.0003607446 -0.0004817678 -0.0020584692 -0.0015361687 0.0007102948 -0.0055201141 0.0047818876 0.0059008864 0.0000145137 -0.0003162065 -0.0000383108 0.0007397107 0.0018420032 -0.0009808615 -0.0007466930 0.0018135007 0.0021496995 0.0000140224 -0.0000719214 0.0000859926 -0.0005106746 0.0001476709 -0.0010254901 0.0002341338 0.0008662992 -0.0002127450 -0.0001193151 -0.0002091027 0.0000051846 0.0001137306 -0.0001922366 0.0005803469 0.0005796493 0.0001881869 0.0001271562 0.0006012168 0.0024743406 -0.0008145330 -0.0000699947 0.0006768986 0.0004969942 0.0161419211 -0.0626475655 -0.0550192953 -0.1917422482 0.7557771739 0.6176194391 -0.0001230197 -0.0001005104 0.0000266532 0.0005373848 0.0011056779 0.0002910122 0.0004649180 0.0003770556 -0.0009898697 0.0005062959 -0.0001880370 0.0003942183 -0.0004220444 -0.0001597525 -0.0002743321 0.0031872299 -0.0009687351 0.0031015305 0.0018530640 0.0029617776 0.0004666419 -0.0003751527 -0.0001560394 -0.0000256539 0.0013564396 0.0030625612 0.0003388606 0.0023297326 -0.0010337104 0.0011138318 -0.0003597767 -0.0005930066 -0.0011398996 0.0000408919 0.0007383663 0.0001096105 -0.0050425976 -0.0029346885 0.0097313161</array>
                     <array dataType="xsd:integer" dictRef="x:serial" size="132">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131</array>
                     <array dataType="xsd:double" dictRef="cc:frequency" size="132">-54.34766470 19.15062181 31.11989948 33.85042176 46.38359798 52.20600587 62.71664936 76.57065356 83.48444284 108.11420904 120.23579218 128.14926895 147.68177752 186.78409752 193.84189714 207.26169643 217.55845561 233.00563416 261.35549578 271.94511314 282.72213292 306.95159099 321.23195536 348.83268939 369.01192234 395.97675889 411.07921478 441.60138111 480.73253562 546.23666923 585.42157848 691.85818057 751.60715210 752.51769086 754.87621150 760.33687533 786.30716460 796.49505675 818.83781755 843.15410738 853.37122994 877.41792549 882.72233194 894.83002651 932.98330166 946.18424258 972.46720741 980.18282615 988.06164575 995.46699486 1022.72643448 1037.09504483 1078.11889374 1080.76550329 1102.65891662 1108.04310045 1118.19873991 1127.57191672 1139.41953136 1140.66954384 1151.87854757 1153.78454984 1197.61279554 1220.12447047 1249.32866266 1259.86628447 1261.00673546 1273.76949388 1308.37863431 1313.47478021 1325.91063689 1329.41908368 1343.51356476 1353.30933715 1361.82080378 1372.16341436 1384.50928130 1385.85089055 1397.48761533 1403.04546512 1407.94305735 1424.21872276 1426.16607095 1427.60123011 1429.86955365 1457.65578942 1463.71633700 1468.40992711 1473.48155651 1481.86819816 1484.81992222 1485.37049519 1487.20087300 1490.15867013 1493.04886395 1494.87552050 1497.54217256 1499.03723693 1505.11051584 1515.12628147 1523.27459212 1671.24028118 1754.08418074 2902.50283816 2946.67721858 2957.11890135 2980.29646069 2993.05145726 3006.81467697 3009.37259191 3011.74483103 3019.21105164 3021.65755266 3036.92293241 3043.30925890 3049.33152953 3056.09010907 3062.19579437 3064.02968653 3064.81698030 3084.81332561 3086.92884897 3097.89345735 3099.17653147 3103.96545969 3104.22301256 3104.29782213 3107.49162569 3122.66012645 3125.36224642 3140.82192708 3176.71064037</array>
                     <array dataType="xsd:double" dictRef="cc:redmass" size="132">5.96529092 2.99532548 2.99687591 3.44132712 3.23421689 2.29821615 3.25275743 3.24655727 2.98763860 3.91846345 2.82429173 2.47925671 2.31071981 1.79576142 3.15997660 3.48371625 2.58173272 2.20070582 1.16730838 2.03095170 1.48011454 1.71637436 2.11521133 2.16653227 2.93833263 2.89418563 2.70974965 2.41194155 1.97638512 2.37163035 3.15023078 3.41415377 1.33802302 2.23826832 1.15695741 1.35269630 1.67055178 1.33658774 1.42992496 2.13909759 1.57373308 1.58218931 1.69783074 2.06887664 1.47282856 1.93320259 1.70410666 1.34576504 1.49895497 1.70226321 1.74632434 1.70817404 1.79819627 2.15286107 1.82879011 1.70009993 1.75351869 1.53968580 1.89925294 1.84848492 2.17973895 2.02824181 1.52844939 1.37242180 1.42765557 1.36159415 1.34062656 1.31308631 1.32611928 1.19275855 1.16477221 1.23656401 1.19065861 1.22793124 1.35482675 1.47116463 1.38525176 1.37841204 1.23708666 1.49638150 1.28671933 1.36679211 1.60675930 1.35096936 1.53887187 1.10536601 1.13803946 1.11066999 1.07089291 1.11637744 1.09302408 1.08227005 1.06167141 1.07769746 1.06329981 1.05645980 1.07453134 1.08426374 1.05784296 1.05851841 2.85638617 7.46681618 8.70482493 1.08571154 1.07017387 1.07344083 1.06690039 1.06598054 1.03829123 1.06168332 1.04569923 1.06341688 1.04185285 1.09459807 1.06407337 1.07907672 1.09637047 1.08862521 1.09213958 1.06750662 1.09947376 1.10259052 1.09035531 1.10101843 1.10529066 1.10456278 1.10260173 1.10351719 1.10329115 1.10345473 1.10377161 1.08767302</array>
                     <array dataType="xsd:double" dictRef="cc:displacement" size="18216">0.1423566664 -0.0793419989 0.0589155930 0.1362570430 -0.0777453727 0.0563321396 0.1969123572 -0.0877502836 0.1091271716 0.1613227278 -0.1064834293 -0.0121333392 0.0542282234 -0.0284049981 0.0796630274 0.0331148323 -0.0191683878 0.0797610705 0.0544058733 0.0066869666 0.1380751298 -0.0211779536 -0.0244102818 0.0196631539 -0.0768813654 0.0019368246 0.0444073003 -0.0351587292 -0.0216144628 0.0167494513 -0.0020370766 -0.0338914458 -0.0794994470 -0.0737155570 -0.0310253200 -0.1299340591 0.0603849464 -0.0619679540 -0.1101890052 0.0297218330 -0.0270618933 -0.0545743379 0.0937014554 -0.0151178100 -0.0116090623 0.0502442475 -0.0334340098 -0.0147558889 0.0860983914 -0.0361156851 -0.0172644007 0.0888943096 0.0725736584 0.0013913280 0.0460851584 0.0871996793 0.0055468413 0.1315547957 0.0893086311 0.0078563025 0.0718598947 0.0975615689 0.0128303715 0.0357909568 0.1156822526 0.0345871232 0.0833239714 0.1310742137 -0.0108879811 0.0749690473 0.0566640100 0.0235373603 0.0624690827 0.0831066935 0.0302709002 0.1092064453 0.0360968558 -0.0097041210 0.0545496581 0.0045731579 0.0689142701 0.0756917408 -0.0240189704 0.0612279263 0.0554848320 -0.0277697465 0.0837434497 0.0153504699 0.0246032946 0.0980440796 -0.0394209648 -0.0370408455 -0.0271485926 0.1787121009 -0.0345791741 0.0097065493 -0.0302191383 -0.0147733619 -0.0842666856 0.0659188876 0.0506911157 0.1143949983 0.1278059081 0.0252659738 0.0698761757 0.1380585999 0.0666347486 0.1530599133 0.0133900373 0.0870207517 0.1897730849 -0.0302592538 0.0111840242 0.0320392399 0.0312099527 -0.0173005219 -0.0429029794 -0.0913633026 0.0367627173 0.0745365744 -0.1141498161 0.0031128518 -0.0122917045 0.0228879143 -0.1028228087 -0.0379052821 -0.1282726671 0.1464007808 0.0772128261 -0.3313500125 -0.0217007848 -0.1511438023 -0.2976580746 -0.0000288641 -0.1072868814 -0.1798429151 -0.0667231877 -0.0594762770 0.1432630924 0.0768775358 0.0030172181 0.1825626939 0.0505808244 -0.0183917977 0.1754286218 0.1221159196 0.0177605994 0.1239952279 0.0406194078 -0.0105607687 0.0772858222 0.0999273829 0.0281024040 0.0421751585 0.1235208587 0.0469772445 0.0963085587 0.1372272872 0.0457546584 0.0300902833 0.0483389914 0.0050681584 -0.0118948067 0.0586724598 0.0300265890 0.0503416083 0.0299526941 -0.0193210670 0.0109561010 0.0131061020 -0.0206512177 -0.0132526100 -0.0112030228 -0.0367003947 0.0440312522 0.0030845979 -0.0396411002 -0.0143054972 0.0230820164 -0.0017803338 -0.0194250563 0.0464452601 0.0161485254 -0.0005851701 0.0368688848 0.0352462189 -0.0336765140 0.0666372746 0.0280699659 -0.0181339764 0.0255165977 -0.0103446273 -0.0053110157 0.0096759909 -0.0446022810 -0.0437650712 -0.0033197483 0.0041220646 -0.0009593184 0.0562945565 -0.0128656891 -0.0901116459 0.1108949502 0.0703241173 0.0933861115 0.1567455929 -0.0500851015 0.0128053058 -0.0968158891 -0.0688000442 0.0313604171 -0.0066085839 -0.0672870389 0.1087367380 -0.1679249066 -0.2001081282 -0.1170807425 -0.2780612527 0.0415457976 -0.1380122208 -0.3938067114 0.0335640974 -0.1061789705 -0.3717262593 -0.0021415057 -0.2088028882 -0.2102517542 0.1825410719 -0.0200349330 0.0097522410 0.0086081415 -0.0212545139 0.0426639266 0.0000560026 -0.0049500596 0.0506628751 -0.0044373607 -0.0548678299 -0.0740962460 0.0147638625 -0.0814190517 -0.0648606436 0.0401063069 -0.0560774364 -0.1051426106 0.0025903402 -0.0535172621 -0.0808512767 0.0108541011 -0.0224822416 -0.0375545884 0.0027741488 -0.0253830760 -0.0338838668 0.0069959562 0.0033164783 -0.0467890505 -0.0235543033 -0.0196986689 0.0048788291 0.0193239033 -0.0369378217 0.0134326322 0.0450064770 -0.0210854495 0.0056873693 0.0214088433 0.0067779765 0.0343898888 0.0006981362 0.0243285520 0.0276073830 -0.0283884943 -0.0051284066 0.0657489235 0.0063249633 -0.1601204012 -0.0207988578 -0.0421179543 -0.1922263292 0.0110352665 0.0028767985 -0.2199779978 -0.0773661766 -0.0777609958 -0.1525405430 0.0149141743 -0.0074940411 -0.0524951502 -0.0370990843 -0.0968765258 -0.0247423485 -0.0660705516 -0.1363767871 -0.0623821421 -0.0753542750 -0.1371566795 0.0357627797 0.0271653106 -0.0452550339 0.1049991038 0.0291314961 -0.0980215613 0.0366850051 0.0493947241 0.0053143559 0.0348462805 0.0485587195 0.0168112274 0.0950579440 0.0766368300 0.0580364748 -0.0251274630 0.0416078764 0.0642360522 0.0269974289 0.0391451646 -0.0382769785 0.0315907427 -0.0227366661 -0.0990738216 0.0024113979 0.0164496218 -0.1522869617 0.0640321044 -0.0801877786 -0.1291657711 0.0324372782 -0.0126185669 -0.0496147340 0.0385451260 -0.0391567473 -0.1207942333 0.0665214717 -0.0709190528 0.0242026342 -0.0193937354 0.1060792518 -0.0017230356 -0.0522669681 0.1469576982 0.0893338904 -0.0301176169 0.1897322711 -0.0860591442 -0.0171144263 0.0754176957 0.0394041427 -0.0588777002 0.2142542086 0.0655909007 0.0185367191 0.0216110843 -0.0923263268 -0.0083769575 -0.0628128083 0.2154604978 0.0215003747 -0.2210282391 0.1914730280 -0.0102844358 -0.0618175237 0.2336704068 -0.0311528944 -0.0143636610 0.3609056951 0.0124263358 0.0783071113 -0.0739961608 0.0303801737 -0.0088166281 -0.0480499430 0.0182532653 -0.0291237574 -0.0265314307 0.0470064052 -0.0529907301 0.0838402203 0.0997380077 -0.0954516361 0.1376136005 0.0266284635 -0.0827860284 0.0632000067 0.0605099064 0.0312821868 0.0964297460 -0.0080225955 -0.0700687067 0.0266081185 -0.0164348653 -0.1432847571 0.0133333088 -0.0539264127 -0.0354825526 -0.0169673105 0.0109441299 -0.0341341094 0.0490896664 0.0240084880 -0.0531861389 0.0892447187 0.0237469447 0.0063616792 0.0560943213 0.0007879473 -0.0201044624 0.0191289562 0.0148618614 -0.0247225089 0.0220151054 -0.0283350469 -0.0087116281 0.0048397710 -0.0511098663 -0.0099575941 0.0774124461 -0.0900640670 0.0169740975 0.1010015262 -0.0427112705 -0.0615193680 0.1001764653 -0.0217355294 0.0026732368 0.0395190221 -0.0493352477 0.0062683369 0.0656395338 -0.0223465787 -0.0149961661 0.0439246017 -0.0685787786 -0.0032024811 0.0948711003 -0.0577789083 0.0608654137 0.0442319927 -0.0590989373 0.0755741386 0.0360454512 -0.0790195541 0.0802035663 0.0699961627 -0.0397333565 0.0708370688 0.0030454799 -0.0560089693 0.0929609721 -0.0091611859 -0.0289572787 0.0607049132 0.0001644671 -0.0178460791 0.0628180944 -0.0168573421 0.0719933202 0.0143975081 -0.0182166051 0.0880038061 0.0264512559 -0.0214882177 0.0829630778 0.0214963797 -0.0205028673 0.0754305318 -0.0221470917 -0.0141925787 0.0990217064 -0.0178561571 0.0173580470 0.0606726666 -0.0082518120 -0.0354523311 0.0675880713 -0.0821024304 -0.0218297722 0.0820731346 -0.1072112220 -0.0817113585 0.0469909580 -0.1316567069 0.0122439034 0.0650364345 -0.0548599852 -0.0003401385 0.0597236656 -0.1433876781 -0.0061832541 0.0471550455 -0.0182818227 0.0948286547 0.0917732103 0.0395844180 -0.0928248820 0.1039868944 0.1421993157 -0.0842561708 0.0891532565 0.0449483107 -0.0708936500 0.1032386467 0.0061153259 -0.1974470061 -0.0533296777 0.0850729435 -0.0373872740 0.0407724317 0.0292095630 -0.0087564083 0.0205287738 0.0153992795 0.0012696448 -0.0901591924 -0.2018159435 0.0716289087 -0.0797839928 -0.2427710662 0.2229587646 -0.1497434945 -0.3157688697 0.0011370087 -0.0475794378 -0.0942437117 0.0572577137 -0.0809487602 -0.1449924418 -0.0114445882 -0.1228272002 -0.2488899460 0.0029530666 -0.0881054623 -0.1120915903 -0.1551648678 -0.0015280570 0.0051519241 0.0815898422 0.0164517310 -0.0403495045 0.2294617515 0.0457771993 0.1186928308 0.0877858390 0.0052417305 0.0786288695 -0.0165486833 0.0315815385 0.0702294077 -0.1042477052 0.0059624763 0.1548949433 0.0199915405 -0.1519739871 -0.0195652011 -0.0195334031 -0.2179371650 0.0092408515 -0.0240497283 -0.1822420165 -0.0637742234 -0.0330289598 -0.1139117941 0.0458271592 -0.0009891948 -0.0784436505 -0.0846973460 -0.0213505356 -0.0284400971 -0.1034738332 -0.0120036027 -0.1087228423 -0.1460545962 -0.0524170466 -0.0308032115 -0.0486245695 0.0060566145 0.0147716584 -0.0862293474 -0.0046779494 -0.0672107876 -0.0353835730 0.0061281914 0.0039450578 0.0112639233 0.0435001115 0.0154919163 0.0164278709 0.0512620745 -0.0216404933 0.0438206625 0.0450551890 0.0405476456 0.0126415110 0.0738150791 0.0257201608 0.0578498385 0.1084315641 0.0302290032 0.0201748068 0.1477222438 -0.0275396964 0.0758570053 0.1333703108 0.0202648238 0.1136918450 0.0380544442 -0.0278025448 0.1236928293 0.0271814036 0.0066513108 0.1279646544 0.0174985513 0.0902285171 0.1298109191 0.0062794359 0.0567621117 0.1568299866 0.0583027500 0.1727032677 0.1823676819 0.0070151388 0.0985577525 0.0529648025 -0.0927012206 0.1564890447 0.1086051485 -0.1074273438 0.1318481342 0.0138039248 -0.1823400832 -0.0052322453 -0.0470718421 -0.0595993730 -0.0597296987 -0.1143165595 -0.0548504892 0.0051812994 -0.0957975174 -0.1281757195 -0.0418963535 -0.0096588884 0.0326567398 0.0204103487 -0.0038908873 0.0938464118 0.0870464314 0.0330066474 0.0966215165 0.0510349119 0.0518941641 0.0619294089 -0.0909532286 -0.0758524616 -0.1014363604 -0.2213392450 0.0220310252 -0.2055380547 -0.0226096853 -0.0426754409 -0.0575054546 -0.1371152215 -0.2624472740 -0.1097449069 0.0416200238 -0.0048042286 -0.0138573816 0.0763510001 0.1593020735 -0.0021116190 0.1577942138 -0.0867691768 0.0688031533 -0.0234530946 -0.0360397841 -0.0582173587 -0.0356724857 -0.0129489789 -0.1228909556 -0.0577320113 -0.0865286423 -0.0466234177 -0.0265131939 -0.0366306191 -0.0483562565 0.0072968517 -0.0370472906 -0.0314295207 0.0498592428 -0.0519857497 0.0004249904 0.0295014342 -0.0168264366 0.0128707336 0.0385192828 -0.0243089153 0.0040611206 0.0524711650 -0.0049060437 0.0295045814 0.0290861880 -0.0318072450 -0.0068266316 -0.0107375014 -0.0023229301 0.0279008959 -0.0152252406 0.0026858462 0.0340226257 -0.0113122777 0.0115857564 0.0520540227 -0.0471964682 -0.0080796855 0.0007555988 -0.0716316651 -0.0166773430 0.0241836866 -0.0711012526 -0.0077218839 -0.0186531860 -0.0226734675 0.0093272510 -0.0409339355 -0.0491619407 0.0308326363 -0.0603479429 -0.0079410376 0.0180671649 -0.0557029785 0.0326081810 -0.0063155524 -0.0395098655 0.0089450674 -0.0182081470 -0.0643979452 0.0074241873 0.0074006967 -0.0896982324 0.0363236444 -0.0334657365 -0.0788160345 0.0121473450 -0.0464006991 -0.0319434659 0.0349579620 -0.0592267802 -0.0505274825 0.0183257538 -0.0706366819 -0.0056764418 -0.0205574880 -0.0203638526 -0.0106502896 -0.0084947316 -0.0216028214 -0.0053737304 -0.0562118838 -0.0234049033 -0.0297427800 -0.0239402324 0.0122222496 0.0306909192 -0.0517456673 0.0329668728 0.0418748346 -0.0367412022 0.0145229982 0.0263697052 0.0227201887 0.0177773636 0.0640221673 0.0423496064 -0.0053980401 0.0570209638 0.0183181490 0.0482462634 0.0867993943 0.0432110769 0.0144752014 0.0739287927 0.1345380907 -0.0196190005 -0.0237563341 -0.0313123511 -0.0016905314 -0.0550665532 -0.0657323842 -0.0077904922 -0.0597756491 -0.1357667822 -0.0897803135 -0.0211551875 -0.3817724774 0.0881652740 -0.1858074891 -0.0079271075 -0.0595490162 0.0498132772 -0.2232138867 -0.4155046533 -0.0272035461 0.1104040299 0.0638831876 0.1019831551 0.1724089117 0.3405977976 0.1167743990 0.3291476525 -0.0835441823 0.2242388261 -0.0180677279 0.0392956176 0.0274136506 -0.0593292775 0.0948750596 -0.0767688194 -0.0972114521 -0.0545418192 0.0678041908 -0.0145591309 0.0455491664 0.0150436210 -0.0253649761 0.0460564646 0.0025597136 -0.0487354909 0.0572394435 -0.0038196111 -0.0419991894 0.0532723242 -0.0415508001 -0.0199067864 0.0632021510 0.0121756498 -0.1021844909 0.0317388311 -0.0879892360 -0.0714516171 0.0459504264 0.0040274608 0.0444861599 0.0768552343 -0.1096483260 0.0126980639 0.0695285272 -0.1604712750 0.0739042828 0.0853859824 -0.1637247631 0.1370526101 0.0954406051 -0.0414704475 0.1946995841 0.1334672243 -0.1080749216 0.2001011528 0.0989503458 0.0194464505 0.0830882245 0.0540213384 0.0418649144 0.1465904892 0.0411492743 0.0868103579 0.0406344052 0.0224124841 0.0894410907 0.0138798797 0.0629958241 0.0041165590 0.0405907949 0.0274200709 -0.0042091621 0.0264714038 0.0396602757 -0.0234381849 0.0744257767 0.0184741469 -0.0202661234 0.0474559716 0.0037151925 0.0437792388 0.0762231684 0.0260286318 0.1305997794 0.0531430259 0.0543285152 -0.0022712355 0.0081610003 -0.1249173623 0.0394510735 -0.0022299809 -0.1595602918 -0.0716473930 -0.0162662294 -0.2012179530 0.0956008632 0.0083161322 -0.1367466978 0.1036946219 -0.0281081763 -0.2768244863 0.1039439339 0.0289760922 -0.0952554425 0.2470604610 0.0292541552 -0.0300990736 -0.0090943555 0.0778006940 0.1231959308 -0.0030119686 0.0256627385 -0.0634024965 0.0492305490 -0.0000400251 -0.0659790540 -0.1646086210 -0.0301526619 0.0860585902 -0.0120309080 0.0325250201 0.0357771622 0.0108633826 -0.0026116661 0.0293630267 0.0076704445 -0.0803185143 0.0035736527 -0.0551188114 -0.1498634528 0.0695941916 -0.1710290599 -0.0162569474 0.0650133212 -0.0024813628 -0.1249084956 -0.1350849199 -0.0490105919 -0.0190052704 0.0179693231 0.0168997344 0.0196283242 0.1404660741 0.0120539294 0.0407541989 -0.0355187526 0.1156922107 -0.0861856603 -0.0516077954 -0.0420082579 -0.0806641607 -0.0383011115 -0.1263372049 -0.1194208597 -0.0998381307 -0.0303746724 -0.1118652076 -0.0799989941 -0.0152541604 -0.0661378231 -0.0830904905 0.0695428204 -0.0850102961 -0.1253675728 -0.0149293638 -0.0467517064 -0.0452567826 0.0689897570 -0.0659568776 -0.0195169057 0.1137258504 -0.0472605005 -0.0985425855 0.0845126070 -0.0328786239 -0.0508885214 0.0350410481 -0.0391208080 -0.0024643396 0.0364918014 -0.0418993184 -0.0164830076 -0.0021285321 -0.0369556894 0.0121366688 0.0554156589 -0.0359896713 0.0426648574 0.0254954516 -0.0369380838 0.0630450252 0.0132625709 -0.0496704890 0.0601975752 0.0530334477 -0.0182123698 0.0486999299 -0.0167229827 -0.0391726807 0.0683457994 -0.0321352703 -0.0035256953 0.0472136755 -0.0263704246 0.0169927617 0.0384476696 -0.0179563358 -0.0457015434 0.0697777510 0.0023660990 -0.0724772673 0.0508607920 0.0062946802 -0.0274827285 0.0793676315 -0.0009207716 -0.0464855038 0.0878196544 0.0412042413 -0.0480121799 0.1172969876 0.1243600397 -0.0292359585 0.1488423866 -0.0080503432 -0.0675968358 -0.0194217136 0.0308489507 -0.0931821008 -0.0372478290 -0.0450671844 -0.0594815248 -0.0649085194 0.0771110737 -0.0647623379 -0.0693229263 0.0559626796 -0.0790439210 -0.1820400865 0.0510158132 -0.0239286008 -0.0481389520 0.1554614845 -0.0956354263 -0.0154210417 -0.0364178930 -0.0571490327 0.1130801223 -0.0306179619 -0.0947569680 -0.0871070646 0.0034812605 -0.1594595567 -0.0307383403 -0.1559313832 0.0910843698 0.0225295282 0.0001925212 -0.0368314583 0.0566978970 -0.0270901502 -0.0283745369 0.0648627248 -0.0349915873 0.1980488341 -0.0524618750 0.1087452128 0.2050024692 -0.0350208785 0.0152571687 0.3412938754 -0.0435861756 0.1784986486 0.0953669949 -0.0885298219 0.2200179591 0.1463724484 -0.0388655655 0.0060994738 0.2432605391 0.0142145117 -0.0880868803 0.1530820889 -0.0621196494 0.1025193511 -0.0344160091 -0.0536391316 -0.0883100011 -0.1006555573 0.0249203336 -0.2076265628 -0.1421991220 -0.1748981601 -0.0299204536 0.0069875433 -0.0196669543 -0.0944048824 0.0521439374 -0.0326849395 -0.1057168632 0.0005824285 0.0080772195 -0.0871511304 0.0120367547 0.2712780499 -0.1111231414 0.0086590529 0.2038718996 -0.2941098926 0.0570529468 0.4195338673 -0.1160749829 0.0220181198 0.3274153569 -0.0512948755 -0.0523509453 0.0876046822 0.0476238622 0.0085790988 0.1256729100 0.2091685423 -0.1007854785 0.0073187998 0.0274952309 -0.1271132624 -0.0355575878 0.0223131795 -0.1656855200 -0.1397460272 0.1161224775 -0.1819540738 -0.0745547902 -0.1104865676 -0.0820007297 0.0286258203 0.0373406325 -0.0753327410 0.0529619599 0.0415318353 -0.1044764212 0.0559001574 0.0396177769 -0.0153845214 0.0130392704 0.0313044909 0.0273922784 -0.0401852908 -0.0118156141 0.0500126690 -0.0034798938 -0.0350203838 0.0318088832 -0.0619996339 -0.0206784068 0.0315671833 -0.0839715308 -0.0264264098 0.0561977275 -0.1100729102 -0.0817442184 0.0096417519 -0.1340322397 0.0096568324 0.0334709358 -0.0260270495 -0.0159021704 0.0525508156 -0.0192498396 0.0201254445 0.0162175909 -0.0096418969 -0.0413894699 0.0306519628 0.0145224537 -0.0152592486 0.0305046126 0.0570536786 -0.0114973445 0.0010311230 0.0132682820 -0.0449448357 0.0660014671 0.0122797137 0.0178190590 0.0524811598 -0.0353924726 0.0154011293 0.0637848475 0.0607221112 0.0071524311 0.1095609687 0.0105299470 0.0569233971 0.0200474479 0.0229775852 0.0250675826 -0.0075606466 -0.0156162664 0.0275568517 -0.0301998586 -0.0296108333 0.0399809005 0.0748259573 -0.0167875439 0.0366201123 0.0953571195 -0.0165187151 -0.0158126444 0.1295464144 0.0076559111 0.0710760995 0.0354416608 -0.0264667801 0.0807277278 0.0346423773 -0.0359293070 0.0074371219 0.0715949830 -0.0164712521 -0.0289790590 0.0211032035 -0.0392195588 0.0614573509 -0.0327375095 -0.0682253283 -0.0375449480 -0.0480988248 -0.0431996386 -0.0964914075 -0.0713728265 -0.1174823581 -0.0198638749 -0.0253220179 -0.0697337237 -0.0231853459 -0.0046410373 -0.0737437692 -0.0032621144 -0.0101516977 -0.0795757311 -0.0164527337 -0.0432032578 -0.0007674352 0.0358645066 0.0064099553 0.0028305919 0.1068101348 -0.1027748414 -0.0159566512 -0.0116979766 -0.0887608174 -0.0345783731 0.0747717921 0.0309275065 0.0567050848 -0.0467003522 -0.0454731940 0.0661486167 -0.1071113266 0.0903107906 0.1022826429 -0.1098473122 0.1216073504 0.0399931902 0.0288291086 0.1645592750 0.0884876629 -0.0339164134 0.2039531959 0.0327438331 0.0810832814 0.0591733573 -0.0126865918 0.1112092442 0.1146259842 -0.0372701512 0.1513626202 0.0271190246 -0.0245355201 0.1388526103 0.0241124823 -0.0057667813 0.1017472166 -0.0460638145 -0.0368107798 0.0343933318 0.0224150948 0.0049277264 0.0313522429 -0.0616389983 -0.0316125808 0.0419852205 -0.0409116471 -0.1281255741 -0.0219281755 0.0022227998 -0.1624411562 -0.0863702279 -0.0993600527 -0.1904719430 0.0060389123 -0.0111060927 -0.0760064809 -0.0253115433 0.0608341056 -0.0888409958 -0.0026005121 -0.0524791979 -0.0953847931 -0.0325922968 -0.0209129570 0.0424793216 -0.0465101297 -0.0028466185 0.1876590126 -0.0399925242 -0.1097809043 0.0301900040 -0.1611939810 0.0599498420 0.0092688655 0.0645588006 -0.0426095327 -0.1933600084 0.0643063750 0.0581647790 0.1813375829 -0.0325661974 0.2266389257 0.0131152270 0.2506331339 0.1613901451 -0.0372236056 0.1331312669 -0.1083275819 -0.0017174873 0.0704981162 -0.1616225478 -0.0150519119 0.0695416012 0.0049331168 -0.0240455327 0.0042204431 0.0478115451 -0.0643991810 0.0729783090 0.0090249390 -0.0859674987 -0.0173621667 0.0014202912 0.0666456325 0.0399343339 -0.0494402666 -0.0132026145 -0.0992781651 -0.0376000715 -0.0982106379 -0.1361368875 -0.0856861009 0.0175111367 -0.1494652735 -0.0645044917 0.0449499386 -0.0835113200 -0.0781697232 0.0516649105 -0.0626325587 -0.0739611398 0.0443648700 -0.0728162340 -0.0427509243 0.0684585075 -0.0932909187 -0.0672110851 0.0750096661 -0.1612956596 0.0189837565 0.0922992817 -0.0405998412 -0.0016069491 0.0524588987 -0.0168077295 -0.0229321301 0.0378512625 -0.0817253750 0.0058677576 0.0904762233 -0.0216364832 0.0141312488 0.0912165987 0.0079044085 -0.0039826242 -0.0290112662 0.0376939549 0.0346268569 -0.0233380187 0.0926444206 -0.0334604298 -0.0762910635 0.0277875299 -0.0210895659 -0.0472488694 0.0284918001 -0.0220541414 -0.1017611162 0.0629615214 -0.0750031020 -0.0488069917 -0.0197471870 0.0293061361 0.0180244886 0.0232582451 0.0389809147 0.0675325246 0.0288478061 -0.0006008381 0.0346196541 0.0370581315 0.1058411123 -0.0039192300 -0.0007457764 0.0171322650 -0.0149538969 -0.0506547277 -0.0249580807 0.0092197876 -0.0954902948 0.0468818362 -0.0661023140 -0.0775354203 0.0150638302 0.0240332646 0.0043019180 0.0105058544 0.0157415289 -0.0252197999 0.0505984714 0.0010602113 0.0462151390 -0.0332658057 0.0762257117 0.0360812761 -0.1014016870 0.1143740295 0.0861989915 -0.0058616534 0.1423313504 -0.0101212791 -0.0261775460 -0.0352951586 0.0663018913 -0.0513256450 -0.1922368006 0.0611692079 0.0636708289 -0.0187802960 0.1938635670 -0.1044679515 0.0101490292 -0.0567156012 0.0475259200 0.2665149658 -0.0613864754 -0.1047171862 -0.2045581658 0.0898089530 -0.3191018563 0.0040888814 -0.2994454003 0.2411490385 -0.0092800603 0.0088159189 0.0288167043 -0.0133451856 -0.0213401793 -0.0293975516 -0.0166854636 -0.0361548543 -0.0560034001 0.0119790401 -0.0404861581 0.0321813031 -0.0718511460 0.1052735188 -0.1855557670 -0.0367585497 -0.1191587573 0.0353921950 0.1776922017 -0.0932596367 -0.1223251715 -0.0343185531 -0.0667554386 -0.1841205259 -0.1833247262 -0.0395333945 -0.2030813077 0.0327655232 -0.1727831265 0.0000600327 0.0054202225 0.0102384775 0.0454101383 -0.0522300849 0.1076990056 0.0728150560 0.1004587266 -0.0217824597 -0.0257592414 -0.0084224601 0.0090174434 -0.0361708785 -0.0036610749 0.0339892395 -0.0251611401 -0.0280487656 0.0020943212 -0.0272744557 0.0483622174 -0.0065634031 -0.0506268063 0.0579483466 -0.0099239475 -0.0541975288 0.0362562331 -0.0265040200 -0.0178758600 0.0793236195 0.0189446558 0.0250502456 0.0084210510 -0.0122795850 0.0368717791 0.0056656730 -0.0046637898 0.0206647275 -0.0201684488 -0.0495366675 0.0685679215 0.0028479825 0.0242313172 0.0940969390 0.0227479727 -0.0070892649 0.1107567390 -0.0011680804 0.0504739543 0.0277847022 -0.0309472226 0.0744089240 0.0675227690 -0.0394025453 0.1021170742 0.0027249228 -0.0565324837 0.1040434658 -0.0320651228 -0.0232733013 0.0340483361 0.0170050780 -0.0887306464 -0.0212395747 0.0129608663 -0.0455206398 -0.0653099362 0.0286311022 -0.1413529991 -0.0424653005 0.0153340347 -0.1092412728 -0.0150478867 0.0454586012 -0.1739917366 -0.1775301034 0.0086799977 -0.2432989076 0.1116282828 -0.0213083250 0.0931452150 0.0385601103 -0.0852957427 0.1678543759 0.2027037388 0.0158805015 0.2469615582 -0.0815793372 -0.0153119217 -0.0008574142 0.0355572897 -0.0175041460 -0.1169057495 0.0261921434 0.0517221460 0.0086836372 0.1227376330 -0.0975475585 0.0298235391 -0.0723384359 0.0590603488 0.2761182374 -0.0789007402 -0.0980176432 -0.1892600294 0.0774416169 -0.3188745049 0.0285488490 -0.3049319337 -0.1204365557 0.0151086279 -0.0019477078 0.0195600938 -0.0704591405 0.0396708907 0.0150601681 -0.0906944106 0.0644673425 0.0219712036 -0.0320919758 -0.0029930044 -0.0587763332 0.0257330236 -0.0544100145 0.0745030053 -0.0302944330 0.0221799187 -0.0143709406 -0.1364259892 0.0047492704 0.1004366216 0.0255491731 0.0241824381 0.1167177361 0.1078223236 0.0292782327 0.1678527330 -0.0166829444 0.0454153675 0.0663096615 0.0370443752 0.0104663657 0.0898998604 0.0192133859 0.0025613239 0.0526410619 0.0644467616 0.0398497473 0.0131939764 0.0333282073 -0.0346407739 -0.0422358862 0.0501358470 -0.0928248496 0.0620191405 0.0366672194 0.0007044663 -0.0381028237 0.1155540970 -0.0083556995 -0.1984842624 0.1617906266 -0.0833780290 -0.0418597815 0.0559301279 0.0062183444 0.0678613247 0.2593308793 -0.0069588566 0.0310554714 -0.0575287910 0.0620616525 0.1492824644 -0.0810943980 0.1346087436 -0.0484419428 -0.1861936811 0.0335729569 0.0470831023 -0.0310130709 0.0668913952 0.0625006938 -0.0378156142 0.0596447476 0.0274877398 -0.0197736834 0.0756494404 0.0583267311 -0.0180413254 0.0595236426 0.0787230581 0.0266042905 0.0717012913 0.0315248882 -0.0486745136 0.0941090431 0.0407000866 -0.0271814886 -0.0110656043 -0.0452654878 -0.0240692396 -0.0187225800 -0.1088715951 -0.0693237701 -0.0091243616 -0.0708457454 -0.0472094968 -0.0164648551 -0.0603028318 0.1282811699 -0.0026456226 -0.1637548483 0.2274691153 0.1994812184 0.0171717757 0.3162149365 -0.1429380629 -0.0517525025 -0.0778490860 -0.0474066511 -0.0065693411 -0.1522807703 -0.2282088263 -0.0952601328 -0.2320598833 0.0696170676 -0.0591814641 -0.0205571275 -0.0178457568 -0.0722769316 0.0178103742 -0.0100735332 -0.0886697694 -0.0190184396 -0.0387887132 -0.0078080161 -0.0238197842 0.0301990450 -0.0970806914 -0.1536095146 0.0352553863 -0.0076936639 0.1035766332 -0.0550895158 0.1223996801 -0.0274806152 0.1512730648 -0.0181494103 0.0188149235 -0.0507825301 0.0684021799 -0.0624385853 -0.0085432901 0.0807885158 -0.0588660974 -0.0072355008 -0.0021916451 -0.0200888819 -0.0297040785 -0.0347943356 -0.0088549374 0.0022037944 -0.0390002207 -0.0375491245 -0.0533016968 0.0245980536 -0.0344162732 -0.0669729897 0.0458095220 0.0055551390 0.0042899935 0.0199927690 0.0112177253 0.0346743320 0.0690143157 0.0000954009 -0.0327468041 0.0920088925 0.0318636702 0.0368013989 0.1562453293 -0.0323353686 0.0885408408 0.1276546853 0.1349237676 0.0502616036 -0.0025597645 0.0096178094 -0.0187490975 -0.0686854757 0.0313014171 -0.0440758826 0.0326617235 -0.0098862750 -0.0017909068 -0.0607673310 0.0904403514 0.0242892089 -0.4697174747 0.2925867581 0.0566840918 -0.0341539191 -0.2572186557 0.1513107196 0.2166419744 0.3403480985 -0.1490357459 0.0471859541 -0.0557609510 0.0539213170 0.2056411135 -0.1158989444 0.0771455933 -0.0596206838 -0.2008009359 0.0615792922 0.0602918165 0.0480021899 0.0349732906 0.0421038082 0.1589401109 -0.0206782931 0.1001298665 0.0797828160 0.1384333695 0.0243509122 -0.0438487330 -0.0711175616 -0.0399640699 -0.0569809288 -0.1162484118 0.1032095770 -0.0927970157 -0.1010295284 -0.0132191814 -0.0362031953 -0.0532734284 0.0063200791 0.0200877532 0.0141410566 0.0289843334 0.0024549680 0.0427926440 0.0178429000 0.0730885143 0.0265763913 0.0124358342 -0.0418002200 0.0141280479 0.0541060159 -0.0737530786 -0.0443145349 -0.0193277734 -0.0996473473 0.0532099260 0.0178847163 0.0138935070 0.0235228354 0.0095570119 0.0348986912 0.0787999334 0.0367225868 0.0591741795 -0.0071576286 0.0206415395 0.0066946606 -0.0008890814 0.0367764088 0.0143982317 -0.0056639425 0.0156782343 0.0042419267 -0.0126506245 0.0088100164 0.0034532794 -0.0071889861 0.0039003310 0.0079191900 -0.0054926306 0.0097713047 -0.0027163245 -0.0128496662 0.0050189228 0.0042638154 -0.0083421110 -0.0009199314 -0.0739807522 -0.0225142174 -0.0359583055 0.0174722374 -0.0488406191 0.0119213325 0.0371544930 -0.0586282443 -0.0168751691 0.0315973037 0.0270357466 -0.0034688299 0.0370194398 -0.0294157258 0.0322336313 0.0617200621 0.0611998099 -0.0522956995 0.0129182573 0.0633679412 -0.0458515692 0.0111262657 0.0100128270 -0.0236339597 0.0165466096 -0.0122904345 -0.0590426340 0.0111700735 0.0447772157 -0.0813207605 -0.0122602424 -0.0173307134 -0.1362231143 0.0417564370 -0.0564392711 -0.1091579904 -0.0938720683 -0.0282015621 -0.0011631657 0.0168798952 0.0089940190 0.0512372723 -0.0006136179 0.0015530072 -0.0407231766 0.0563811362 -0.0021511917 -0.0776321353 0.0481027070 0.0640991661 0.0313007213 0.0321692999 0.1568114614 -0.1308915126 0.0600631378 0.0140494577 -0.1626672079 -0.0443295216 0.0982415709 -0.0419492817 0.1618347045 -0.0328133357 -0.1753314116 0.1930954465 -0.0988243042 0.0511541557 0.2632440922 -0.0825635494 0.0011672854 0.1005249126 0.0118833628 -0.0255585911 0.2218562433 -0.0444336983 0.1279868158 0.0836267265 0.0788542024 -0.0764081330 -0.0307862815 -0.0239936332 -0.0709875195 0.0103683091 -0.0228399931 -0.0591942389 -0.0960256168 0.0005194174 -0.0321675082 -0.0737303334 -0.0905498091 -0.0005806284 -0.0476709516 0.0492174390 -0.0657058137 -0.1160699295 0.0794787257 0.0692661214 0.0224187992 0.0447049807 -0.0041390697 0.0028748216 0.1519717604 -0.0374769985 0.0225579804 0.1795718471 0.0408190483 0.0444772675 0.1373181955 0.0489302287 0.0168498027 0.1325354142 0.0781160817 0.0220391023 0.1748349580 0.1098912489 0.0393237323 0.1470924748 0.0563375913 0.0352715576 -0.0310705671 0.1827321173 0.1068622836 -0.0676000223 -0.0041375105 0.0202696738 -0.1290704810 -0.0180478378 -0.0011921573 -0.0537678534 -0.1801575988 -0.1104534927 -0.0289413710 -0.0053109277 0.0700688667 -0.2263907312 0.0833551596 0.0076466531 0.0819796639 0.0776927242 -0.0587645691 -0.1008176053 -0.0294296625 -0.0729411265 -0.0880298018 -0.0412577210 -0.0395500904 -0.1281129865 0.0166419362 -0.0216174314 -0.0368794718 0.0146020104 -0.0366846502 0.0345952584 -0.0695111790 -0.0426072827 -0.0845725912 0.0781485203 0.0142375419 -0.0985940143 0.0419341656 -0.0182376656 0.0026307368 0.0045898630 -0.0348278023 0.0383095895 0.0461906973 -0.0120199033 -0.0381420020 0.0956146543 -0.0042085768 0.0358675004 0.1569899137 -0.0642116083 0.0801318996 0.1279739629 0.0901958694 0.0484959152 0.0026934838 -0.0405264177 0.0006466727 -0.0734605296 -0.0235198614 0.0129696469 -0.0392644371 -0.0713160049 -0.0431157443 -0.0047589493 -0.0038265799 0.0050408249 0.0974922582 -0.0513879908 0.0052428274 -0.0231055854 0.0770046630 -0.0351052185 -0.0755073385 -0.0641514944 0.0542071875 -0.0121294230 0.0306545399 -0.0130476736 -0.0638261315 0.0492495018 -0.0228051935 0.0235560150 0.0696511329 -0.0315087005 0.0001487654 -0.0031996786 0.0051504461 0.0055302680 -0.0110000858 0.0058776267 0.0104062383 -0.0124051136 -0.0068040500 -0.0034060497 0.0012261539 0.0284843303 0.0189182546 0.0186328170 0.0435992679 -0.0238013219 -0.0043275568 0.0451666424 0.0150024687 -0.0090560496 0.0004040056 0.0017432315 -0.0277869816 -0.0125660181 -0.0276056762 -0.0285490386 -0.0272090389 0.0087757838 -0.0501406630 -0.0219704978 -0.0022316573 0.0243580498 0.0059270477 -0.0370961194 0.0471394107 0.0430020827 0.0289323026 0.0652413508 -0.0168051543 -0.0008779247 -0.0003079854 0.0000182784 0.0036098905 -0.0091358211 -0.0221989531 -0.0032789011 -0.0188183608 0.0155686857 -0.0008866559 0.0002041095 -0.0018359811 0.0009255114 -0.0003090243 -0.0024837238 0.0003604518 -0.0004131669 -0.0027126068 -0.0045481602 -0.0028968642 -0.0017272445 -0.0046411711 -0.0043728269 -0.0017938022 -0.0041659070 -0.0063588862 -0.0029022325 -0.0077160659 -0.0013799773 0.0002212861 0.0341971099 0.0093296782 -0.0136369178 0.0236845140 -0.0324273657 -0.0007323457 -0.0157307733 -0.0322489923 -0.0114645294 -0.0326384586 0.1695875044 -0.0546620383 0.0311416070 0.2020619151 -0.3528697249 -0.0196303926 0.4733333506 0.0651071809 -0.0390543753 0.0195428409 -0.0972347763 -0.0897124330 -0.0325286064 0.1741625272 -0.1328161623 0.0171797581 0.2385230277 -0.1613058063 -0.0150240033 0.2728643992 -0.0421126311 -0.1384328893 0.1548957558 -0.0629994165 -0.1240329882 0.1721879674 -0.0426797349 -0.1219096037 0.1626001885 0.0118959904 -0.0020474495 0.0115040017 0.1045821723 -0.0337126209 -0.2476908012 -0.0104082200 0.2191977719 0.0950154272 -0.0493715095 0.0266364679 0.0389143967 -0.1706053283 0.1228306741 0.1450863658 -0.0446828102 -0.1585655466 0.0982808874 0.0312583014 0.0560983588 -0.0705972141 -0.0201432639 0.0909166840 -0.0209412669 -0.0678699389 0.0930987882 -0.0661705250 0.0122343440 0.1319166854 -0.0292580683 -0.0092424191 0.0792193575 -0.0129673355 -0.0470335118 0.1795242634 -0.0478601795 0.0761534599 0.0718898789 0.0416161056 -0.0573304897 -0.0245097878 -0.0794462055 -0.1347989500 -0.0783560632 -0.1327755023 0.0354641864 -0.0322342215 -0.1399674813 -0.0228747876 -0.0155175512 0.0259155355 -0.0040086496 0.0434146783 0.0159287792 0.0853510935 0.0404834096 0.0678449480 -0.1158387988 0.0640285462 0.0645359896 -0.0005215321 0.0355337121 -0.1288143431 -0.0134454405 0.0349804793 -0.1388507679 -0.0372194261 0.0272111016 -0.1423662898 -0.0141253248 0.0144901820 -0.1287824375 -0.0547958459 0.0153717668 -0.1615639916 -0.0492430085 -0.0006611862 -0.1347087771 -0.0167897503 -0.0259537021 0.0253302377 -0.1511154539 -0.0999406315 0.0642937057 0.0608667706 -0.0156028641 0.1239039905 0.0518634949 -0.0024468228 0.0580255504 0.2846902898 0.1548707349 0.0223735713 0.0363806708 -0.1388410218 0.3013882023 -0.1251710554 -0.0035695648 -0.1292384428 0.0128724512 -0.1075574546 0.1107076031 0.0202861439 0.0399318641 0.0494212424 -0.0132965225 0.0532409338 0.0232540487 0.0228204957 -0.0037797338 -0.0571802635 0.0400703605 -0.0318831887 0.0227284710 -0.1121409074 0.0009387557 -0.1182160137 0.1199516799 0.0473237419 -0.1566648836 0.0444206436 -0.0300358119 0.0278663245 -0.0016966589 -0.0353165312 0.0769435190 0.0405267522 -0.0219606253 -0.0011640164 0.1033626251 -0.0267746991 0.0602132233 0.1754194970 -0.0967842625 0.1074846276 0.1368767141 0.0842315042 0.0791861137 -0.0020555404 -0.0474936154 0.0041534474 -0.0483072785 -0.0326327741 -0.0048588318 0.0149172400 -0.0686638906 0.0075414415 -0.0540400431 0.0350328898 0.0433969639 0.1832569224 -0.0807839225 0.0295239061 -0.1357635630 0.2412235213 -0.0895091660 -0.2279379928 -0.0796383144 0.2141833848 -0.0181445243 0.0650973514 0.0006457735 -0.1262175191 0.1081277906 -0.0097535707 0.0569042364 0.1264126134 -0.0730804680 0.0189209487 -0.0184102721 0.0465803286 0.0099785903 0.0149919594 0.0320332614 0.0773566581 -0.0387487322 0.0496241497 -0.0150156297 -0.0668997645 0.0444269751 0.0116355094 -0.0186320315 0.0604433010 -0.0356846068 -0.1047414695 0.0808004923 -0.0094866170 -0.0814107776 -0.0225432697 -0.0006012586 -0.0585389617 -0.0160136477 -0.0453814495 -0.0871493581 -0.0116124777 -0.0256381443 -0.0725474976 -0.0108801279 -0.0012820645 0.0977845563 -0.0343222504 -0.1303577574 0.1673837838 0.0623062644 0.0803773241 0.2189119150 -0.1098173901 0.0283766237 0.0330351852 -0.0612913112 0.0089487009 0.0192427507 -0.1154419364 0.0319955011 -0.0039430461 -0.0240603956 0.0354403791 -0.0107717195 0.0038609705 -0.0389968222 -0.0530371233 0.0253534678 0.0957497138 -0.0110088604 0.0554073491 0.0641094847 -0.0159012143 0.0313705150 0.2829209047 0.1287241804 -0.0020860570 0.0522587970 -0.1735831447 0.2536531694 -0.1281180743 -0.0064878241 -0.1349522242 -0.0180131274 -0.0715576407 -0.0340077020 0.0304671194 -0.0765385214 -0.0196482939 -0.0213535649 -0.0648532647 -0.0482221702 -0.0220991852 -0.0044685409 0.0629340613 -0.0471325515 0.0281291400 -0.0171689783 0.1336215875 -0.0225976977 0.1284293169 -0.1340596285 -0.0595346902 0.1788920057 -0.0427222644 0.0338904385 -0.0407039984 0.0011109241 0.0260632187 -0.0908973908 -0.0392124919 0.0287759366 -0.0247546554 -0.0894621786 0.0372989425 -0.0645372301 -0.1585416494 0.1039165273 -0.1057829276 -0.1104519975 -0.0706870883 -0.0958403532 0.0209766514 0.0510745110 0.0067928833 0.0814250893 0.0358258928 0.0345363329 0.0220056262 0.0617592318 0.0116637709 0.0023884804 -0.0024032992 -0.0000461279 -0.0375567714 0.0238723194 0.0204239224 0.0142623888 -0.0523634522 0.0252188331 0.0308306172 0.0092891313 -0.0376846866 -0.0028213992 0.0110246294 -0.0056344724 -0.0063093331 0.0101899643 -0.0110682519 -0.0009129548 0.0176119323 0.0008066206 -0.0070625451 0.0095344567 -0.0086227434 -0.0116948971 0.0134840494 -0.0076434217 -0.0019947878 0.0073860829 -0.0090970220 -0.0085776311 0.0041019517 -0.0109642232 -0.0168159122 -0.0056930118 -0.0163053943 0.0009038176 0.0100915819 -0.0206967623 0.0020250076 0.0043285248 0.0071316647 0.0062079802 -0.0003874799 -0.0026071540 0.0097651195 0.0071450272 -0.0076788223 0.0025097432 -0.0091801013 -0.0041136054 0.0035763722 -0.0040273501 -0.0038222210 0.0100821451 -0.0065344397 -0.0058233142 0.0003486376 -0.0088392348 -0.0003881768 -0.0075320720 -0.0040698645 0.0005658774 -0.0069189069 -0.0052363311 -0.0030215565 -0.0146459895 -0.0063435471 -0.0016599154 -0.0098642305 0.0005068329 0.0024386222 -0.0052276683 -0.0006620294 0.0007549204 -0.0136724208 0.0014728917 0.0020676705 -0.0150835440 0.0027634760 -0.0036289900 -0.0530658794 -0.0206026410 0.0023949896 -0.0129190820 0.0289007785 -0.0424536597 0.0172029707 0.0010267540 0.0237065665 0.0079003909 -0.0037890629 0.0143395587 0.0119991064 0.0021596248 0.0097169207 0.0050815790 0.0000256000 0.0104142466 0.0238469937 -0.0112940932 -0.0086633903 -0.0286020090 0.1322301707 -0.5020999059 0.4482808588 0.2159226223 0.2735605512 -0.2774436951 -0.3429569567 0.2416240668 -0.0464140209 -0.0451596490 -0.0538358852 -0.0774093210 -0.1491818714 -0.0511395831 -0.1059205791 0.0036542963 -0.1260664855 0.0433034123 0.0169619823 0.0158745905 0.0962026156 -0.0514286315 0.1357522964 0.1151227596 0.1388666292 -0.0015558006 0.0087162673 0.0064087368 0.0076784307 -0.0174285965 0.0147062981 0.0335076435 0.0156770330 -0.0216837101 0.0003607741 -0.0068504523 0.0061821771 0.0001440924 0.1850768860 -0.1250096691 -0.1118047384 -0.0617618466 0.2580795774 -0.1227838094 -0.1430683493 -0.0445551567 0.1876985238 0.0143631265 -0.0701166930 0.0368922311 0.0615538514 -0.0787413272 0.0638258065 -0.0156649356 -0.1198126409 0.0244584251 0.0227855038 -0.0318113244 0.0329079599 0.0414205512 -0.0505056753 0.0306608024 -0.0234827815 -0.0098217418 0.0424932234 0.0466714593 0.0051196482 0.0208600501 0.0769268447 0.0527020331 0.0402972934 0.0038480664 -0.0165268415 0.0632711930 -0.0030131346 0.0013335173 -0.0548025809 -0.0619646815 0.0939278888 0.1156271721 0.0647455214 -0.0392024216 0.3083938226 -0.1406454825 0.3205504266 0.2173336247 -0.0459673488 -0.0422841148 0.0000342334 0.0208722580 -0.0909429875 -0.0850834306 -0.1442996080 -0.1280297843 0.0274965017 0.0210341295 0.0060222224 -0.0174316428 0.0210380330 0.0270635399 0.0461723155 0.0536384034 0.0473894978 -0.0362303121 0.0268244702 0.0015335836 -0.0139364675 -0.0099122612 0.0232791636 0.0004500168 0.0349934307 -0.0020984831 -0.0178641193 0.0753923995 -0.0057555231 0.0345570127 0.3110587086 0.1356142389 -0.0036217334 0.0607747222 -0.1574303189 0.2796559783 -0.1170244499 0.0028888851 -0.1340081382 0.0076853139 0.0328221583 -0.0872178558 -0.1025807989 0.0506921860 -0.0722931556 0.0316912685 0.0938313117 -0.0844784805 0.0175426935 -0.0019003333 -0.0276285921 0.0163796058 0.0203776982 -0.1205410026 0.0567911933 0.0662008434 0.0163828835 -0.0100061243 -0.0613968330 -0.0145463098 0.0061945189 -0.0269657088 0.0026798513 -0.0154292767 -0.0484775493 0.0193032267 -0.0090101975 -0.0136569271 -0.0194707007 0.0326049577 -0.0103058357 0.0239724258 0.0516006783 -0.0339021631 0.0599146355 0.0425265286 0.0365682181 0.0369087882 -0.0032674734 -0.0148034468 -0.0012429900 -0.0620418488 -0.0065015691 -0.0155610062 -0.0554806540 -0.0162266443 -0.0396990127 0.0546945543 -0.0325587007 -0.0364435254 -0.2210810082 0.1270453563 0.0465352662 0.1593811830 -0.3311943397 0.1440531958 0.2559299563 0.0658584094 -0.2832185226 -0.0039121508 0.0126157896 -0.0295122903 0.0044718078 0.0057234764 -0.0374748687 -0.0107768931 0.0301108753 0.0159093849 -0.0194652171 0.0080356077 -0.0350753783 -0.0045477239 -0.0249399289 -0.0252504179 -0.0164130270 -0.0043618520 -0.0600777418 -0.0300129110 0.0228872012 0.0426407534 0.0169826767 0.0078615269 0.0771264900 -0.0616201451 0.0381475386 0.0542235497 -0.0240474042 0.0141362495 0.0252861200 -0.0333432077 -0.0546500787 -0.0015818843 -0.0895276798 -0.0447410858 -0.0409628545 0.0158053070 -0.0848315454 -0.0297941640 -0.0334948218 0.0216362397 0.0605675732 -0.1068276676 0.0705567236 0.1415138809 0.0398351538 0.1150285980 0.0064863550 0.0277972473 -0.0251384771 0.0226368625 0.1002827475 -0.0610418031 -0.0176305122 0.0305540995 -0.0881566274 0.0826535872 0.0301715040 0.0406833006 -0.0559405382 0.0656425067 0.1437550223 -0.0593924676 -0.0153628019 0.0222321966 -0.1509983016 0.0419421952 -0.0190315801 0.0187893388 0.3447789963 0.1366110692 -0.0319403244 0.0281318506 -0.2643325919 0.3178240053 -0.2507551268 0.0156986501 -0.1626018402 0.0224817502 0.0555780456 -0.0115442674 -0.0535408219 -0.0406968687 0.0050279225 -0.0507487764 -0.0651511452 0.0378446681 0.0017873137 -0.0015920216 0.0030646274 -0.0000469817 0.0016935048 -0.0065055113 0.0147183553 -0.0004126873 0.0096372181 -0.0075042305 -0.0079216523 0.0122073029 -0.0003692656 0.0006030541 -0.0036904308 -0.0021623428 -0.0029243205 -0.0031993189 -0.0000836838 0.0011006812 -0.0063327425 0.0007090033 -0.0007339016 -0.0034669837 -0.0152332715 0.0129755044 -0.0078541595 -0.0028971076 -0.0218855396 -0.0101358379 0.0169468876 -0.0042380359 0.0130743142 -0.0191757636 0.0013360194 -0.0089202372 0.0140016711 -0.0046727349 0.0099878063 -0.0298908665 0.0209760799 0.0117733976 0.1546396788 -0.0945841549 -0.0673641670 -0.0953313119 0.2406541429 -0.1109738780 -0.1624697086 -0.0369539115 0.1845451173 0.0070544337 -0.0292518863 0.0223762625 0.0529855361 -0.0492991910 0.0238173414 -0.0232898036 -0.0738194658 0.0192399321 0.0116272505 0.0315137510 0.0089538489 0.0022873431 0.0914636355 -0.0216029764 0.0164225836 0.0576306277 0.0711351234 0.0134241023 0.0034056684 -0.0683419271 -0.0548919560 -0.0234540356 -0.1157500371 0.0722662361 0.0061511490 -0.1094239208 0.0163494238 0.0148851258 -0.0020493876 0.0525706029 0.0153554223 -0.0276489114 0.0385384131 0.0652682866 -0.0821593384 0.0936240064 -0.0331363632 -0.0589327989 0.0392007924 -0.0349198844 0.0339204949 0.0917532323 -0.0259984092 0.1009332658 0.0518164992 -0.0085200835 0.0152984452 -0.0051420929 -0.1086589764 0.0306634370 0.1532827864 -0.1954844026 -0.0899363632 -0.1175390901 -0.2579375618 0.1016134484 -0.0360845915 0.1015787585 -0.0681697360 0.0785670837 0.2961102377 -0.0911157879 -0.1754294734 0.0762193973 -0.2644207228 -0.0935184779 0.0002786924 0.0102353106 0.1038434560 0.0817720265 -0.0237299555 -0.0947990864 -0.2533012779 0.1885115897 -0.3719184774 0.0594327966 -0.0708907365 -0.0173466778 -0.0333525935 0.0432317553 0.0514512263 0.0334042296 0.0159141161 0.0307463962 0.0288991636 0.0131253663 0.0004161688 0.0005725862 -0.0032505138 0.0025356557 -0.0009735853 -0.0020852521 -0.0054016154 0.0035867136 -0.0049792736 0.0047305136 0.0020998971 -0.0080190220 0.0003700319 -0.0026348504 0.0025969649 0.0009378838 -0.0010305733 0.0027409898 -0.0008417576 -0.0022284811 0.0036316367 0.0010959573 0.0003938279 0.0039327560 0.0185901061 -0.0152480906 0.0109954056 0.0061884809 0.0247575474 0.0105629801 -0.0163631279 0.0029220188 -0.0110259382 0.0163194816 -0.0015966842 0.0107475591 -0.0051009479 -0.0006105485 -0.0037574130 0.0061162039 0.0014480038 -0.0326560404 0.1743132533 -0.1301994757 -0.1758553266 -0.0228402029 0.2583640383 -0.1347429243 -0.1076211008 -0.0340515459 0.1338067539 0.0134017359 -0.0928329541 0.0279411683 0.1723600263 -0.1602746104 0.0344936129 -0.0874844187 -0.2038605308 0.0801366472 0.0257743971 0.0751224495 0.0027757279 0.0514644145 0.2023231313 -0.0952257609 0.0653839271 0.1341130431 0.1662935655 -0.0189308246 0.0064904865 -0.0374795463 -0.0497801941 -0.0530418244 -0.0567285013 0.0256920067 -0.0003346121 -0.0649163362 -0.0596694325 0.0298791324 0.0291627657 -0.0366557453 -0.0295558371 -0.1256451295 -0.1703197751 0.1321097067 -0.3501028506 0.1306899822 -0.2310814282 -0.2523958021 -0.0179263530 0.0591302760 0.0479541384 -0.0858640041 0.0925728124 0.0891497652 0.0799676401 0.1239464655 0.0363802892 0.0213851864 0.0546740416 0.0371114003 -0.0352769782 0.0834616662 0.0765023750 0.1116506162 0.1068141836 0.0434168856 0.0515993879 -0.0421116930 -0.0027227976 0.0447721815 -0.0807885881 -0.0035303446 0.0912573908 -0.0408388974 0.0348574028 0.0879207247 -0.0178647748 -0.0166229431 0.0965154412 -0.0196558194 -0.0191617424 0.0824315313 0.0434043181 -0.0021665450 0.1446043160 -0.0377534227 -0.0278500076 -0.0078179177 -0.0323794060 0.0780096984 -0.1251903989 0.0281498569 -0.0005792714 -0.0773190900 -0.0309842846 0.0835583092 0.0220041545 -0.0054886248 -0.0255319206 0.0338641801 -0.0034980514 -0.0624269071 0.0146563785 0.0379785005 -0.0124976780 0.0279148600 -0.0201945985 -0.0374986752 0.0108744319 -0.0272086638 0.0036328039 -0.0046139376 -0.0381810771 0.0160272646 0.0041471868 -0.0197791349 -0.0109604643 0.0132468560 -0.0108484046 0.0135269004 -0.0227287190 0.0159921866 0.0185142959 -0.0021836936 -0.0419380664 0.0146607878 0.0316724146 -0.0044684785 0.0276943176 -0.0548223937 0.0093555422 -0.0095401780 0.0034084204 -0.0111123734 0.0040694662 -0.0556709510 0.0301298222 0.0968312569 -0.1212017198 0.1162736978 0.2458541179 -0.1465015848 -0.1349209138 0.0675441310 -0.0362888070 0.0518392539 0.0930013564 0.0437191321 0.0723247942 -0.0006661558 -0.1381031153 0.1609047594 0.0144377789 0.1555293257 0.1656601239 -0.1095828108 -0.0010705072 -0.1626830660 0.0059154489 -0.0806942498 -0.4019508038 0.2133366801 -0.1374176138 -0.2465808523 -0.2945789251 0.0923624230 -0.0323760997 -0.0117246743 0.0574447889 -0.0279363333 -0.0364260068 0.0852736899 0.0082764290 -0.0280104925 0.0334890578 0.0100282210 -0.0009453800 -0.0107656042 0.0544695316 -0.0951223670 -0.0751868702 0.1745972345 -0.2442198719 0.1169781017 -0.0681708944 -0.1814048806 0.0060751943 0.0089399266 0.0323835424 0.0525895693 -0.0026112656 0.0360137643 0.0234799534 -0.0024336224 0.0519832208 0.0043287694 -0.0035302585 0.0350629232 0.0102378651 -0.0026514569 0.0418075493 0.0318898560 0.0024151294 0.0465543652 0.0141891953 -0.0035805953 -0.0187951414 0.0452600421 0.0298875912 -0.0265064749 -0.0077406644 -0.0079434367 -0.0510504903 0.0301676828 -0.0083610928 -0.0079733644 0.0743871978 0.0019046945 -0.0167473995 0.0260711234 -0.0151663665 0.0366911792 0.0144396690 -0.0092877747 -0.0274871937 -0.0553554120 -0.0201428841 0.0158940714 -0.0711548734 0.0799157951 -0.0269450683 -0.0180204553 0.0795408989 -0.0133221877 0.0415606105 -0.0090778887 -0.0594569898 0.0782314149 -0.0201164549 -0.1011203895 -0.0179692924 0.0749041126 -0.0557064800 0.0854781665 -0.0103592268 -0.1129417999 0.0204899912 -0.0566132637 0.0117401252 0.0205104504 -0.0502324614 0.0125673741 0.0154019931 -0.0516467540 0.0072503119 -0.0176430240 -0.0082518323 0.0184947968 -0.0591021713 0.0227348940 0.0267925655 -0.0543441904 -0.0328896436 0.0468350519 -0.0097423237 0.0280223794 0.0052128201 -0.0316048510 0.0315225870 0.0204874454 -0.0533155183 0.0230188522 -0.0285960326 -0.0272280085 0.0152572205 0.0412293982 -0.0120867946 0.0259895598 0.0884235524 -0.0856747060 -0.0051013658 -0.0033370259 -0.0517977973 0.0107991433 0.0831514042 0.0278779374 0.0182080181 0.0016255835 -0.0032853990 0.0343612296 0.0063470598 0.0455535206 0.0282967376 -0.0242442244 -0.0018609128 -0.0413889793 -0.0128158765 -0.0426032182 -0.1243663303 0.0687810877 -0.0629386264 -0.0663436487 -0.1197998159 0.0371802046 0.0029966274 -0.0433585631 -0.0129490380 -0.0257784769 -0.0774505280 0.0666085235 0.0325124035 -0.0791387909 0.0177415095 0.0216839806 0.0072769466 -0.0255918883 0.0324796709 -0.0376246051 -0.0542554873 0.0860091495 -0.1044021906 0.0323051752 -0.0268251950 -0.0781251296 -0.0187550003 -0.0011322871 0.0256274215 0.0155837222 -0.0163618558 0.0096615716 -0.0173724472 -0.0233177117 0.0469139277 -0.0085368136 0.0054693754 0.0251641409 -0.0224691342 0.0210335628 0.0576536867 0.0343084842 0.0370389191 0.0217290703 0.0010834030 -0.0156196781 -0.0171888949 0.0151604729 0.0039267141 -0.0202210075 -0.0086124617 -0.0172588607 -0.0309667793 0.0375625697 -0.0069059422 -0.0051554877 0.0845156830 0.0021605038 -0.0150045311 0.0310953453 0.0115289825 0.0465094305 0.0440517974 -0.0157046172 -0.0291596411 -0.0086923178 0.0019653685 0.0192392595 -0.0321967308 0.0386872261 -0.0065845029 0.0700040369 0.0309433898 0.0347959546 -0.1283189627 0.0332688910 0.1717073996 -0.2596119985 0.0839744336 0.2749072902 0.0685458615 -0.2118991831 0.1721576302 -0.2742187560 0.0043923856 0.3378820329 -0.0523284259 0.1739634241 -0.0303732324 -0.0922618527 0.1131952969 -0.0019303167 -0.0565049145 0.1771767158 -0.0551402072 0.1213386381 0.0134339643 -0.0295469352 0.2731508339 -0.1120573865 -0.0228285109 0.2503761158 0.1383983844 -0.1115737261 0.0539645420 -0.1289890329 -0.0072054495 0.0044781164 -0.1279806168 -0.1118120862 0.0692607691 -0.1186801734 0.0079910217 0.0123277740 -0.0084952195 -0.0279620438 -0.0099940825 -0.0134601339 -0.0674558229 0.0602597203 0.0011030089 0.0103948965 0.0411465318 0.0028494567 -0.0663556159 -0.0282591668 -0.0129706097 0.0037407852 -0.0574365370 0.0017362548 0.0058746853 -0.0097821818 0.0030970870 -0.0109725262 0.0066452708 -0.0035086989 0.0304741214 0.0408189923 0.0271786261 -0.0136796989 0.0289698359 0.0093611917 0.0799128638 -0.0006683492 -0.0083154666 0.0408908929 0.0328388589 0.0309051673 0.0636788645 -0.0215683754 -0.0503519958 0.0785181839 -0.0177733492 -0.0040973836 -0.0129514140 -0.0362358306 0.0061631094 -0.0265875853 -0.0676627919 0.0477836558 -0.0804070262 0.0173485314 -0.0432935323 -0.0621915504 -0.0393444912 -0.0105726963 0.0341940938 -0.0012065198 -0.0294792716 0.0061350898 -0.0315164826 -0.0459241184 0.0705495091 -0.0388041116 0.0103123717 0.0335522652 -0.0881693677 0.0483698392 0.0995906245 0.0415472789 0.0846319840 0.0128900360 -0.0279124414 -0.0333279871 -0.0403225001 -0.0020827980 0.0106469338 -0.0447780328 -0.0499413738 -0.0358561747 -0.0695611564 0.0610893329 -0.0086533379 -0.0099432346 0.1529141269 -0.0028057932 -0.0305390470 0.0468863081 0.0524947344 0.0935998688 0.0944583468 -0.0303624128 -0.0510673682 -0.0035889309 -0.0199916645 0.0196602369 -0.0084102242 0.0135849937 0.0076084347 -0.2066986281 0.0373460479 -0.0838147593 -0.0017145877 0.0009054000 -0.0141797975 -0.0216223461 0.0090671592 -0.0016225658 -0.0322892016 0.0005719792 -0.0291959316 0.0208783156 -0.0147446860 -0.0467900210 0.0268785386 0.0114245505 0.0137872248 0.0209353799 0.0088454818 0.0197657031 0.0320235857 0.0094812861 -0.0003034407 0.0367520481 0.0559811788 0.0399120420 0.3028027235 -0.1827218417 0.1520744758 0.1095562172 0.4534924412 0.1635570067 -0.2134692602 0.0394563573 -0.1778390313 0.2013566678 -0.0452982552 0.0651718779 -0.3803990556 0.0760589432 -0.2864867991 -0.0346381780 0.0242954407 0.0490942371 0.0350761481 0.0088306327 0.0942446221 -0.1399309250 0.0553652567 -0.0517711032 -0.1051869145 0.0040382147 0.1583757729 0.0527599108 0.0133223836 -0.0038110640 0.1116025405 -0.0167529363 -0.0085975828 0.0030465691 -0.0375670843 0.0263218915 -0.0171703155 0.0266204120 -0.0646355248 -0.0885846115 0.0007070523 0.0041136401 -0.0571780671 0.0132290704 -0.1274521930 0.0120572940 0.0304746244 -0.1354458145 -0.1419580033 -0.1019743461 -0.2379549176 0.1358346742 0.1284077437 -0.2730615480 0.0653348943 0.0231298242 0.0290563950 -0.0596201093 -0.0592098237 0.0478364835 -0.1110051418 -0.1244864060 0.0825387589 -0.1034262700 -0.0849368056 0.0560968788 -0.0976670508 -0.0403174087 0.0555044057 -0.0621004664 -0.0702135417 -0.0034625541 -0.0864354840 -0.1009634899 0.1158533509 -0.0954947409 0.0199834841 0.0523465744 -0.1953803957 0.1054523791 0.2092025263 0.0630783550 0.1872679947 -0.0081846298 -0.0850851458 -0.0747882045 -0.0783403039 -0.0480495218 0.0044086647 -0.0833076535 -0.1246466177 -0.0771573262 -0.1236273924 0.1069290378 -0.0134614814 -0.0163516578 0.2908004199 -0.0062689286 -0.0581203991 0.0762448679 0.1340850212 0.1927464944 0.1983700176 -0.0642202987 -0.0983158537 0.0198246076 0.0778256467 -0.0082302323 0.1596117104 -0.0823742994 0.0669032837 0.1048074044 -0.0826010025 0.0548205322 0.0125925371 -0.0038328128 -0.0150458829 0.0367395441 -0.0159014598 -0.0232936920 -0.0062421645 0.0211180686 -0.0148638086 0.0269930573 0.0100817457 -0.0278152672 -0.0033888887 -0.0208525787 -0.0002581848 0.0188534233 0.0021516320 -0.0166748196 0.0014498028 -0.0264085037 0.0176256477 -0.0364150807 -0.0029811262 -0.0076081734 -0.0815716825 0.0366650960 -0.0210301206 -0.0524909087 -0.0592948979 -0.0177191222 0.0024291418 0.0247244804 0.0157286837 0.0056456440 0.0330035091 0.0180701830 0.1085835887 0.0086013420 0.0869955705 -0.0265112616 0.0331984719 0.0878027033 0.0089085712 0.0523800806 0.1822488542 -0.2349410678 0.0137841376 -0.0876257570 -0.1044993871 0.0689338677 0.2886729223 0.1480075018 -0.0240566131 -0.0046141804 0.2994410731 -0.0907237944 -0.0006747990 0.0191271445 -0.1505339761 0.0851988315 -0.0093680586 -0.0065593941 -0.1289457938 -0.1190377568 -0.1154748425 0.0196532603 -0.0783918565 -0.0535381670 -0.2893272094 -0.0345002042 0.0164238874 -0.0632096626 -0.0143566251 -0.1281161956 -0.0408697249 -0.0522979403 0.1073124843 -0.0952360342 -0.0625753399 0.0302957196 0.0343283616 -0.0164744546 -0.0992457187 0.0416816016 0.0182466434 -0.1461682465 0.1063638797 -0.0573197884 -0.0191769816 0.0819497787 -0.0058880135 0.0025741445 -0.0288841385 -0.1509331767 0.0594779712 0.0181181021 0.0178854420 0.0990047430 -0.1077222853 0.0756116084 0.0021090144 -0.0515672681 0.1473958473 -0.0462752875 -0.1240279228 -0.0176088223 -0.0993651633 -0.0134135984 0.0778060678 0.0435997362 0.0671492445 0.0086515548 -0.0617505357 0.0813434122 0.1475513488 0.0499119233 0.1492887844 -0.0567372199 0.0079676020 0.0167615030 -0.1956830398 0.0141322036 0.0490396008 -0.0339430068 -0.1014934530 -0.1362365628 -0.1238560186 0.0422009596 0.0660657945 0.0294103680 0.0691237256 0.0084039777 -0.0949095037 -0.0596313655 0.0140299979 -0.1589164120 -0.1080905117 0.0539465861 0.0027442941 -0.0010706598 -0.0058059330 -0.0013064292 0.0011656059 -0.0058535029 -0.0089281169 0.0038485071 -0.0095127241 0.0114957118 -0.0067806414 -0.0180855769 0.0094063738 0.0006602563 0.0044746444 0.0053006485 -0.0007908268 0.0081487097 0.0118991594 -0.0003954369 0.0002088436 0.0056197447 0.0160515842 0.0102610600 0.0769757860 -0.0473389417 0.0399691973 0.0191481537 0.1251041646 0.0518975081 -0.0567206295 0.0104082843 -0.0466650392 0.0474685032 -0.0162722470 0.0152475349 -0.1304070862 0.0247243864 -0.0954172264 0.0168732865 0.0085071452 0.0527851494 0.0003085510 0.0469491745 0.1338505051 -0.1127113569 -0.0503567902 -0.0425462173 -0.0136907054 0.0552488938 0.1716371761 0.1020583537 -0.0176607466 -0.0096003709 0.2712218016 -0.0937206725 -0.0075552400 -0.0339505703 -0.1269637840 0.1276784107 -0.0304246081 0.0272726785 -0.1209355165 -0.0762232569 -0.0225293455 -0.0557820907 -0.0250967484 -0.0053775673 -0.1854708426 -0.0937377829 0.0335535790 0.0930264809 0.2807969488 0.1945856976 0.3490600662 -0.4220077544 -0.0111612367 0.3539722694 -0.0478307944 -0.0205019500 -0.0425579313 0.0606734652 0.0468862898 -0.0088682208 0.0797886627 0.0442192630 0.0042168564 0.0474658953 0.0661634653 0.0020763211 0.0467259373 0.0193361117 0.0031960111 0.1003261958 0.0104070782 0.0213092751 0.0668391011 0.0032018286 0.0295595134 -0.0562028559 0.0019849963 0.0253731089 -0.1309942858 0.0379266758 0.0618269077 -0.0062814282 0.0744792145 -0.0120440531 -0.0697446477 -0.0276707973 -0.0462793233 -0.0133594964 0.0553308734 -0.0582943853 -0.1260234767 -0.0333824554 -0.1145937771 0.0203004384 -0.0018877102 -0.0122597595 0.1133642610 -0.0137177077 -0.0342845978 0.0043588170 0.0840810138 0.0877377881 0.0783558308 -0.0269579396 -0.0396772622 0.0027115292 -0.0869450464 0.0159446058 0.0406573290 0.0266600154 -0.0224567668 0.0625924913 0.0378040244 -0.0316083047 -0.0014510989 0.0005437694 0.0022171520 -0.0029835312 0.0013908431 0.0024914963 0.0003690698 -0.0009682596 0.0025426729 -0.0028174127 -0.0002534774 0.0036202652 -0.0011375858 -0.0001926609 0.0018810382 -0.0045350145 -0.0018477546 0.0049426755 -0.0041516691 0.0014021839 0.0028864113 0.0009454050 -0.0065502745 -0.0017503947 -0.0173943442 0.0107271848 -0.0128168613 -0.0067547266 -0.0360207680 -0.0085966436 0.0146402981 -0.0033058899 0.0058468883 -0.0125498470 0.0031295338 -0.0039784737 0.0214062208 -0.0060377852 0.0110505831 -0.0089280520 -0.0002128755 -0.0094460924 -0.0125181885 -0.0060383501 -0.0290727258 -0.0019268244 0.0121697037 -0.0069099038 -0.0010313260 0.0041393607 -0.0158596722 0.0022125281 -0.0105944757 0.0000297789 -0.0659485521 0.0217355424 0.0018285228 0.0527022680 0.0220085184 -0.0641684975 0.0343462957 -0.0457021398 0.0439785000 0.0348948462 -0.0452654642 0.0430543373 0.0398480040 -0.0503823469 0.0366630869 0.0017467426 -0.0586686484 -0.0130911998 -0.1553261454 -0.2162328469 -0.1146044008 0.1597458944 -0.0456787603 -0.1346386798 -0.0854178415 0.0251802426 0.0350759633 0.1665921069 -0.0602125082 0.0429236054 0.3248774643 -0.1212031373 0.1881882419 0.0626231302 0.1482728039 0.1490471191 0.1446842176 0.0479991460 -0.0233787979 -0.0068404400 0.1607614671 0.1827097169 0.3331004795 0.2358026817 -0.1012006162 -0.0700422496 0.0209238721 0.0143456689 -0.2200026989 0.0869395271 0.0763827974 -0.0241396921 0.1576412479 -0.0861611354 -0.1147684804 -0.0390400161 -0.0537241578 -0.0311412148 0.0777716251 -0.0724600177 -0.1941141410 -0.0485126537 -0.1548320962 -0.0023213870 0.0046389441 -0.0170908096 0.1144842279 -0.0221985466 -0.0448352971 -0.0246922664 0.1524773594 0.1022343334 0.1084847983 -0.0363548768 -0.0452546786 0.0265778309 0.0725737432 -0.0053443169 -0.1291460388 0.0050668482 -0.0061889605 -0.1993090822 -0.0520073953 0.0395227955 0.0006459530 -0.0005276563 0.0001671167 -0.0037254981 0.0020637609 -0.0000727315 0.0007267570 -0.0022809643 -0.0002434251 0.0003244180 -0.0044167086 -0.0005450654 0.0030293853 0.0021623166 -0.0003535715 -0.0071479689 -0.0075282826 0.0069282904 0.0019133578 0.0040348389 -0.0074454541 0.0060124904 -0.0014037428 0.0009307247 0.0113928737 -0.0035508359 -0.0042186605 -0.0014198371 -0.0053346630 0.0068379217 0.0058326320 -0.0066963067 0.0040704951 -0.0078070691 -0.0114130983 -0.0031618928 -0.0517211997 0.0046384293 -0.0331533318 -0.0024403410 -0.0048285008 -0.0099292516 0.0251872559 -0.0208089633 -0.0190430773 0.0753013078 0.0081077670 0.0541436847 -0.0022005000 -0.0590180243 -0.0863829485 -0.0597117208 0.0253896561 0.0134886874 -0.0017774001 -0.0030161523 0.0071438868 -0.0885852712 -0.0018562076 0.0352536581 -0.0267083456 0.0717358493 -0.0034961321 0.0170634654 -0.1502198960 0.1023516340 -0.2695385308 0.0961366147 -0.1541196939 0.1658656165 0.2095916090 -0.0237827002 0.1854984522 0.3470815952 -0.0201426002 0.1119521591 0.2106439913 0.0149140275 0.1130307392 0.0446133169 -0.0379666751 0.0195818505 -0.1256416138 0.0031229458 0.1112310299 -0.3445802434 0.2692105739 -0.0832905719 0.2078784865 0.1484172329 0.0050643445 -0.0182501209 -0.0017186370 -0.1586312560 0.0774096535 0.1429111118 0.1431438301 0.1465791039 -0.0857824077 -0.0045571293 0.0092130535 0.0090834385 -0.0223802541 0.0408288929 0.0873243906 0.0138775995 0.0779650097 -0.0430650626 -0.0074596403 -0.0046062065 0.0003882334 0.0008705944 0.0032201850 -0.0018795620 -0.0122286179 -0.0061601742 -0.0081766455 -0.0031110925 0.0018259363 -0.0028046907 0.0018901087 0.0014755323 -0.0032904559 -0.0047980766 0.0203788018 -0.0002419757 0.0142780254 -0.0042750980 -0.0062861886 -0.0885161522 -0.1353311004 0.1119982048 -0.0716533175 -0.0724688800 -0.1262520968 0.0148935350 -0.1664277321 0.0168976127 -0.0040425543 0.0030700445 0.0030877674 -0.0068530887 0.0055594132 0.0000154282 -0.0065681524 0.0071889888 0.0036431950 -0.0027526420 -0.0008428444 0.0000211930 -0.0017795604 -0.0016814422 0.0055275293 -0.0096008507 -0.0132464433 0.0100727552 -0.0087931940 0.0036394894 -0.0011393382 0.0005457658 -0.0017353660 0.0013598168 -0.0105999111 0.0097111769 -0.0052007811 -0.0098293808 -0.0108325463 0.0083531913 0.0042858779 0.0022709457 -0.0163314247 -0.0025919182 0.0002953004 0.0031443970 -0.0819099673 0.0115204563 -0.0759918708 -0.0000449730 0.0014886979 0.0030691588 -0.0031709905 -0.0021553109 -0.0103729097 0.0052149291 0.0106906288 0.0050078430 0.0045895027 0.0064658016 0.0020891710 -0.0038261776 -0.0037951974 0.0053484618 -0.0071735916 -0.0039533579 -0.0017166883 -0.0069883209 -0.0034821510 0.0130482789 -0.0038843015 0.0095661638 -0.0077590138 -0.0040284598 -0.0091021038 0.0037416846 -0.0378610123 0.0177062159 -0.0181535757 0.0198949986 0.0188554508 -0.0119857970 0.0534933687 0.0648060869 0.0092978998 -0.0103939744 -0.0113448723 0.0264246068 0.0124331345 -0.0099822697 -0.0197848660 0.0018368458 -0.0023316201 0.0015677299 0.0231944113 0.0103388734 0.0017941018 -0.0087520904 -0.0188685266 0.0008136281 0.0053602788 -0.0013914874 -0.0021292068 -0.0133732792 0.0115064608 0.0204470972 0.0179687162 0.0195376505 -0.0143376407 0.0002371817 -0.0008506994 0.0022175338 -0.0050723455 0.0041824921 0.0119068725 0.0012335905 0.0091375225 -0.0064895475 -0.0001541122 -0.0005258402 0.0007113555 0.0032029658 0.0049941968 -0.0000460346 -0.0040965754 -0.0010875601 -0.0045041197 -0.0005290757 0.0002494281 -0.0002727162 -0.0006514673 0.0018868527 0.0000184011 -0.0006032234 0.0018350095 -0.0011069211 0.0009646769 -0.0006433846 -0.0021352963 -0.0074535621 -0.0128193487 -0.0149920561 -0.0050676399 0.0108980075 0.0125151271 -0.2775567903 0.0328835660 -0.0969980522 0.0853678997 -0.0683475537 -0.0712935696 0.1163575274 -0.0828503936 -0.0845628233 0.0800667661 -0.0583832473 -0.0725467872 0.1034687829 -0.0486960867 -0.0860006621 0.0315245736 0.0532638998 -0.0886329742 0.1525970834 0.1105800748 -0.2049297371 0.1567102302 -0.0100232442 -0.1283077483 -0.1243946942 0.1661954394 0.0440951031 0.1184674409 -0.0448147328 0.1223152197 0.0288615134 0.3662805889 -0.0159744345 -0.1269805536 -0.0354585096 0.2934450800 0.0491013427 -0.1206248265 -0.1076174706 0.1409858795 0.0992640980 0.5588544213 0.0128429200 0.0046458833 0.0150843162 -0.0643013337 0.0213866443 -0.0370866825 -0.0395989788 0.0170299435 -0.0341177876 0.0450261870 0.1036258580 0.0898969224 0.0118901963 -0.0236715338 0.0059967398 -0.1462899925 0.0430659128 -0.0070851437 0.1166003955 0.1184032586 -0.0052562288 -0.0219091528 -0.0335815441 -0.0252899872 -0.0236926417 0.1803379271 -0.1553032517 0.1126792275 0.0133446469 0.1903134089 -0.0324581522 -0.0267900881 -0.0180722272 0.0540718786 0.0368704615 0.0400574829 -0.1515450102 0.0731595812 0.0154477469 0.0829620800 -0.0042280934 0.0258157009 -0.0360622565 0.0117682501 -0.0325668122 0.0372572036 -0.0068363935 0.0246559509 -0.0837003547 0.0706105040 0.0046901199 -0.0114447438 -0.0352003502 -0.0430991111 -0.0785168157 0.0884365791 0.2508927836 0.0181785772 0.2115934613 -0.2620704706 0.0171910218 -0.0658215837 0.0057527200 -0.1306916441 0.0901637674 0.3279381752 0.1027982761 0.2455774660 -0.2316320866 0.0380862271 -0.0199742201 0.0540678335 0.1066332455 0.2833715862 0.0560659003 -0.1226009457 -0.0620099707 -0.2159643761 -0.0004323883 0.0091999295 0.0209616077 -0.1415652363 0.2133995703 0.0749641966 0.0180460510 -0.0377473901 -0.1324640343 -0.0159276646 -0.0312201203 -0.1392952126 -0.0169408147 0.0182097806 0.0046865776 -0.0082088618 0.0153818640 -0.0025170368 0.0971911931 0.0140256730 0.0312138952 -0.0015511961 0.0003219736 0.0007984981 0.0111701212 -0.0060225879 -0.0023298383 -0.0031633174 0.0090619464 0.0033699539 0.0004048373 0.0113604369 0.0021581753 -0.0030635539 -0.0033111744 0.0005060355 0.0120057690 0.0247996988 -0.0071456022 0.0136660191 -0.0171880325 0.0233987975 -0.0065854797 0.0021936052 -0.0032396438 0.0072701448 -0.0145393606 0.0251790657 0.0077542085 0.0350538016 -0.0016592842 0.0006924688 0.0002384667 -0.0047164599 0.0006312445 -0.0001074190 0.0006935164 0.0002042244 -0.0061990882 -0.0080529013 0.0004946258 0.0158333432 0.0074330681 0.1421399284 0.0106796374 0.1687465351 0.0495026270 -0.0446377205 0.0690454340 -0.0784845314 -0.1583294481 -0.0849160439 -0.0409549939 0.0588873997 -0.0161440894 0.3093280689 -0.0716083160 0.0622846756 -0.2766821717 -0.1920775875 0.1196107583 -0.0422084661 0.0384063356 -0.0484047596 -0.0426933988 0.1102092281 -0.0909254615 0.1285857919 -0.0089888581 -0.0139927556 -0.0137802528 -0.0569055992 0.0339515937 -0.0766931870 -0.0728483412 -0.0117338813 0.0158964858 0.1340117168 -0.0885164572 0.2085077411 -0.1060194532 0.0966972516 0.0313547317 0.0102736990 0.0379060536 0.0159048606 0.1377990888 -0.0963126915 0.1137417720 -0.0947358192 -0.0248179995 0.0372698198 0.0099716881 0.0105892519 0.0213103582 0.0048612577 -0.0139911634 0.0394015895 -0.0016419569 0.0229415682 0.0031133268 0.0180843186 -0.0213849484 0.0211607383 -0.0036477725 -0.0690996491 -0.0153720487 -0.0211884994 0.0036066509 -0.0306514260 -0.0038245154 -0.0210186003 -0.0540955654 -0.0720628343 -0.0191250268 0.0054421915 0.0061273632 0.0418664262 -0.0110543309 0.0029428167 -0.0017732057 0.0458464227 -0.0499890817 -0.0199229854 -0.0205646275 0.0454837969 0.0596715621 0.0173455006 0.0041225395 0.0325349802 -0.0391339312 0.0138051492 -0.0570833054 -0.1175360156 0.0083068058 0.0040905439 0.5277626562 0.0343183990 0.1643007457 0.0071634864 -0.0040228102 -0.0010859333 -0.0294288070 0.0221165870 -0.0237209963 -0.0338787828 0.0224562266 -0.0098602735 0.0336676228 -0.0535526620 -0.0503404756 0.0109481087 0.0051258056 0.0060537329 -0.0013718668 -0.0942550422 -0.0119463723 -0.0365247152 0.0475411543 -0.0784607250 -0.0250424370 0.0468447380 0.0119731189 -0.0171559777 0.0443155049 -0.0009804473 -0.0646626909 0.0554072504 0.0614290149 -0.0157133237 -0.0033010842 -0.0061724024 0.0032588802 -0.0291295376 -0.0106600851 -0.1928142665 0.0198645787 -0.1261283111 -0.0047475032 -0.0000348553 -0.0060552791 0.0467294940 -0.0057239704 0.0429919212 0.0196519905 -0.0178240927 0.0205042145 -0.0307313197 -0.0654455672 -0.0473492872 -0.0080446504 0.0181729336 -0.0062012012 0.1065196688 -0.0265041895 0.0133016157 -0.0837458577 -0.0758907926 0.0158022004 0.0033162255 0.0161082312 0.0054264961 0.0040037223 -0.0533210816 0.0477516104 -0.0177381727 -0.0104350773 -0.0710715169 0.0063810463 -0.0008995795 0.0133196668 -0.0361329777 -0.0113625037 -0.0169805725 0.0542807113 -0.0197190612 -0.0117268034 -0.0034349526 -0.0154737777 -0.0009612628 0.0013195641 0.0047789529 0.0040618090 0.0060985737 0.0345516596 -0.0226659071 0.0147182266 -0.0163349037 -0.0084403152 0.0035988811 -0.0007967879 -0.0020867311 -0.0050114557 0.0086216578 0.0180581704 0.0026659964 0.0181920319 -0.0205296487 0.0023743115 -0.0040517204 -0.0035853673 -0.0128407467 0.0078893077 0.0178589657 0.0076632364 0.0181759541 -0.0211359131 -0.0000825169 -0.0021053539 0.0022068071 0.0021210719 0.0172634889 0.0029729497 -0.0105095111 -0.0045581167 -0.0143864882 -0.0014717393 0.0013928289 0.0019123886 -0.0079139515 0.0137409822 0.0047177567 -0.0008235000 0.0009392770 -0.0051318069 -0.0003729038 -0.0017691572 -0.0082550023 0.0045957270 -0.0060005653 -0.0105528764 -0.0172063826 0.0055518008 0.0049398376 0.0600577272 0.0077950467 0.0258242571 -0.0193035586 0.0003940314 0.0036518787 0.2114099686 -0.1265035328 -0.0060238683 0.0357977297 0.0690871014 0.0555874507 -0.0418955266 0.2280956936 0.1091102274 -0.0513353327 -0.0395812367 -0.0150420006 0.1224314834 0.4569622627 -0.0515363682 0.2574026985 -0.2842285249 0.3559287910 -0.0352575916 -0.0301377309 -0.0417312371 0.1121530204 -0.2125022981 0.2724673198 0.1754789249 0.3045039651 -0.0998463325 0.0360467569 0.0046109762 -0.0194800881 -0.0098904612 0.0235510345 0.0151882970 0.1385473988 -0.0312986296 0.0385710199 -0.0197432885 -0.0036309800 -0.0255353285 0.1430064057 -0.0255933567 0.1199956003 0.0627327509 -0.0549066348 0.0612642350 -0.0981885689 -0.2108695204 -0.1626534692 -0.0198468490 0.0540007262 -0.0192253064 0.3200583087 -0.0784818898 0.0395914620 -0.2445663805 -0.2413306487 0.0208222611 0.0266422251 0.0441652034 0.0377420507 0.0239644232 -0.2273756013 0.2068378481 -0.0830442956 -0.0492426841 -0.2589529392 0.0137259519 -0.0044210929 0.0433822789 -0.1304429334 -0.1044412046 -0.0533694551 0.2043180749 -0.1312439213 -0.0283660019 -0.0896490098 0.0027056537 -0.0183252141 -0.0268161924 0.0286621691 -0.0172660224 -0.0267365978 0.0271253361 -0.0170125859 -0.0460141959 0.0087495238 -0.0177879068 -0.0063538257 -0.0018422230 -0.0310452798 0.0170742521 0.0282123381 0.0698053689 -0.0463075490 0.0680074301 -0.1188900314 0.0083482149 -0.0422832527 0.0051878365 -0.1051237116 0.0438139413 0.1555775548 0.0563343816 0.1195335461 -0.1161391395 0.0294412718 -0.0165878465 0.0433386339 0.0920931566 0.2375376483 0.0432981351 -0.0928672152 -0.0564028300 -0.1869881240 0.0033507339 0.0020158933 0.0152406216 -0.1075596405 0.1743134087 0.0586441059 0.0177107410 -0.0292006877 -0.1056627257 -0.0018925038 -0.0352986043 -0.1229702281 0.0263202075 -0.0125126933 -0.0045169491 0.0429463318 -0.0055660369 0.0051608180 0.1107589081 -0.0036882802 0.0242044883 0.0067025547 -0.0018452296 -0.0018282420 -0.0461036762 0.0280255090 -0.0031128750 -0.0100150673 -0.0126897063 -0.0138074158 0.0150265138 -0.0563823400 -0.0305693143 0.0127438990 0.0096980729 0.0038171733 -0.0283729303 -0.1088210001 0.0118179835 -0.0566468741 0.0667357186 -0.0899999508 0.0035870326 0.0149964945 0.0120264771 -0.0289855187 0.0561237677 -0.0609721840 -0.0486828644 -0.0592654227 0.0313862353 -0.0119135274 -0.0016100290 0.0048339023 0.0044162222 -0.0074221839 -0.0041686319 -0.0298233167 0.0092568567 -0.0028394900 -0.0019754893 0.0058948071 0.0152799953 0.0147537587 -0.0158522464 -0.0212683352 0.0536819522 0.0411063226 0.0537284116 0.0079573034 -0.0103471598 -0.0242837411 -0.0313838700 0.0017172791 0.0154642142 0.0063867645 -0.0211490506 -0.0021155771 -0.0727377598 -0.0360926784 0.0486903476 -0.0027800646 0.0328657396 -0.0306651298 -0.0007565170 -0.0381621804 0.0110941386 -0.0919867858 0.0422494750 -0.0843682516 0.0621323080 0.0247959311 -0.0227120328 0.1300700590 0.0797160625 0.0214411815 0.0073111282 -0.0114104266 0.0377917232 0.0093612928 -0.0546190696 -0.0202110070 0.0322445032 -0.0188033816 0.0969205196 -0.0393487924 0.2326774428 -0.1868896670 0.1931900477 -0.3244440127 -0.0614541067 -0.0155773447 -0.0491069922 0.0336797073 -0.1480577165 0.0555458290 0.2230176473 -0.0453110185 0.1448200412 -0.1656621928 0.0370471404 -0.0340669621 -0.0701424910 -0.0311146727 0.0720336170 0.1781746296 0.1162125304 0.1769960505 -0.2196429287 -0.0263277029 -0.0040696396 -0.0315527778 -0.1268479775 -0.1147245606 -0.0073881371 -0.0129708634 0.0347713118 0.1007206957 -0.0232069986 0.0302839280 0.0172493694 -0.0030243399 -0.0401039136 0.0050506893 -0.0264977124 0.0121239391 0.0538525579 -0.0563122551 0.0597019139 0.0850851063 -0.0048929550 -0.0193726450 -0.0657993447 -0.0060424638 0.0599903830 0.0934146351 -0.4779251217 0.1691358715 -0.1833695042 -0.0058576007 0.0094961936 0.0039394777 -0.0474329362 0.0266257830 0.0296977607 0.0077132665 -0.0344681196 -0.0061272533 -0.0209400006 -0.0167450054 0.0128997394 0.0038987939 0.0013208069 0.0024291582 -0.0219753900 -0.0457270094 0.0176274807 -0.0543488090 0.0359923768 -0.0082577577 0.0318153017 -0.0437681130 -0.0072691762 0.0080988087 -0.0166596517 -0.0549671764 0.0139580086 -0.0963273558 -0.0175930871 0.0017514469 0.0065710034 -0.0096038239 -0.0038512418 0.0207181093 0.0089619941 0.0819061416 -0.0075938417 0.0399512375 0.0028180335 0.0100083223 0.0154669598 0.0150169741 0.0015572545 0.0081922168 0.0272357665 0.0227793112 0.0334593092 0.0027399605 -0.0056913695 -0.0039510513 -0.0198680082 0.0020670565 0.0070231671 0.0244009258 -0.0183761439 0.0041220796 -0.0671799560 -0.0369955046 0.0517114762 -0.0125749133 0.0161116110 -0.0342793550 -0.0059940492 0.0305350138 -0.0482257678 -0.0039055790 0.0228752932 -0.0127167986 0.0262573640 0.0018808981 -0.0034312978 0.0391238662 0.0051320681 0.0043791519 0.0035748945 0.0533951840 -0.0136777852 0.0624790676 -0.0447176119 0.0229939072 -0.0093535684 -0.0053904059 0.0117428191 -0.0191857187 -0.0007777429 0.0044297969 -0.0572862716 -0.0527903659 0.0175430513 0.0306444942 0.0604880016 -0.0346342087 0.0883828322 -0.0382999316 -0.2680474232 -0.0255709760 -0.1480354546 0.1358965599 -0.0236369687 0.0357516198 0.0302272502 -0.0449874865 -0.0504744328 -0.2377213006 -0.1052018052 -0.1484651603 0.1528810441 0.0135967889 -0.0268744389 0.0558730082 0.1351722089 0.3209567458 0.0435941325 -0.0551805670 -0.1207733427 -0.2966783645 0.0133690056 -0.0325961862 0.0027467096 -0.0706270941 0.2203026898 0.0485813172 0.0193788588 0.0495006200 -0.1055573719 0.1126198909 -0.1291257920 -0.2345866331 -0.0228003331 0.0023860552 -0.0238502346 -0.0301222663 -0.0114555072 0.0315332979 -0.5268074365 0.0232935997 -0.1664844130 -0.0047818851 0.0061584985 0.0000567094 -0.0140594653 0.0054185164 0.0250037979 0.0217115788 -0.0321204984 -0.0019221858 -0.0256439842 0.0123567185 0.0273118420 -0.0013703831 0.0013665930 -0.0053089786 -0.0090726361 0.0109341676 0.0070213207 -0.0135110951 0.0037315218 0.0177289430 0.0248252317 -0.0390043062 -0.0050232741 0.0091221232 -0.0234491625 -0.0266308554 0.0304402353 -0.0727189794 -0.0311625663 0.0029062957 0.0073360099 0.0005806527 -0.0029349212 0.0172630000 0.0055602769 0.0284771029 0.0081604343 0.0178771134 -0.0006621598 -0.0191467100 0.0006082470 -0.1110501143 -0.0240945658 -0.1518556586 -0.0226403582 0.0575496696 -0.0414658470 0.0684370352 0.1295204046 0.0722176467 0.0108603468 -0.0289096852 0.0148289688 -0.1981637283 0.0290639971 -0.0778108857 0.1741369847 0.1808263130 -0.0227214875 0.0069907480 0.0186011606 0.0052208881 -0.0002840067 -0.0515965249 0.0532782693 -0.1331921057 0.0530997946 -0.0375264161 0.0318896809 0.0550036234 -0.0234662035 0.0663309009 0.0588076789 -0.0001627981 0.0089903262 0.0259039914 0.0101706911 -0.0706697583 -0.0083543191 -0.0199313761 0.0357248446 -0.0347140049 0.0958392011 -0.1055977599 0.1329671278 -0.1475906948 0.1835433081 -0.2825338119 -0.0419158157 0.0017268941 0.0236193533 0.0155446401 -0.0528803408 -0.0183087305 -0.1422570498 -0.0992176183 -0.0657561324 0.0467784452 0.0174503870 0.0212201620 -0.0484556196 -0.0390014168 0.0014671346 -0.1507404553 -0.0013456616 -0.0377613923 -0.0062276414 -0.0171332732 -0.0354124307 0.0216179152 -0.0140027605 0.2093237634 0.0396654739 -0.0403434281 -0.1037896145 -0.2108508413 -0.0129170476 -0.0069899517 0.0234224667 -0.0708393330 0.2033661254 0.0586047414 -0.0131763765 0.0920314219 -0.0454388411 0.0837740390 -0.0914083567 -0.1749596989 0.0237857663 -0.0249065101 -0.0258664872 -0.0294616954 -0.0008532585 0.0208863018 0.4986971283 0.0120705009 0.1721020784 -0.0000076879 -0.0039648246 0.0068606173 0.0128107096 -0.0014667652 -0.0339657328 -0.0459038725 0.0606557038 0.0099334249 0.0343110901 -0.0156061510 -0.0385816684 0.0010972309 -0.0086816484 0.0138969444 0.0098727222 -0.0237016427 -0.0012967265 0.0095311424 -0.0078486935 -0.0153175637 -0.0256953052 0.0471955242 -0.0013689631 -0.0090869379 0.0281467888 0.0339906609 -0.0377710532 0.0978509635 0.0412318877 0.0087065549 -0.0106641992 -0.0145671606 -0.0004085289 -0.0201523190 -0.0037886733 -0.0256718895 -0.0283075781 -0.0475448567 -0.0039295577 -0.0634401773 -0.0956005029 -0.1236171922 0.0082278302 -0.0525648075 -0.2569730008 -0.1420014766 -0.2962791387 -0.0110052454 0.0794139442 0.1112091888 0.1483581374 -0.0059792230 -0.0411694765 0.0654649033 0.0013276064 -0.1219898902 0.2043675896 0.0766173779 -0.0314834338 -0.0233486831 0.0437417621 0.1278907130 -0.0853609549 -0.0687172714 0.2470399367 -0.0611309898 -0.0112094407 -0.0253307218 -0.1039018413 0.0764489450 0.0735331150 -0.3942763977 0.0887381385 -0.1306364248 0.1431261527 0.1105046736 -0.1237696636 0.0830335351 -0.0380393106 0.0204896438 0.0049894859 0.0145381998 0.0208384460 -0.0538269223 0.0534633113 -0.0475087437 0.0677587891 -0.0590308722 -0.0237265013 0.0054425740 0.0040781464 0.0138323785 0.0337097631 -0.0057512090 0.0072412963 -0.0550993187 -0.0092137660 -0.0051783851 0.0207048673 -0.0098705058 -0.0244267014 -0.0098254457 0.0152698203 0.0204344390 0.0587290238 0.0397790488 -0.0481584888 -0.0116685960 -0.0123636316 -0.0084109076 -0.0352062934 0.0048085975 0.0005433297 -0.0191595773 -0.0127618821 -0.0160305149 -0.0126444718 0.0110169885 0.0122748544 -0.0131368312 0.0291974909 0.0143842545 -0.0149722583 0.0301127645 0.0176894166 -0.0018146888 0.0033848463 -0.0044842693 -0.0268191582 -0.0233100173 -0.0102109028 -0.0063191276 -0.0105047979 -0.0211858729 -0.1178139014 0.0515468566 -0.1342791286 0.0045099877 -0.0085589454 -0.0305617323 0.0819048683 -0.0670481537 0.0343436427 0.1400826481 -0.1063278264 -0.0046752603 -0.0809486134 0.1082851598 0.1135804689 -0.0125477704 0.0246572375 -0.0437084146 -0.0457893649 0.1331901839 0.0255635629 0.0813222517 -0.0328017868 -0.0143245633 0.0379263500 -0.0430876126 0.0387025905 -0.0384613182 0.0354768279 -0.0565031740 0.0311721509 -0.1975518324 -0.0402142661 -0.0278562949 0.0163108956 0.0375733621 -0.0011343445 0.0072241592 -0.0068728945 -0.2689873654 0.1108916104 -0.0971574760 -0.0029154387 -0.0263885961 -0.0431736872 -0.0435683150 0.0039624274 -0.0120196794 -0.1056916037 -0.0674366066 -0.1221060702 -0.0129371586 0.0177754597 0.0352225396 0.0606875688 0.0017586435 -0.0153887994 0.0458726606 -0.0010844148 -0.0424660438 0.0667780291 0.0144593768 -0.0067575107 -0.0124110961 0.0223413903 0.0548200341 -0.0471099136 -0.0258158362 0.1117527049 -0.0324351644 -0.0022913085 -0.0163316372 -0.0376659572 0.0286152466 0.0251441373 -0.1408736938 0.0530987624 -0.0481826240 0.0501744988 0.0274332675 -0.0385264183 0.0405093402 -0.0229264901 0.0034385402 -0.0075993802 0.0058949011 -0.0111290146 0.0281878679 0.0041186116 0.0108268799 -0.0369804117 0.0253533951 0.0052872410 0.0058148609 -0.0009746206 -0.0095490734 0.0082183175 0.0067010139 0.0134077167 0.0292678805 0.0106065164 -0.0076012079 -0.0090147587 -0.0001664222 0.0136372748 0.0003583011 -0.0038004916 0.0102615299 -0.0210382392 -0.0043454079 0.0107738115 0.0046856861 0.0067411449 0.0019616031 0.0188805521 -0.0146283849 -0.0043265357 0.0021579158 0.0131596876 0.0194938248 0.0054208965 -0.0029856552 -0.0068753515 0.0113939886 -0.0283876442 -0.0108937489 0.0061875334 -0.0185852081 -0.0017593345 -0.0069639411 0.0071921325 0.0165315223 -0.0128416057 -0.0127593354 -0.0179591249 -0.0157472929 0.0092189922 0.0085351735 -0.2005976988 0.0192351105 -0.0613499756 -0.0055733003 0.0192119536 0.0604495346 -0.1847510649 0.1457324723 -0.0518730938 -0.2668527800 0.1824815810 0.0013776976 0.1542480145 -0.2269187225 -0.2189036694 0.0240314838 -0.0450116763 0.0763811597 0.0918334341 -0.2621114227 -0.0662299402 -0.1846496088 0.0798885590 0.0260919956 -0.0620959219 0.0613750538 -0.0769810690 0.0776801344 -0.0845381377 0.1026016570 -0.0382800798 0.3412473185 0.0516062082 0.0587182695 -0.0275096237 -0.0602179890 -0.0041684372 -0.0107108899 0.0112942901 0.4436773583 -0.1876234315 0.1491997344 0.0009161455 0.0055797510 -0.0162782689 0.0487956045 0.0242050861 0.0945042326 -0.0232942935 -0.0674023157 -0.0160073654 -0.0436083838 -0.0632911956 -0.0280429041 0.0096076011 0.0088863209 -0.0076449490 0.0429405210 0.0261183974 0.0733926111 -0.0087171429 -0.0419390683 -0.0468331476 -0.0029574967 -0.0278952901 0.0223035018 -0.0022972933 0.0410084416 -0.0204755950 0.0390585635 -0.0153196909 0.0854740969 -0.0099849323 -0.0019942599 -0.0147640663 0.0189447015 0.0574089510 0.0043194993 -0.0496648450 -0.0137333733 0.0199845992 -0.0042176484 0.0278010142 -0.0183530003 0.0148642030 -0.0178359156 0.0115308248 -0.0025071279 -0.0063053157 -0.0092430035 0.0669756466 -0.0056297837 -0.0067896707 -0.0145137975 -0.0072678572 0.0173677774 -0.0649711062 -0.0036838470 -0.0116658385 -0.0137105062 -0.0052397960 0.0155432090 0.0116252535 0.0145597175 -0.0190208846 0.0316375900 -0.0012750954 -0.0466377061 0.0024469839 -0.0226005319 0.0092965692 -0.0077647138 -0.0100151084 -0.0013406267 -0.0349009463 0.0315066451 0.0107415353 0.0282847874 -0.0347039978 -0.0459035785 -0.0097309712 -0.0022629759 0.0104278522 -0.0139996282 0.0626787225 0.0183153418 -0.0128578455 0.0530075721 0.0020764751 0.0379905304 -0.0342521692 -0.0538522050 0.0031089632 0.0017896400 0.0123022364 -0.0160659758 0.0087270860 -0.0193322348 0.1860946811 -0.0171198314 0.0754082984 0.0679689639 0.0167271623 -0.0276368385 -0.3288905243 0.1903572380 0.1794897784 0.0874011980 -0.3535461428 -0.1582309580 0.0079957993 -0.2653198838 -0.0526976966 0.0189619438 0.0588528198 -0.0279460406 0.0689390517 -0.0674674094 -0.1238717084 -0.2749693309 0.1780495082 0.1973482829 -0.0450701199 -0.1567888364 -0.0154240191 0.1434257252 -0.3461343323 0.1514521142 0.1343131527 0.1326447952 -0.0610575685 -0.0299899650 0.0406376054 0.0371071241 0.0018689271 0.0567796885 0.0147183416 0.0448363351 0.1419657741 0.1367431257 0.0084757315 0.0325150969 -0.0348834620 0.1711763437 0.0881030912 0.3206545328 -0.0516108376 -0.1972028554 -0.0193989764 -0.1374764373 -0.2080625521 -0.0892486904 0.0182953105 0.0211631542 -0.0242488288 0.1402745907 0.0727613232 0.2401844024 -0.0758548033 -0.1799649490 -0.1311580753 -0.0083956310 -0.0923637766 0.0472819661 0.0234082108 0.1358185666 -0.1163307918 0.1399481048 -0.0435094530 0.2797576227 -0.0250425529 -0.0024730434 -0.0340412979 0.0346057075 0.1436631030 0.0043047452 -0.1282574984 0.0007981904 0.0370761795 0.0078535774 0.0755373225 -0.0363068022 0.0261392848 -0.0232423181 0.0243983841 -0.0985646475 -0.0608891180 -0.0046968782 0.1627512956 -0.0113035803 -0.0243832416 -0.0250887608 -0.0016965791 0.0630731006 -0.0524901972 -0.0306640196 -0.0406473747 -0.1145356720 -0.0552197765 0.0661625314 0.0767391138 0.0135211318 -0.0695618161 0.0783488660 0.0120554578 -0.0720096273 0.1546635871 -0.0014690349 -0.0121864591 -0.0345723645 -0.0509769473 -0.0272033192 -0.1302919465 0.0488034734 0.0113432347 0.0434189338 -0.1044585151 -0.1227465601 -0.0541655696 0.0223867607 0.0505630990 -0.0435367649 0.1857014080 0.0662020789 -0.0695360210 0.2002644203 0.0666662796 0.0822280729 -0.0619579482 -0.1103061682 -0.0086756752 0.0132898795 0.0465462581 0.0173442802 0.0015530584 -0.0512420904 -0.1759788255 -0.0361635514 -0.0633752909 -0.0226680438 -0.0040604391 0.0145127431 0.0907302586 -0.0496734873 -0.0620349446 -0.0508309583 0.1295891269 0.0517231497 0.0104862682 0.0663263018 -0.0013268402 -0.0037826783 -0.0227211691 0.0151719273 -0.0130296279 0.0001772352 0.0328835745 0.0743800118 -0.0516292320 -0.0587817985 0.0122778329 0.0514411019 -0.0035129248 -0.0310724612 0.0966030934 -0.0486746998 -0.0355342101 -0.0185841972 0.0131626679 0.0126377381 -0.0158211889 -0.0104709062 -0.0001443379 -0.0172112026 -0.0032714653 0.0701568781 -0.0643805587 0.0109009475 0.0012283545 -0.0021341804 0.0542123950 -0.0915209833 -0.0511802868 -0.1963682372 0.0869148035 0.1710831660 0.0786433945 0.1024619339 0.1362855040 0.0555879121 -0.0383119241 -0.0194512055 0.0127954786 -0.0938647504 -0.0627147380 -0.1549415417 0.0001908816 0.0871417786 0.0947483839 0.0142492655 0.0376508681 -0.0636263276 0.0397152466 -0.0765022693 -0.0128504085 -0.0066343897 0.0003891530 -0.1629082325 0.0031531680 -0.0179190461 0.0451482731 -0.0825446957 -0.2207050318 -0.0081164574 0.1141144067 0.0259569654 -0.0595080253 0.0034597207 -0.0090228620 0.0376540402 -0.0506612477 0.0580889954 -0.0426633794 -0.1949495326 -0.0982173010 0.0342473794 -0.0053989458 0.1364388222 -0.0329124254 0.0604378420 0.0656242784 0.0352906513 0.3402356417 -0.0548796004 -0.0881799912 -0.1347656448 -0.1103252570 0.0966727819 0.1324540065 -0.0515149911 -0.0434414415 -0.0114174016 0.0313580065 0.0697238476 0.3921098543 0.1127724300 -0.0456518637 -0.0399256746 -0.0781345201 -0.0617598115 -0.0645091221 -0.0715623490 -0.0547444735 -0.0863933079 -0.0614392140 -0.0481016844 -0.0875354920 0.0775371329 0.0636258041 -0.0016063510 0.0712519720 0.0460782470 -0.1126394339 0.2124021568 0.1912487688 -0.0177342104 0.0598815962 0.0682471516 -0.0059937127 0.0113605846 0.0291042411 0.0031034941 -0.0878662563 -0.0589327250 -0.1096915343 -0.1088764444 -0.0725528431 0.0115561364 0.0038166075 0.0055560049 -0.0706801729 0.0476434995 0.0151211342 -0.0296734267 -0.0208735597 -0.0228227711 0.0301650256 -0.0730341626 -0.0436911868 0.0032831804 0.0027672945 0.0025352247 0.0385861703 -0.0259250693 -0.0455860529 -0.0538663461 0.0249191651 0.0510478294 -0.0206032179 -0.0095089591 -0.0126788710 0.0197541032 -0.0584341867 0.0656000475 0.0331625548 0.0800243730 -0.0240229633 0.0147803921 0.0006915192 0.0048867172 -0.0031607105 0.0035531385 0.0005444818 -0.0112551267 0.0101962312 -0.0097725424 -0.0133054355 -0.0189170988 0.0297304149 -0.0767493193 -0.0746353442 -0.2009581475 0.0823925216 0.1434704613 0.0644100398 0.0789147681 0.0910565652 0.0072071252 -0.0113673066 0.0019580195 0.0046031192 0.0122242163 -0.0846680973 -0.1819526750 -0.0205173224 0.0294440834 0.0714194531 0.0220878678 0.0395019711 -0.0143336562 -0.0235947597 -0.0898141934 0.0988252616 0.0509742557 -0.0595800495 -0.2056137235 -0.0387015933 -0.0503956049 0.0317549167 -0.0728499290 -0.1007799986 0.0100138820 0.0309615966 -0.1079653056 0.0107924777 0.0380212893 0.0132995977 -0.0016329221 0.0326751160 -0.0047464336 -0.0450086311 0.1773256540 -0.0163711564 0.0445868134 0.0390562894 0.1616924176 0.0042059201 -0.0721479795 -0.0907993506 0.0338851411 -0.2865443492 0.0218146669 0.1764903445 0.1019580806 0.1023221584 -0.0565061393 0.0197466734 0.0704208534 -0.0137997445 0.3147487671 -0.0307225445 -0.0519842886 -0.1273493572 -0.1144226863 0.0694736003 -0.0123105587 -0.0004485657 -0.0105787252 -0.1206130465 0.0143930699 0.0264681221 0.2995554328 -0.1184983341 -0.1003494331 -0.0407279064 -0.0346146838 0.0240527157 0.0250180805 0.1867910704 0.0329870722 -0.0638624834 0.2664819147 0.0557330508 0.2145555902 -0.1759512978 -0.2144477079 -0.0063981076 0.0082336303 0.0101340365 0.0307435164 0.0553934878 -0.0202119183 -0.0061145745 0.0788910106 -0.0619122441 -0.0060731878 0.0005885758 0.0031371628 0.0140180686 -0.0078286182 -0.0088653479 -0.0089182756 0.0228571155 0.0102912453 -0.0020009887 0.0149703834 0.0030236723 0.0011804163 -0.0040347793 0.0012172985 -0.0008895743 -0.0056563523 0.0033968012 0.0122559990 -0.0067433720 -0.0169148637 0.0060851017 0.0008425148 -0.0029067031 0.0073928334 0.0049247117 -0.0256181876 -0.0039969447 -0.0183341559 -0.0022598685 -0.0052318233 -0.0003668346 0.0010172883 0.0005553554 0.0008204685 0.0000868212 0.0326914600 -0.0050926964 0.0266859169 0.0169423431 0.0240466225 0.0626071280 -0.0001941044 -0.0037055018 -0.0372737469 0.0900943782 0.1096505257 0.1025193607 0.0617482640 0.0648767708 0.0388534955 -0.0334388684 -0.0235632791 -0.0244748588 -0.0186642815 -0.0594300704 -0.0942186128 -0.0430169625 -0.0214948674 0.0000170405 0.0252055989 -0.0244185432 -0.0380895073 0.1396647271 -0.0651243631 -0.0986550879 0.1243801472 -0.0594638645 -0.0314109069 -0.0482682197 0.0052582647 0.0654318239 -0.2211791464 -0.1478216956 -0.0504687943 0.1143145891 0.0662524784 -0.0881188931 0.0247122879 0.0402927106 -0.0009758960 0.0958750272 0.0096849305 0.0436247020 -0.0899837103 -0.0008585996 -0.0448411902 0.3272586826 0.0014005438 -0.0458278844 -0.0546435400 0.0038569470 0.0786474784 -0.0283390641 -0.0313677326 0.0075363741 -0.1931752428 -0.0636340333 0.0710157556 -0.0801611892 -0.0083319176 -0.0827267536 -0.1730199201 0.0348314600 -0.0392762313 -0.0670276410 0.0597019930 -0.1351539222 0.0019214643 0.0483907914 0.0251493670 -0.1965245743 0.1104082618 0.0964656552 -0.0909664809 0.0901312247 0.0690993611 0.0956372850 -0.0335561358 -0.0202701584 -0.1672701386 0.0217533610 0.0406036602 0.1459338567 -0.3453697746 -0.3029106370 -0.1370694337 0.0305093304 -0.0316200916 -0.0148506034 0.0055519030 0.0484357957 0.0254877409 -0.0262850425 -0.1060842897 -0.1160792055 0.0141225771 -0.2033754634 0.0055265524 0.0000840100 0.0165527873 -0.0390790915 0.0332244529 -0.0184350800 -0.0676968897 0.0444184160 -0.0008295023 0.0511575840 -0.0618858566 -0.0604201374 -0.0016896031 -0.0044993779 0.0013234208 0.0543846086 -0.0131734435 -0.0640955258 -0.0181394726 -0.0026856459 0.0387933666 -0.0146569666 0.0089202719 -0.0134701975 0.0008477756 -0.0171640183 0.0566735976 0.0530019249 0.0471471158 -0.0686963179 0.0262580887 -0.0065174841 0.0173189959 -0.0094986341 -0.0064225470 -0.0056754404 -0.1175247699 0.0194605115 -0.0770673515 -0.0691879776 -0.0565593688 -0.0495520571 -0.0705424792 -0.1313583077 -0.2480006313 0.0717443607 0.0626203005 0.0337586383 -0.0059249033 -0.0455244376 -0.1602889645 0.0429885228 0.0515787447 0.0552656350 0.0883500894 -0.0359350513 -0.1104810722 0.0354819710 0.0174955286 0.0200229954 0.0137061961 0.0574867253 0.0490201174 -0.3233496025 0.0451400223 0.3086999069 0.0150353270 -0.0587813506 -0.2039854904 -0.0085619022 -0.1074724978 -0.0918303515 0.3162970836 0.0799025005 0.1325480859 -0.2713398354 -0.2343821255 0.1678653366 0.0628017409 0.0338719443 0.0026450747 0.0257872930 -0.0196234351 -0.0001877373 -0.0506789035 -0.0935847979 0.0327104644 0.0917377709 0.0543845749 -0.0025100025 -0.0057972471 0.0324754858 0.0386315402 0.0453048853 -0.0261480831 -0.0816685952 -0.0720476050 -0.0758694312 0.1055876418 -0.0102988345 -0.0177906206 -0.0376697071 -0.1426302374 0.0212094161 -0.0396134986 0.1050684574 0.0428424009 -0.0255126158 -0.0045342832 -0.0041820572 -0.0019368856 -0.0824910162 0.0415408478 0.0273269672 -0.1280254145 0.0406271591 0.0267888754 0.0347876404 0.0114710511 0.0038699893 -0.0985943845 0.0049695196 0.0321119567 0.0593162918 -0.1710305618 -0.1242416977 -0.1155014538 0.0649628915 0.0380281263 -0.0090136544 0.0434447952 0.0304817630 -0.0317769320 -0.0009132359 -0.0178756132 -0.0027262506 -0.0851357703 0.0930412111 -0.0166506883 0.0025863044 0.0024463616 0.0367520926 -0.0241828384 -0.0104985563 0.0000227429 0.0348245744 0.0224456000 -0.0217394698 0.0515704092 0.0254599469 0.0079785618 -0.0069170350 0.0013595376 -0.0157658435 -0.0166061527 0.0260087540 0.0334014343 -0.0118669936 -0.0472355302 0.0174962290 -0.0132598861 -0.0075137932 0.0501455227 -0.0234019950 -0.0924604413 -0.0087000481 -0.0323128151 0.0119282212 -0.0294962686 0.0087834724 0.0016362915 0.0085385246 0.0095287449 0.0040392759 0.1207599868 0.0022228779 0.1097734275 -0.0054951725 -0.0038282840 -0.0130546354 0.0045570698 -0.0009681348 0.0082212432 -0.0120055437 -0.0217921151 -0.0136387812 -0.0160051065 -0.0205747135 -0.0173600562 0.0056318153 0.0042334322 0.0091361454 -0.0023850928 0.0162133837 0.0290175427 0.0108853358 0.0042264768 -0.0030310448 -0.0022240064 0.0037265537 0.0050461947 -0.0320865398 0.0159827002 0.0198304542 -0.0293587267 0.0155934708 0.0079479516 0.0094927899 -0.0056683163 -0.0150876770 0.0613428714 0.0032716322 0.0212684190 -0.0317337728 -0.0123670578 0.0193388935 -0.0117133591 0.0001730721 0.0045287063 -0.0078088874 0.0010798880 0.0056176515 0.0097762090 0.0226364981 -0.0063847996 -0.0413673841 -0.0460955244 0.0061790428 0.0016189276 -0.0034954625 -0.0169420403 -0.0121653207 0.0069077271 0.0015289323 0.0095850663 0.0153061255 -0.0302845273 0.0038664245 0.0008805230 0.0153575390 0.0249617305 -0.0058819221 0.0144163982 -0.0180985706 -0.0083335222 0.0109568613 0.0031926124 -0.0018233917 0.0017258764 0.0455438761 -0.0140890284 -0.0132721025 0.0157366341 -0.0081160918 -0.0060959073 -0.0105129143 0.0007619537 -0.0020943824 0.0323307494 -0.0145335529 -0.0128984669 -0.0178026019 0.0423684872 0.0434827898 0.0229582582 -0.0068796763 0.0054783124 0.0016716776 0.0054776482 0.0037996915 0.0163782430 -0.0025069386 0.0075488957 0.0201643368 0.0204746998 -0.0183893585 -0.0334484725 0.0065988365 0.0949079215 -0.0360665005 0.0626318077 -0.1388349849 -0.3250717555 0.3497769340 0.0884097728 0.1703592847 -0.0998306772 -0.1907747636 0.0133628146 -0.0394951493 -0.0149645023 0.1970356487 -0.0752024957 -0.2286242254 0.0665669455 -0.0681897146 -0.0227628783 0.0338394920 -0.0287808535 -0.0678647573 0.1325704031 -0.0998481896 -0.1146547953 0.2714635557 -0.0783946015 -0.3658133986 -0.0218240712 0.0217441806 0.0905369141 -0.0028123455 0.0185589696 -0.0155715021 -0.4363884977 0.1767048362 -0.1494766631 0.0269877536 0.0087469570 0.0185113021 -0.0106642396 0.0371708143 0.0456577873 -0.0469621907 -0.0034597466 -0.0409391684 0.0247797316 0.0586132256 0.0929343238 -0.0188936558 -0.0105649656 -0.0211762736 -0.0139994309 -0.0060001006 -0.0020464830 -0.0270546129 0.0227046511 0.0514287346 -0.0140800973 -0.0094318741 -0.0204924214 0.1087114571 -0.0269597120 -0.1015173255 0.0216121592 0.0009074368 0.0331529301 0.0000742624 0.0198110025 0.0447154417 -0.1444219041 -0.0427225120 -0.0551346960 0.1287065866 0.0197500939 -0.0488787207 -0.0007088226 -0.0007992956 -0.0159975631 -0.0003321583 -0.0050325420 -0.0087666577 0.0020977346 -0.0142297330 0.0028241969 0.0479773408 0.0591375092 -0.0142253486 0.0036989387 0.0073805442 0.0109217664 0.0103615153 -0.0045922820 -0.0185101606 0.0045861297 -0.0140930838 0.0309224192 0.0004724571 -0.0020951935 -0.0104545052 -0.0402827824 0.0062328136 -0.0213445603 0.0306536831 0.0059108290 -0.0004706987 -0.0014627960 -0.0035341450 -0.0023944036 -0.0208998267 0.0092828784 0.0049908169 -0.0287530176 0.0059241928 0.0021904904 0.0062873064 0.0047213240 0.0027328622 -0.0249337457 0.0048396147 0.0096532418 0.0118470769 -0.0349811881 -0.0276179866 -0.0276177515 0.0164899684 0.0092854487 0.0032533733 -0.0162825380 -0.0109394897 -0.0436998766 0.0022792003 -0.0119489724 0.1975633384 -0.0237924381 0.0932392886 -0.0609354042 0.0095856069 0.0208980510 0.1149708418 -0.0715598378 -0.0516419222 -0.0403840910 0.1603433858 0.0878456953 -0.0532710790 0.1589010202 0.0631678893 0.0380816508 -0.0268650384 0.0046504328 -0.0615265384 -0.0922317405 0.0956974995 0.1125234202 -0.0275116579 -0.2119623278 0.0621844580 -0.0654947289 -0.0441776099 0.2511672476 -0.1515801294 -0.3907457449 -0.0294341842 -0.0902334255 0.0465001115 -0.1191204552 0.0409951943 0.0193191827 0.0291764691 0.0379734215 0.0136919016 0.4340039435 0.0542416376 0.4345012487 0.0252368517 -0.0438657509 -0.0913297092 -0.1010491346 0.0863322704 0.1049705313 -0.3354133166 -0.2156880780 -0.3535297067 -0.0606976473 0.0386703382 0.1770870658 -0.0068884993 0.0414964958 0.0584444809 -0.0214541546 0.1219492057 0.2379642767 -0.0539702255 0.1661389695 0.3684571100 -0.0894552363 0.0444964240 -0.0430248230 -0.0461971247 0.0974878344 -0.1063937529 -0.1558777007 0.1295045262 0.0869549069 0.1238942843 -0.0604023045 0.0334550022 0.1219708114 -0.2423037861 0.0378301759 0.1522476829 -0.0886521972 0.0302607296 -0.0422325780 -0.0182145610 0.0205614822 0.0147895195 0.0396732582 -0.0355225400 0.0192226492 -0.0184336033 0.0241378300 0.0656999358 0.1567398181 -0.0163737891 -0.0037023340 -0.0162779249 0.0536572828 0.0824886613 -0.0163588847 0.1202177592 0.0051723238 0.0019084368 0.0424027645 -0.0139172108 0.0122506911 -0.0443468453 0.0689271978 0.0060283355 0.0053808622 -0.0303121436 0.0046723180 -0.0468159463 -0.0163723490 0.0266708754 -0.0088404996 -0.2080655937 0.0302703352 0.0552135128 0.0868278167 0.0066745578 0.0187619659 0.0232892795 -0.0272441121 0.0064716000 -0.0733327695 0.0883671771 0.0387739682 0.0373745081 -0.0442079796 -0.1199177208 0.0168393304 -0.0551278914 -0.0995428422 0.0090814648 0.0105231297 0.0036979596 0.0137849233 -0.0313134393 -0.0033679684 -0.0435866727 -0.0509632193 0.0002699852 0.0042667250 -0.0005112480 -0.0026590917 -0.0067845957 0.0038485833 0.0052270906 0.0066423826 -0.0145587535 -0.0068587970 0.0010802391 -0.0080534151 -0.0013720138 -0.0026118233 0.0026745222 -0.0007538581 0.0051272583 0.0087625010 -0.0066365516 -0.0040257573 -0.0001077917 0.0180177485 -0.0055296147 0.0051524240 0.0041239675 -0.0204770006 0.0117476082 0.0322788662 0.0007903603 0.0063306803 -0.0023341314 0.0091943845 -0.0031866655 -0.0024909276 -0.0019957458 -0.0022314978 -0.0009723053 -0.0234345052 -0.0020211446 -0.0254030572 -0.0238750602 0.0225583999 0.0138435078 0.0759290146 -0.0287635379 0.0015367820 0.1325076783 0.0356597899 0.1450747071 -0.0213550287 -0.0821814021 -0.1327651116 0.0234369981 -0.0228494575 -0.0071482929 -0.0373685183 0.0029944477 -0.0127173516 0.0879827548 -0.0655584124 -0.2267299219 0.0265709023 -0.0082611446 0.0200018621 -0.0580093259 0.0198189958 0.0652438057 -0.0574707407 0.0220969544 0.0153761151 -0.0179096138 0.0446575612 -0.0415408170 0.0643402710 0.0831706487 0.0153103684 -0.1073191246 0.1190386758 -0.0156342024 -0.0174584867 -0.0364024746 0.0248838644 -0.0840482861 0.0689519824 0.0026285585 -0.1791677084 0.0305275271 -0.0100486645 -0.0288611872 0.0362410142 -0.0261937746 0.1127129514 -0.0207128739 0.0509276431 0.4240465365 -0.0149799310 0.3061889586 0.0709870639 0.0491471763 -0.0341126406 -0.0129850924 0.0192120373 -0.0530763991 0.2144079503 0.0060391295 0.0925261476 -0.2266408557 0.0262084902 -0.1855866272 -0.0506736605 0.0857315792 0.0078547329 -0.3137377655 0.0362703955 0.0918730032 0.1960235404 0.0316866058 0.0542770205 0.0219265104 -0.0839299370 -0.0222900619 0.0117086844 0.0715322323 -0.0065831382 0.0237970954 0.0405775113 -0.1032971525 0.1503924256 -0.1738448493 -0.2053326263 0.0028829442 0.0006819521 -0.0066069320 -0.0180021519 -0.0843208456 0.0210540294 -0.0148736315 -0.1146115618 0.0587634635 -0.0064115392 0.0017033889 0.0017919842 0.0091386018 -0.0057549481 -0.0030596842 -0.0025719871 0.0137952855 0.0081951116 -0.0070218198 0.0164606179 0.0076522700 0.0059256407 -0.0025252011 -0.0002339724 -0.0071471116 -0.0115697186 0.0114787223 0.0104454678 -0.0002640750 -0.0256741890 0.0046644015 -0.0086673775 -0.0047718141 0.0275871080 -0.0214979174 -0.0393602279 -0.0041055744 0.0010892049 0.0106333015 -0.0125027007 0.0068987659 0.0008412652 0.0042589501 0.0043030618 0.0022157837 0.0320285382 0.0113500823 0.0368389407 0.0055133452 0.0257627835 0.0197870341 0.0624821411 0.0145624717 0.0595641602 0.0585405997 0.0098174222 0.0713807094 -0.0032570197 -0.0252129844 -0.0310139035 0.0054609638 -0.0296258539 -0.0279504069 -0.0395918140 -0.0061516511 -0.0207751395 0.0508785314 -0.0425544200 -0.1559716912 0.0082119157 -0.0008986439 0.0131235439 0.0283045333 -0.0190231189 0.0084196682 -0.0870306759 0.0443428061 0.0314471148 -0.0071411879 0.0464721519 -0.0092608619 -0.0199494426 0.1044798500 -0.0219304415 -0.0138012794 0.0980467661 -0.0301949506 -0.0210034536 -0.0654163482 0.0263968484 0.0255847805 -0.0164124424 -0.1091453285 0.2797445837 -0.1070837117 0.1186847823 -0.1743045294 0.2272502556 0.0486382011 -0.0415556452 0.0058151903 0.0605974068 -0.0315075291 -0.0247235093 -0.0146794598 0.1789401765 -0.0605198269 0.2396271635 0.0046737672 0.0028680486 -0.0303603822 -0.0243277440 -0.0006645889 -0.0621645834 0.3152480726 -0.0120269790 0.1654107437 -0.0144404496 -0.0332642538 -0.0632113390 -0.3194346636 0.0117597116 0.0411823162 -0.0281694222 -0.0028276528 0.0193433757 0.0407999718 0.0309825414 0.0575267921 -0.2518995089 0.1783193822 0.1383590405 0.0844053406 -0.1913586704 -0.2554386187 -0.1658768487 0.0680901485 -0.0293987189 0.0090261736 -0.0289881406 -0.0656234158 -0.0030378130 0.0542536898 0.1105415609 -0.0093820012 -0.0434362411 0.2283181957 0.0050039695 -0.0018928826 0.0069914238 -0.0133597082 0.0121118175 -0.0098503901 -0.0252504032 0.0137497884 -0.0013353374 0.0241615395 -0.0284386462 -0.0255987031 -0.0058902333 0.0013156820 -0.0050118738 0.0213241126 0.0130371420 -0.0321842523 -0.0056860690 -0.0030852937 0.0179170879 0.0018930591 0.0029029826 0.0034422327 -0.0228734141 0.0187119269 0.0284055996 0.0261255513 -0.0279798919 -0.0422165574 0.0040940216 -0.0000228920 0.0032949003 -0.0021654595 -0.0025277432 -0.0030899302 -0.1005808310 0.0090386152 -0.0692648079 0.0512860919 -0.0266597765 0.0205321971 -0.1168534382 0.0324150486 -0.0368023062 -0.1236882109 0.0292174661 -0.1463711640 0.0876894321 0.1658217929 0.2158269668 -0.0549052689 0.0355265031 -0.0393033585 0.1252506894 -0.0802756934 -0.1179248190 -0.1858324434 0.0181405186 0.2400912728 -0.0003096149 -0.0203724108 0.0234454902 0.1661432346 -0.1043943352 -0.0507820723 0.2071030062 -0.1357061903 -0.0541994163 -0.0135768858 -0.0276603079 -0.0121428879 -0.0966562314 0.2540272651 -0.0812120179 0.0322420475 -0.2422028846 0.0673813219 0.0268647282 0.0602220824 -0.0565942367 -0.0907376775 -0.0687853260 0.0226363912 -0.1262596586 -0.1109953490 0.0460563902 -0.2089053513 -0.1767543751 0.0343940691 0.0843309610 0.0007993787 0.0104333891 0.0983945288 -0.0010234871 0.0161459734 0.1734406430 -0.0063869446 0.0644202518 0.0427016369 0.0092451848 -0.0107880751 0.0530590489 0.0060544590 -0.0136122703 0.0708323091 0.0080910724 0.0049735376 -0.0606485050 0.0218009268 0.0121526778 -0.1950470170 0.0570243552 0.0596280102 -0.1341527373 0.0553091842 0.0492517887 0.0234834432 -0.0297258602 -0.0171507127 -0.0179867119 -0.0143637337 -0.0072052232 0.0334551750 -0.0691183693 -0.0904977852 0.0039239921 -0.0344970562 -0.0497504529 -0.0005773546 -0.0022249747 0.0028867481 -0.0024117706 0.0726767405 0.0235937329 0.0320104649 0.0530372195 0.0685175437 0.0465664522 -0.0656493958 -0.0003400420 0.0775359999 -0.0646276039 -0.0921632801 -0.0242022183 0.0118726827 -0.0071356657 0.1263961514 -0.1170739109 -0.1121539235 -0.0755289446 0.0518556101 0.0432482098 -0.0566670313 0.0847742978 0.0313819651 -0.1031236977 0.0515389740 0.1359418579 0.0256186066 0.0193622456 -0.0065057078 -0.0208098979 0.0664632793 -0.0446833193 0.1178186162 -0.0744276555 -0.1673153056 -0.0066096333 -0.0061067656 -0.0116822003 0.0037081726 0.0051748233 -0.0004550908 0.0013563528 -0.0246304868 -0.0190694938 0.0277585262 -0.0106062936 0.0103261645 -0.0527798083 0.0218321744 -0.0062751608 -0.0635883675 0.0093232494 -0.0738360383 0.0409579674 0.0796661994 0.1093669098 -0.0285604931 0.0138034494 -0.0211047503 0.0544147005 -0.0383885632 -0.0548206944 -0.0872704485 0.0087720328 0.1084287479 0.0008955969 -0.0083028017 0.0129399776 0.0876409145 -0.0580182418 -0.0222980753 0.0845783001 -0.0579820174 -0.0252299387 -0.0090844731 -0.0141795674 -0.0075741621 -0.0413913792 0.1179641836 -0.0353092610 0.0145530785 -0.1331510354 0.0373318079 0.0108926292 0.0325744261 -0.0275082238 -0.0442020345 -0.0361833520 0.0123931538 -0.0606091561 -0.0567450150 0.0232706791 -0.1257328414 -0.1071989947 0.0235876548 0.0410874327 -0.0000246549 0.0034625122 0.0375948886 -0.0000624282 0.0015562235 0.0947979967 -0.0032569045 0.0350137084 0.0248645548 0.0053399969 -0.0032638385 0.0347101857 0.0020350467 -0.0051732188 0.0495648215 0.0025400659 0.0129024077 -0.0342563453 0.0104932747 0.0061217180 -0.1101163731 0.0315067759 0.0330002928 -0.0805485719 0.0310357245 0.0282463617 0.0136739895 -0.0155569544 -0.0087839919 -0.0132191013 -0.0068523666 -0.0023518884 0.0196800021 -0.0419054942 -0.0524645240 -0.0011978406 -0.0168902255 -0.0262611987 -0.0011182395 -0.0002816204 0.0032310133 0.0077564295 0.0388919078 0.0097955610 0.0078764259 0.0357653926 0.0192461774 -0.0786115095 0.1617615466 0.0224602302 -0.2888193755 0.2387518257 0.2231797608 -0.0148955566 -0.0401708297 -0.0176453005 -0.2201181859 0.1359025117 0.1768992561 0.1372035982 -0.1336829923 -0.1259811336 0.2439398054 -0.1076794674 -0.2339323576 0.2088928764 -0.1698270977 -0.1604799417 -0.0235148929 -0.0112825362 0.0562197766 -0.1810402751 0.0611891832 0.2974762663 -0.1272546980 0.0083146927 0.1921820937 0.0049363255 -0.0036207353 0.0135018922 -0.0031328968 -0.0172656631 -0.0044857440 -0.0484866074 -0.0183372774 -0.0261344919 0.1001007888 0.0708914426 0.0470539313 0.1033104055 0.1631779906 0.2934380992 -0.0633064381 -0.0669612816 -0.0488916994 0.0261179467 0.0695825182 0.1941789203 -0.0460593324 -0.1013861035 -0.1281535691 -0.1234373387 -0.0915054704 -0.1888322320 0.0415090685 -0.0794696418 -0.3040167936 -0.0587639718 0.0929429309 0.0592961928 -0.0009925827 -0.0923122874 0.1256891098 -0.4389759389 0.2020867797 -0.0064551275 0.0047534406 -0.0735574477 -0.0302894055 0.0800775072 0.0280870585 0.0205543082 0.0278217110 -0.4674662419 0.1620163481 0.0457882169 -0.0001467683 0.0100890566 0.0194678921 0.0106514634 -0.0028237804 -0.0391305220 -0.0316787391 0.0076125558 0.0902638019 0.0645927198 -0.0123415392 -0.0105704864 0.0062419742 0.0098169761 0.0263628006 -0.0060883756 0.0052458297 -0.0883274826 -0.0079417154 -0.0182602466 -0.0165896094 -0.0068408851 -0.0114215727 -0.0401444846 0.0043015301 -0.0005853626 -0.0731436595 0.0155724025 -0.0649666955 0.0221546220 0.0018524756 0.0084439057 0.0911575168 -0.0074216966 -0.0153602545 0.0457958568 -0.0137952443 -0.0194853139 -0.0121202153 0.0027887659 -0.0046504770 0.0384189927 -0.0190924898 -0.0181142166 -0.0204302124 0.0433798958 0.0569054598 0.0221437292 -0.0006765557 0.0174026116 -0.0047761651 0.0291897050 0.0159426553 -0.0177171366 -0.0143315101 -0.0000732010 -0.0117543150 -0.0732337208 0.0726409600 0.0058505648 -0.0006397051 0.0025798068 -0.0127595562 0.0103545403 -0.0010513300 -0.0093510762 -0.0035661076 -0.0057505273 0.0132738683 -0.0221065680 -0.0141933502 -0.0098200946 0.0001636542 -0.0032711712 0.0189872951 0.0194507815 -0.0286304148 -0.0072839673 -0.0073432384 0.0303813042 0.0082831180 0.0061816207 0.0089560263 -0.0391992314 0.0402752308 0.0275792701 0.0228963177 -0.0394163155 -0.0336524284 -0.0062772906 -0.0023135830 -0.0074532232 0.0025597022 0.0004012262 0.0005330423 0.0161643545 -0.0110941481 0.0043636057 -0.0178834528 0.0300987818 -0.0116569428 0.1018707014 0.0097216051 0.0881630711 0.0544851292 -0.0488505108 0.0742224208 -0.0633859128 -0.1004561568 -0.1031942925 0.0276515638 -0.0464262730 0.0164593923 -0.1280270622 0.0523150413 0.0800380355 0.1325830335 -0.0075522582 -0.1674412247 -0.0107133827 0.0383115898 -0.0234955174 -0.0800799365 0.0280058251 0.0354559213 -0.2119024827 0.1280736004 0.0092262942 -0.0047259136 -0.0160268983 0.0314380028 0.0311804586 -0.2645112997 0.0666867099 0.0390587002 -0.0162289270 -0.0005404224 0.0096079798 -0.0013805869 0.0097978283 -0.0281685042 -0.0220464679 -0.0025354351 0.0576115714 0.0331489196 -0.0112935993 -0.0756021005 -0.0478953765 0.0048479280 -0.0010778014 -0.0109888089 -0.0292143612 -0.2340147288 0.0197699951 -0.1365009699 0.0876716536 0.0225221683 -0.0156835267 0.1325259552 0.0229001304 0.0281114760 0.1543582530 0.0090214113 0.0040775288 0.2502379507 -0.0154753787 0.1322203471 -0.1247087068 0.0260140258 0.0714822244 -0.2095111465 0.1446622543 0.1102531834 -0.4449277561 0.1258486258 0.0952186464 0.0303200183 -0.0557946569 -0.0609720994 0.0608021406 -0.1390505954 -0.0780327647 0.0314542132 -0.0922722407 -0.0421154916 0.0355410284 -0.0543374121 -0.0361821017 -0.0032969092 0.0079316022 0.0151252872 0.0231061050 0.0276496014 -0.0391491617 0.0665759595 0.1841318052 -0.2194265613 -0.0069398186 -0.0075537607 -0.0093797230 0.0414823252 -0.0352735070 -0.0059041993 0.0270879560 0.0007144059 0.0097026497 -0.0193762467 0.0393690439 0.0228313006 0.0091399515 0.0078911005 0.0147964339 -0.0383134009 -0.0311817921 0.0557739809 -0.0035955368 0.0245405475 -0.0380200148 -0.0149143562 -0.0069671411 -0.0163101366 0.0660506411 -0.0637670680 -0.0514666487 -0.0347681457 0.0665063655 0.0480005345 0.0131751836 0.0000563936 0.0077114923 -0.0034164537 0.0036979702 -0.0002326338 -0.0213482147 0.0137579015 -0.0134790777 0.0064824362 -0.0177523413 0.0127046928 -0.0619492461 -0.0154875871 -0.0707829361 -0.0133537331 0.0481535097 -0.0241694815 0.0448461310 0.0598910255 0.0457865336 -0.0082546490 0.0299293367 -0.0178358717 0.0883201659 -0.0367305383 -0.0694078123 -0.0707377026 -0.0043929391 0.0735902075 -0.0031912568 -0.0266214066 0.0167573589 0.0176079702 0.0134684238 -0.0236659255 0.1211646428 -0.0710398844 0.0192221030 0.0161221005 0.0208511088 -0.0157670596 -0.0231095592 0.1859457113 -0.0505786291 -0.0219597498 0.0861548968 -0.0217854414 -0.0190613139 -0.0251878033 0.0095309381 0.0895507429 0.0373707282 -0.0565505850 0.0171140285 -0.0911945009 0.0327435693 0.2122209453 0.2693010771 -0.0310681429 -0.0875451487 0.0403081682 0.0050313093 -0.0546290269 -0.0151652742 -0.1302379886 -0.3461560270 -0.0290230952 -0.0693590833 0.0773867633 -0.0264487664 -0.0057388972 0.0688897496 0.0216244641 0.1166354301 0.0486025812 0.0454237372 -0.0860506053 -0.0454475990 0.0601040812 0.0960480897 0.0360735601 0.1060862866 0.0740917448 -0.2090918964 0.0968074796 0.0624920610 -0.0188842798 -0.0642664769 -0.0738285200 0.2029895571 -0.1683067276 -0.1361171105 -0.0499260921 0.0971886608 0.1610384090 0.1664416111 -0.1091081148 -0.0309340343 0.0060687547 -0.0203452928 -0.0392268107 -0.0201706801 -0.0176140922 0.0640324126 -0.1268133483 -0.2910741872 0.3641411833 0.0093373065 0.0043624529 0.0117924839 -0.0391468677 0.0345323749 -0.0025317886 -0.0351286007 0.0052556338 -0.0088566622 0.0302213504 -0.0478547746 -0.0326779999 -0.0138055872 -0.0037449663 -0.0174563012 0.0405646471 0.0417039850 -0.0642629274 0.0052916984 -0.0249490147 0.0410536509 0.0181681249 0.0054537973 0.0199449337 -0.0682123707 0.0674277290 0.0511844608 0.0355265708 -0.0825328583 -0.0507687284 -0.0170238937 0.0019887807 -0.0111758820 0.0034099950 -0.0053104993 0.0010254615 0.0284254494 -0.0079753311 0.0211827581 0.0339751403 -0.0086999994 0.0079275252 -0.0504986535 0.0336545162 0.0125291862 -0.0637263163 -0.0009037346 -0.0775492831 0.0371000024 0.0728095309 0.1133473777 -0.0358680034 0.0128690905 -0.0250017365 0.0514103135 -0.0419352844 -0.0601326153 -0.0905941719 -0.0092327614 0.0673028380 0.0131668665 -0.0064623809 0.0311273896 0.0656873871 -0.0555149643 0.0210199298 0.0473163846 -0.0419727094 -0.0194799935 -0.0016337237 -0.0047823901 -0.0378141684 0.0375885212 0.1441606861 -0.0155536434 -0.0636671255 -0.0394053620 0.0253784857 -0.0045321497 0.0017086446 0.0130834137 0.0443697824 0.0034831990 0.0026987787 0.0164740523 -0.0096167939 -0.0010973987 -0.0657487840 -0.0856576617 0.0209092020 -0.0328060836 0.0352096419 -0.0371670602 0.0843003331 -0.0019955995 -0.0445317098 -0.1360796744 -0.0152783159 -0.0436413806 -0.0021512679 -0.0267803917 0.0399187379 0.1184414533 -0.0178132157 0.1654159528 0.0552255013 0.0094899153 0.0426272139 -0.0092276426 0.0248673833 -0.0237047779 -0.1008076415 -0.0442520702 0.0024581599 0.0861729982 0.0214281064 0.0519036482 0.0041923549 -0.0182860154 0.0142317053 -0.0280657464 0.0672816023 0.0290738829 0.0069340714 0.0193882068 -0.0358923754 0.0284704683 -0.0487225676 -0.0699220356 -0.0009236089 0.0042711760 -0.0019713516 0.0104081767 -0.0089214646 0.0103228293 -0.0924155972 -0.0506839155 0.0301238827 -0.0410100418 -0.0238869622 -0.0279317494 0.1632442658 -0.1346495445 -0.0353869421 0.0814329022 0.0464830996 0.0556126772 -0.0741113862 0.1776745847 0.0852560116 0.0640244966 0.0390572779 0.0375709290 -0.1175860494 -0.1543445233 0.1771151339 0.0281723388 0.1111495381 -0.2468770281 -0.0894257151 -0.0422216550 -0.0490111669 0.2601732955 -0.2997327499 -0.1486417795 -0.1577608887 0.3070111324 0.2284715221 0.0857143487 -0.0064318558 0.0396835582 -0.0190584443 0.0150358209 -0.0035934958 -0.2766590371 0.0833714798 -0.1931100594 -0.0020236602 0.0137868513 -0.0607635833 0.0532275964 0.0630778282 0.1552747279 -0.0971981764 -0.1616860614 -0.0889444472 -0.1145736810 -0.1093821058 -0.0193242099 -0.0465008842 -0.0424173746 0.1153105090 -0.2420200290 0.1616894335 0.3896386128 0.0765136594 0.1287914699 0.1103688912 0.1505901748 0.0402246852 -0.0541183045 0.4297059680 -0.3546949399 -0.0213191179 -0.0947269948 0.0488938980 -0.2319414925 -0.1278311019 0.0222036890 -0.0445437850 -0.0355111397 0.0076394262 0.0198466565 -0.0725944526 -0.2057936626 0.0332015182 0.0652831982 -0.0058537765 0.0080650433 0.0370595359 -0.0103184961 0.0007572402 -0.0175414851 -0.0477369393 0.0087364780 -0.0171107496 -0.0412853223 0.0119037562 -0.0244237397 0.0363940439 -0.0283580936 0.0944974768 -0.0028290421 -0.0419301555 -0.1404450209 -0.0214628464 -0.0350347160 -0.0066268896 -0.0275533368 0.0292067055 0.0788504995 -0.0115237531 0.1438443725 0.0238908459 0.0146858977 0.0102041093 -0.0019408050 0.0231633583 -0.0182214118 -0.0578744482 -0.0407954286 -0.0034615936 0.0839608617 0.0176364690 0.0417232841 0.0002805289 -0.0153561523 0.0109005127 -0.0139345190 0.0498331595 0.0198904186 0.0003403393 0.0306572094 -0.0148751321 0.0293090370 -0.0426246261 -0.0572721803 -0.0098174195 0.0026620644 -0.0047964788 -0.0286725685 0.0087284191 0.0042118392 -0.0017085276 -0.0489036855 0.0810913923 0.0081555049 0.0045276027 0.0032077076 -0.0297430036 0.0236808065 0.0101167185 -0.0094461080 -0.0152676215 -0.0122563900 0.0093186362 -0.0315193858 -0.0113253385 -0.0139647732 -0.0097612604 -0.0036169306 0.0173182026 0.0292972767 -0.0259523356 -0.0136293960 -0.0204638697 0.0530935849 0.0192566727 0.0094647020 0.0061263233 -0.0404231509 0.0554204110 0.0136362567 0.0272378811 -0.0578721996 -0.0417118505 -0.0193260881 0.0032147785 -0.0072764677 0.0043466205 -0.0026774584 0.0006047121 0.0502220678 -0.0178900030 0.0350127299 0.0059108551 0.0004130661 -0.0176447461 0.0020277670 0.0244384861 0.0456153605 -0.0436644273 -0.0485686531 -0.0449206996 -0.0262677197 -0.0170259699 0.0179905945 -0.0227987193 -0.0078082679 0.0314240191 -0.0573087497 0.0420480151 0.1136138630 0.0008929945 0.0403023420 0.0553122449 0.0551909963 0.0084122212 -0.0084766381 0.1550024663 -0.1234950882 -0.0034150103 -0.0149725593 0.0026967060 -0.0787442593 -0.0404266576 0.0127293848 -0.0235217957 -0.0053224719 0.0589469301 -0.0016237690 -0.0487608475 -0.0241814482 0.0015424321 0.0066189311 -0.0199224727 0.0190099858 -0.0656941907 0.0067153541 -0.0416216187 -0.0394312424 -0.0879357046 0.0690008928 0.0791512866 0.2116363904 -0.0278002466 0.0396430993 -0.0660840316 0.1167241799 -0.1205098227 -0.0170183654 0.1260395346 0.2012954260 0.0016360276 0.1388656534 0.0057273758 0.0472410150 -0.1209200327 -0.2747186931 0.0485752251 -0.3509771588 -0.1467030128 0.0122732886 -0.1826307990 0.0341598204 -0.0396732485 0.0855446354 0.2722233236 0.1367363473 0.0174107564 -0.1950593855 -0.0403439115 -0.1230536274 -0.0256388623 0.0287430701 -0.0537327298 0.1391683934 -0.2014974695 -0.1116661848 -0.0452937049 0.0107195733 0.1574749121 -0.0028657986 0.0819738403 0.1628080880 0.0009100419 -0.0034957133 -0.0140734806 0.0297931301 0.0250455801 0.0354379039 -0.0471261075 -0.0020955071 0.0479844033 -0.0196619951 -0.0178177774 -0.0033894362 0.0850922520 -0.0659306919 -0.0443731711 0.0089826171 0.0561937330 0.0367068425 -0.0048839476 0.0723690480 0.0111729491 0.0301339080 0.0351710788 0.0023394054 -0.0265558034 -0.0601662167 0.0342610813 0.0333594243 0.0614843671 -0.1479295192 -0.0460006497 -0.0294913102 -0.0034679248 0.0854456665 -0.1303668890 -0.0225874526 -0.0678244752 0.1239839940 0.1084351403 0.0446974242 -0.0061296522 0.0093826694 -0.0098191536 0.0073402961 -0.0002174375 -0.1308830762 0.0389749111 -0.1002363203 0.0214871835 -0.0072427029 0.0012190932 -0.0323742953 0.0222834185 0.0119654588 -0.0430336738 -0.0075451747 -0.0536385172 0.0199157860 0.0424556444 0.0720764516 -0.0273837324 0.0091643217 -0.0095910957 0.0261734590 -0.0176700749 -0.0137298735 -0.0586521327 -0.0078736054 0.0366666902 0.0230209212 -0.0050533822 0.0220884358 0.0510444612 -0.0440470286 0.0240377547 0.0312982824 -0.0304116775 -0.0272044774 -0.0060004833 0.0094971472 -0.0346582733 0.0410422379 0.0928913320 -0.0038438050 -0.0690412425 0.0344425073 -0.0022077272 -0.0127491310 -0.0194762882 0.0180315529 -0.0074886460 0.0387703294 -0.0047532707 0.0939354605 0.1204838646 -0.0306779515 0.0485759005 0.0693290544 -0.0155083243 -0.0023105781 -0.0246999269 0.0069169389 -0.0813582745 0.0054389066 0.0241549517 0.0637385987 0.0251830703 -0.0045026267 0.0121001160 0.0227233722 -0.0078025587 -0.0143973398 0.0061849060 -0.0759612872 0.0093298917 -0.0200540099 0.0293700484 -0.0072733719 -0.0183575831 0.0118151489 0.0228857398 0.0289132035 0.0050899408 -0.0770453170 -0.0088286105 -0.0213733896 0.0042209164 0.0096159687 -0.0071693282 -0.0003999742 -0.0342440046 -0.0101767952 0.0054856386 -0.0313592078 0.0026498688 -0.0267734237 0.0300477621 0.0349899319 0.0019419662 0.0105678455 0.0073437002 0.0036358421 -0.0519715329 0.0008695601 0.0162473905 -0.0160558305 -0.0402877925 0.0107597758 0.0705212847 -0.0725016462 -0.1453023163 0.0791352771 0.2607089991 0.2132927132 -0.2926479679 -0.1054695707 -0.2325105816 0.0345413950 0.2123591375 -0.0041171875 -0.1628661803 0.1175531599 -0.1367328260 -0.0845564989 0.2954623686 -0.2068379794 -0.0953588066 0.3413198968 0.0481404207 0.1110603656 -0.1437199031 0.1224473563 0.0702206879 -0.2237219861 0.0975811075 0.0604418748 -0.2217625356 -0.0335221456 0.0177685362 0.0835071411 0.0082216951 -0.0097669152 -0.0223207530 -0.1679799180 -0.0375473980 -0.0464428553 -0.0403701143 0.0146955210 -0.0021768245 0.0691845969 -0.0416331823 -0.0144779069 0.0837580122 0.0135675446 0.1041101590 -0.0362905357 -0.0772911031 -0.1361091809 0.0528407680 -0.0190687620 0.0144130524 -0.0468194941 0.0288731658 0.0174475353 0.1149793246 0.0179115491 -0.0720042490 -0.0479770229 0.0109145122 -0.0395309549 -0.1063125386 0.0889403169 -0.0411370973 -0.0690060882 0.0647189720 0.0620002719 0.0127569189 -0.0204188578 0.0762573635 -0.0759741224 -0.2239758116 0.0210898276 0.1367286670 -0.0258890347 -0.0108366440 0.0216655545 0.0377970162 -0.0317047159 0.0171708615 -0.1130397155 -0.0259916095 -0.2424326364 -0.4442354980 0.1640712572 -0.1575840440 -0.1342624570 0.0384578616 0.0008237719 0.0610865488 0.0451428855 0.2387819093 -0.0351256979 -0.0205401069 -0.1558801727 -0.0970782285 0.1096669601 -0.0334325820 -0.0630267754 -0.0430028490 -0.0873994812 0.0069666153 0.1067996563 -0.0750783525 0.0864153902 -0.2041049629 0.0441682874 0.0543410088 0.0157603101 0.0540236407 -0.0127570736 0.0075152465 0.1613562590 0.0216834502 0.0189536763 -0.0339991501 -0.0274820880 -0.0113315945 0.1018528951 0.0006794898 -0.0392425182 -0.0533291674 0.1368056967 0.0967944862 0.1214506406 -0.0814060331 -0.0452262565 0.0000756340 -0.0331645310 -0.0341262627 0.0135836889 0.1657787044 0.0234456987 -0.0065564976 0.0621147962 0.1511015295 -0.0024870967 0.0181990833 -0.0262811678 -0.0223438852 0.0056665895 0.0751460933 0.0768521639 -0.0834237722 -0.0247355167 -0.0809664807 0.0355776552 0.0763044026 0.0078690239 -0.0433448816 0.0409171875 -0.0521099247 -0.0507226139 0.1072601355 -0.0564594027 -0.0155388660 0.0769718017 0.0014775742 0.0276891026 -0.0497555063 0.0626361559 -0.0142668956 -0.0765418399 0.0248307272 0.0727713006 -0.0489852958 0.0058129136 0.0010706796 0.0362380487 -0.0023926610 -0.0013696063 -0.0099754521 -0.1221056059 -0.0094968127 -0.0665280190 0.0546058019 -0.0114290683 -0.0079714082 -0.0456650876 0.0670448521 0.0765193499 -0.0862548745 -0.0474092136 -0.1164905947 0.0282129569 0.0800926704 0.1695345942 -0.0694566229 0.0088063225 -0.0146383482 0.0204806564 -0.0447401290 -0.0408446326 -0.1198378482 -0.0752856685 -0.0339526612 0.0587332478 0.0011574091 0.0535549141 -0.0992632013 0.0096870006 0.1657300519 0.0300010362 -0.0392251137 -0.0609189082 -0.0015081966 0.0114635807 -0.0435924040 0.1763931532 -0.1287497172 0.0877778250 -0.2092375032 0.3868039077 -0.0900270942 -0.0413220658 -0.0596245603 0.0493652137 0.0126041867 -0.0481158420 -0.0295104761 0.1250495403 -0.0423510862 0.0254995500 -0.1151763414 -0.0269110804 0.0242578432 -0.0251517833 0.0404448407 0.0275061152 0.0421883286 -0.0141618195 -0.0651661865 0.0817389356 -0.0695570748 0.1847303858 -0.0157538997 -0.0629090453 -0.0335405899 -0.1524159251 0.0061831332 0.0480749884 0.1277465418 0.0689159296 -0.0694177323 0.0369157944 0.0604566762 0.0158029548 -0.0099394249 0.0060111009 0.0281731388 0.0719967417 0.0643854556 0.0577447960 -0.0352859275 -0.0342667120 -0.0082021585 0.1006129299 0.0142661824 -0.0336189245 -0.0492122447 0.1250219835 0.0543253897 0.1232272595 -0.0942765197 -0.0608481818 0.0029874648 0.0212445265 0.0176491848 0.0029637018 0.0168777994 -0.0295755510 0.1702057214 0.3581163696 -0.4047980786 0.0074053401 0.0003781228 0.0105945276 -0.0195122435 0.0200997185 -0.0113481680 -0.0291367237 0.0073867698 -0.0042967937 0.0267257031 -0.0340704294 -0.0257923754 -0.0124891710 0.0011256675 -0.0155065344 0.0049913774 0.0423926018 -0.0223656016 0.0127024164 -0.0202291537 0.0230845469 0.0152043982 -0.0029757432 0.0099376872 -0.0199719770 0.0260030456 0.0050359039 -0.0146322602 -0.0400410853 0.0217728151 -0.0154066917 0.0064023465 -0.0108895301 0.0012326022 -0.0049412580 0.0023202391 0.0937061000 -0.0043765952 0.0681980928 -0.0446073698 -0.0009157117 0.0123283945 0.0231105938 -0.0692975370 -0.0882053769 0.0670545578 0.0567090206 0.0891168243 0.0016501270 -0.0359450981 -0.1242753530 0.0581901395 0.0098674181 -0.0014522199 0.0293438501 0.0405003775 0.0367969932 0.0523917612 0.0469968161 0.0736331285 -0.0446444539 -0.0127627462 -0.0303571249 0.1573055329 -0.0429112373 -0.1633248262 -0.0540700695 0.0421927610 0.0813371606 0.0050874806 -0.0001922631 0.0002458196 -0.1113181303 0.2811979274 -0.0924478277 0.1461709645 -0.3663039832 0.0917758331 0.0085404886 0.0040103395 -0.0060783410 -0.0057211354 0.0138604546 0.0066577831 0.3381082223 0.2938600554 -0.0856991375 -0.1327162407 -0.0365444178 0.0412627772 -0.0270355158 0.0232771218 0.0194788519 -0.0450779087 -0.0014598147 -0.0587349979 0.2490960152 -0.0558207355 0.2407166030 -0.0211994303 -0.0648614785 -0.0369731207 -0.2366298721 0.0100661324 -0.0021950401 0.2362748102 0.0580401058 0.0023481419 0.0473944451 0.0679226803 0.0134485323 -0.0278936701 0.0100265757 0.0349599299 0.0471591827 0.0902650180 0.0798344062 -0.0424777243 -0.0380947913 -0.0039527177 0.1154426035 0.0290768951 -0.0319735636 -0.0546005162 0.1357044729 0.0356000895 0.1375050745 -0.1080977244 -0.0713460004 -0.0016595066 0.0209650261 0.0222862047 -0.0143560810 -0.0665007996 -0.0017889662 0.0387898720 0.0286188288 -0.1017337874 -0.0019418303 -0.0005273109 -0.0022298799 0.0058325710 -0.0056915839 0.0014228377 0.0059286571 0.0001640647 0.0018121008 -0.0053572291 0.0075185687 0.0048009062 0.0036539248 0.0006141122 0.0036968165 -0.0000504257 -0.0090071052 0.0040760320 -0.0060816957 0.0095625240 -0.0142994633 -0.0055849002 0.0018888044 -0.0010852705 0.0069896070 -0.0090200859 0.0065121627 -0.0072320469 -0.0058783887 -0.0020630949 0.0042415329 -0.0044593188 -0.0001337324 0.0010975290 0.0047266380 0.0004304131 -0.0101786579 -0.0060166065 -0.0145215479 0.0326171420 0.0274843414 -0.0236582104 0.0265479137 0.0833179347 0.1259260544 -0.0472887963 -0.0945496620 -0.0538670504 -0.0624282829 -0.0399969222 0.0629745223 -0.0461510951 -0.0414735955 0.0292420514 -0.0996999048 -0.0748294485 -0.1048166212 0.0364887569 0.0225540223 -0.0598443307 0.0173162981 0.0218571272 0.0018009847 -0.2224987466 0.0814372581 0.1458689926 0.2177296174 -0.1225192762 -0.1422527085 -0.0026802956 -0.0043592030 0.0295617690 0.0166778103 -0.2887928010 0.0537157062 -0.0420558455 0.1883089618 -0.0450111460 0.0328136420 0.0838249796 -0.0572939306 -0.0359150343 0.0339870276 0.0395920816 0.0635350635 0.2031803252 -0.0719557895 0.0101105452 -0.0162979248 0.0066243084 0.0250927734 -0.0175771920 -0.0055727047 -0.2074054134 0.0212714283 -0.0797415312 0.1906632144 -0.0027219533 0.0711096828 -0.0120284713 -0.0323221747 0.0051887112 -0.2293471353 -0.0021649832 -0.0888393113 0.1512117223 0.0343447810 0.0390206016 0.0258583165 0.0495201532 -0.0217061819 0.0010928199 -0.0655617702 -0.0222867225 -0.0253571023 0.1073260692 0.1108832287 -0.0203262358 -0.0337490844 0.0214258492 0.0372662227 0.0897000221 0.0214749964 -0.0209718235 0.0922122613 -0.0389908828 0.0743612770 -0.0913067771 -0.0918023360 -0.0029985581 -0.0418415333 -0.0267918106 0.0096729152 -0.0163330348 0.0031274797 -0.1443583883 -0.3085822683 0.3238358369 -0.0229802946 -0.0098572315 -0.0166647798 0.0596080606 -0.0589677056 0.0009001513 0.0480803509 0.0194844624 0.0273641583 -0.0343829928 0.0807709899 0.0313406468 0.0297597255 0.0119236764 0.0202150032 0.0490755761 -0.0890729417 -0.0287818087 -0.0579909128 0.0665410707 -0.0022821233 -0.0116208575 -0.0004523479 0.0002117203 -0.0572205409 0.0156684482 0.1010354728 0.0913696990 -0.0192768038 -0.1257853160 -0.0030941196 -0.0012167283 -0.0022896518 0.0010646970 -0.0003115999 -0.0002825140 -0.0104256506 -0.0109174623 -0.0121300687 -0.0112383425 -0.0056859988 0.0054431994 0.0007847471 -0.0231298352 -0.0289061320 0.0166115499 0.0246768178 0.0199766706 0.0144452180 0.0078142502 -0.0245148759 0.0147881818 0.0093473130 -0.0084495323 0.0232098892 0.0218425119 0.0291504136 -0.0064926453 0.0049506629 0.0340454255 -0.0028256129 -0.0029439853 -0.0009551934 0.0811759869 -0.0353285238 -0.0445399117 -0.0783152631 0.0445336866 0.0378206958 0.0013708149 -0.0036080479 -0.0088539245 -0.0130179180 0.1347946573 -0.0248164866 0.0036524697 -0.0233888629 0.0005466015 -0.0161281870 -0.0446801537 0.0308061941 -0.0462240897 0.0009106397 -0.0076120354 -0.2784928325 -0.1899525693 0.0595323546 0.3464865580 0.2534142076 -0.0848936240 0.0786892708 -0.0220426647 -0.0076986483 -0.3820870241 0.0302113990 -0.2310401671 -0.0390408813 0.0326305330 -0.1264975807 0.0093243091 -0.0247438431 0.0512843746 -0.2615438477 -0.0049850758 -0.1201385508 -0.0377036843 0.0308068168 -0.0307417162 0.0023097134 0.0551185929 -0.0687127602 0.0889560912 -0.2119665103 -0.1196312983 -0.1054554865 0.1697167080 0.1950446862 -0.0004777749 -0.0485966863 0.0578008952 -0.0493587818 0.1973841503 0.0939792343 0.0070232465 0.0898706466 -0.1077720803 0.0458052823 -0.1236817868 -0.1688197908 0.0030440400 0.0139255579 0.0038774739 0.0183830299 0.0264458659 0.0107011835 0.0155763648 0.0719468117 -0.0478232304 0.0159295069 0.0086759320 0.0091235208 -0.0414538008 0.0409040651 0.0051819578 -0.0266974110 -0.0199865780 -0.0212910056 0.0172040748 -0.0536647875 -0.0155700290 -0.0191292906 -0.0098735019 -0.0098367966 -0.0374300740 0.0539023876 0.0281164813 0.0508135145 -0.0490839488 -0.0150840346 0.0016020745 0.0015697833 -0.0009181320 0.0488930717 -0.0199243191 -0.0848658625 -0.0512897842 0.0340734544 0.0758820054 0.0103381211 -0.0001214523 0.0050776468 -0.0027304781 -0.0008784455 -0.0006665457 -0.0324918753 0.0216788339 -0.0143604158 -0.0072755803 -0.0234634329 0.0150592680 -0.0426661871 -0.0386409520 -0.0745322323 0.0084312268 0.0572439578 0.0034732847 0.0492505707 0.0422235108 -0.0008330036 0.0126327480 0.0294856083 -0.0175708942 0.0644144582 0.0497515178 0.0863796452 -0.0377669664 -0.0468315583 -0.0240822562 0.0022682769 -0.0130219756 0.0060415734 0.0957965581 -0.0365341407 -0.0494734857 -0.1290106035 0.0699416928 0.0762718731 -0.0089877819 0.0134214550 -0.0132958441 0.0212156522 -0.0123336716 0.0099976690 -0.0061063658 -0.0327050916 0.0086359518 -0.0067572545 -0.0317875142 0.0133139558 0.0000093846 -0.0121976248 -0.0116579339 -0.0573382744 -0.0750273007 0.0196529174 0.0803651882 0.0769438212 -0.0163312512 0.0084478951 0.0042129574 -0.0011526636 -0.0212022277 0.0007290454 -0.0365761674 -0.0560937481 0.0051589904 -0.0386539440 0.0047904596 -0.0002437585 0.0094982501 0.0037498309 0.0004412761 0.0097963742 -0.0443813785 -0.0026803536 -0.0175094610 -0.0061712567 0.0008192439 -0.0087738398 0.0145472112 -0.0274100844 -0.0180182985 -0.0062185655 0.0073185889 0.0124470149 0.0045154313 -0.0021031396 0.0062849438 -0.0187404877 0.0183634144 0.0134860514 0.0060987065 -0.0033091018 -0.0112659793 -0.0063360759 -0.0046383927 -0.0137040356 0.0014261138 0.0118312521 0.0074280960 -0.0087471332 0.0071788786 0.0032327549 0.0666086155 0.1021770751 -0.0934408660 -0.0764664777 -0.0362918400 -0.0472494010 0.1884962290 -0.1899154572 -0.0071690041 0.1360288336 0.0864693329 0.0980066701 -0.0976150576 0.2598396119 0.0890972925 0.1006107950 0.0353278329 0.0537559180 0.1589113999 -0.2625286164 -0.0944618070 -0.2541106649 0.2395084062 0.0476623231 -0.0160793053 -0.0042963100 -0.0048522429 -0.2254116192 0.0874574227 0.3669086968 0.2701711676 -0.0808440268 -0.3691035750 -0.0287917825 0.0015546881 -0.0171816678 0.0036279936 -0.0056408786 0.0018619157 0.0682965989 -0.0144814962 0.0491188144 0.0103442812 -0.0772169374 0.0442651124 -0.1917846668 -0.0727775610 -0.2081772352 -0.0282019901 0.1566051703 -0.0608189344 0.1497057701 0.1354912453 0.0737306389 0.0003501860 0.0859472407 -0.0388894035 0.1753247495 0.1458400090 0.2942011870 -0.1089453972 -0.2013335103 -0.2532312446 0.0208152401 -0.0272340659 0.0189609837 0.1385577722 -0.0573732236 -0.0474522385 -0.3293557733 0.1814066808 0.1821862059 -0.0421316400 0.0328445724 -0.0157717762 0.1176803747 -0.4677945244 0.1168618609 -0.0631142746 -0.0326556951 0.0289926766 0.0409947036 0.0352556194 -0.0154150286 -0.0063559532 0.0138153277 0.0164790934 0.0232113060 0.0699161348 -0.0220438257 -0.0479459331 -0.0582134385 0.0115024181 0.0000409567 -0.0088893507 -0.0022957071 -0.0254246253 0.0037653368 0.0144057824 0.0691176165 -0.0020810086 0.0300218687 -0.0050665026 -0.0030106140 -0.0047372573 -0.0480489957 0.0031711731 -0.0226927056 0.0522769760 -0.0032110950 0.0291565286 0.0088581783 0.0073680730 -0.0007932193 -0.0023505367 -0.0012070433 0.0021880217 -0.0148817766 0.0203700092 0.0179931931 -0.0063645392 -0.0045906929 0.0022384054 0.0157582376 0.0103510350 -0.0009141084 -0.0065012281 0.0130101426 -0.0046555655 0.0192733220 -0.0154231030 -0.0104350720 -0.0057977690 -0.0234889185 -0.0180182580 0.0027727487 0.0032208498 -0.0066155451 -0.0791770129 -0.1453617708 0.1532031026 0.0144071209 0.0068487254 0.0072657337 -0.0323277538 0.0334499813 0.0020182417 -0.0210884488 -0.0203262101 -0.0195698537 0.0161580826 -0.0471862643 -0.0150508266 -0.0212109645 -0.0045663257 -0.0078915949 -0.0222376745 0.0426165678 0.0078533974 0.0588914232 -0.0497016090 -0.0116501647 0.0015148469 0.0009184193 0.0035436025 0.0427460402 -0.0165889489 -0.0714458875 -0.0416337857 0.0119068119 0.0576074574 0.0050602943 -0.0014609048 0.0024950090 0.0002653424 0.0022899419 -0.0004184343 -0.0139868499 -0.0057009918 -0.0149776735 0.0017000574 -0.0013883333 0.0001494218 -0.0028968045 0.0004697171 0.0000561768 -0.0039334069 -0.0005830463 -0.0049647516 0.0024763716 0.0029904892 0.0052128442 -0.0017190182 -0.0003339859 0.0015363301 -0.0079607187 0.0066932658 0.0124829939 -0.0037533309 -0.0138294711 -0.0165205938 0.0020640168 0.0001315307 -0.0020947788 -0.0179108267 0.0115719738 0.0055055880 0.0133568935 -0.0080385063 -0.0107410348 -0.0008975105 0.0035921261 0.0008435949 -0.0004983380 0.0064644604 0.0011748430 0.0103786928 -0.0042237344 -0.0025475586 -0.0004271076 -0.0050843538 -0.0018793415 -0.0082654783 -0.0094922674 0.0005106486 0.0005184681 0.0047356700 -0.0082639171 0.0613056907 0.0602230078 -0.0070774921 0.0047985812 0.0094882104 -0.0039177832 -0.0221007522 0.0039418338 -0.0413859777 0.0130629184 -0.0068577697 0.0150860526 -0.0034039253 -0.0096728163 0.0021758857 0.0269975888 -0.0034244143 0.0475556268 -0.0033401174 0.0011470947 -0.0077182373 -0.0029095752 -0.0020636210 0.0043947096 -0.0457748362 0.0262397965 0.0215283291 0.0678956566 -0.0353136021 -0.0339556310 0.0007617493 0.0075257475 -0.0073464919 0.0042169602 -0.0272438189 -0.0120369674 0.0008848922 -0.0158215281 0.0090466101 -0.0055681884 0.0162419061 0.0179432293 0.0003834696 0.0022966378 0.0013734796 -0.0046351521 0.0007415551 0.0065889713 0.0104061343 0.0345626636 -0.0304027364 0.0303596466 0.0522902634 -0.0228999321 -0.0310909669 0.0526434868 0.1056131845 0.1026208545 -0.1827757134 -0.0776799240 -0.0341270419 -0.1369920992 0.0020433488 -0.0363245804 -0.0056188526 0.0881870182 0.0227450865 -0.0426743600 0.0150657914 0.4147420680 -0.1358813357 -0.5555017293 -0.0871270058 0.0099942968 0.0641215337 0.0887285107 -0.0980231369 -0.0926390266 0.3285263107 -0.0676948808 -0.4588360886 0.0208157043 -0.0101093851 -0.0500309560 -0.0036805101 0.0027618626 0.0085426566 0.0769947386 -0.0051045320 -0.0119999202 -0.0008919186 -0.0008437214 0.0004257983 -0.0012041812 -0.0012838347 -0.0017876283 0.0017757456 0.0036178026 0.0015072360 0.0017365770 0.0013898514 -0.0015724608 0.0010025862 0.0011997229 -0.0015728413 0.0044061947 0.0026233222 0.0053916811 -0.0005397661 0.0033568058 0.0053642735 0.0015707222 0.0014052843 0.0003784130 0.0167696701 -0.0135363843 -0.0012270386 -0.0225392642 0.0146826416 0.0094262874 -0.0009125939 -0.0043336755 0.0002027316 -0.0019608672 0.0093085333 -0.0012613212 -0.0106777698 0.0227277437 -0.0073446661 -0.0014188783 -0.0060831810 0.0043761736 -0.0362105574 0.0028817737 0.0221854758 -0.1615524061 -0.0433556398 0.0039297121 0.2733717503 0.1609790043 -0.0523962394 0.0436134040 0.0163009604 -0.0326122251 -0.2811330041 0.0329202935 -0.2372975628 0.1831005400 -0.0205775685 0.0752816821 -0.0379521643 -0.0608292523 0.0174650619 0.0301858850 -0.0258994074 0.1932221632 0.1324769276 0.0027388100 0.0582878964 0.0058270063 -0.0018091534 0.0271876815 -0.3880616730 0.2132654123 0.1799398091 0.4512518232 -0.2071577722 -0.2026123930 -0.0089914418 0.0445817575 -0.0519116205 0.0711506969 -0.1749952142 -0.0944617087 -0.0106389217 -0.0784829481 0.0648006963 -0.0032565072 0.0914302662 0.1220234839 0.0006272904 -0.0000855688 -0.0020416094 0.0120438260 0.0099566123 0.0040578427 -0.0218638910 -0.0207710466 0.0337260711 -0.0033960565 -0.0061836007 0.0025226650 0.0015262037 -0.0050932585 -0.0116552251 -0.0133403281 0.0223719484 0.0087897346 0.0025895704 0.0175113443 0.0017734172 0.0044975653 -0.0008459289 -0.0113879151 -0.0033256177 0.0061665284 -0.0009536108 -0.0541665286 0.0157663198 0.0733320357 0.0102479240 -0.0003869609 -0.0081848159 -0.0081688692 0.0126387154 -0.0019199728 -0.0409847935 0.0215372560 0.0625468861 0.0014910317 0.0009956309 0.0068855143 -0.0011828897 -0.0023365770 -0.0008603860 -0.0252381151 0.0221143710 -0.0008734989 0.0325949267 -0.0439270970 0.0179055305 -0.1281476448 -0.0012580978 -0.0628533659 -0.0639806683 0.0459169366 -0.0905098125 0.0695488357 0.0648250317 0.1031780212 -0.0304737647 -0.0021653632 0.0218990099 -0.1031273031 0.1854158059 0.4031727202 -0.0090951010 -0.2516006011 -0.4524804104 0.0209148103 0.0272251822 -0.0598596925 -0.3028216953 0.1993737785 0.0710026328 0.1520417296 -0.0797532045 -0.1978091581 0.0156656715 -0.0166091346 0.0409518174 -0.1535925377 0.2991117352 -0.0917513238 0.1385559357 -0.0928815302 -0.0033073229 -0.0057403222 -0.0007795015 -0.0083205061 -0.0121675867 -0.0151337409 -0.0059152094 0.0825488110 0.0577473591 -0.0251446098 0.0117400137 0.0684107944 0.0103220073 0.0082511990 0.0263127930 0.0159125402 -0.0627799202 0.0067948050 -0.0961554472 -0.0052703745 -0.0259714693 0.0590358405 0.0104763608 -0.0122309660 -0.0037485527 0.0881421356 0.0010956612 0.0986084442 -0.1486201902 0.0115140940 -0.1195223991 -0.0129107950 -0.0061482016 -0.0033604787 0.0490281209 -0.0419964865 -0.0279640541 -0.0042399958 -0.0143365454 -0.0150665371 0.0081020735 0.0030349282 0.0056813296 -0.0283109058 0.0043375767 0.0140601383 0.0104692632 -0.0151298851 -0.0135850888 -0.0207292768 0.0068904995 -0.0086615857 0.0008230339 0.0070501945 0.0066104487 -0.0022962038 -0.0078454064 0.0098815107 0.0210281350 0.0330053329 -0.0313271579 -0.0011595774 -0.0027689536 0.0015578228 -0.0013877239 -0.0008200050 -0.0048166437 -0.0075264898 0.0121019808 0.0043338254 0.0012413581 0.0081234109 0.0016953269 0.0048245405 -0.0008952776 -0.0049340183 -0.0123243791 0.0056195111 0.0146285661 -0.0251880857 0.0112123765 0.0201162592 0.0010636650 0.0007145050 -0.0054301498 0.0012266772 -0.0030012240 0.0111986486 -0.0234753196 0.0034062944 0.0257249567 0.0022830309 -0.0038310935 0.0063921867 0.0008591126 0.0036613588 -0.0016708282 -0.0211130716 -0.0127149616 -0.0152095922 0.0072224399 -0.0150381654 0.0066088205 -0.0366867431 -0.0043782761 -0.0194307578 -0.0109919958 0.0222890334 -0.0193342499 0.0265766260 0.0273485017 0.0307698186 -0.0072875382 -0.0027465454 0.0005248616 -0.0349538219 0.0737102933 0.1578994536 -0.0036687272 -0.0705797453 -0.1251180394 0.0110880632 0.0138058112 -0.0206174105 -0.0866543295 0.0594757878 0.0216691500 0.0044683022 -0.0028318512 -0.0679650497 0.0108662680 -0.0238996198 0.0157135055 -0.0709916600 0.2065530464 -0.0509602791 0.0307891927 0.0299188383 -0.0256450595 -0.0125290815 -0.0243708493 0.0086566217 0.0392442812 0.0384956229 0.0095007338 -0.2558769984 -0.2168231624 0.0950692946 0.0326933814 -0.1557789472 -0.0456845979 -0.0243082347 -0.0713658799 -0.0505223019 0.2083335898 -0.0224593991 0.2762863962 -0.0080360003 0.0772441689 -0.1857947359 -0.0353038360 0.0354494583 0.0099136606 -0.2575539559 0.0043415003 -0.2627526082 0.4375744066 -0.0528997533 0.3709655489 0.0432418239 0.0169528334 0.0083541762 -0.1557380638 0.1297582298 0.0869017833 0.0062102544 0.0464085623 0.0487626617 -0.0245468638 -0.0093541592 -0.0174588892 0.0816383019 -0.0106305976 -0.0414485422 -0.0329599712 0.0511461779 0.0474121486 0.0597142237 -0.0189842701 0.0288692003 0.0016447190 0.0123210051 0.0098503910 -0.0043642449 0.0128806168 -0.0123896413 -0.0008941309 -0.0128387190 0.0147503587 -0.0006495144 0.0014693930 -0.0017285707 0.0030004562 -0.0022363378 0.0051304747 0.0076056935 -0.0053120321 -0.0004227955 -0.0028745383 -0.0013232726 0.0009289050 0.0010464595 -0.0001862602 0.0054573460 0.0049318294 -0.0047665736 -0.0003447043 0.0074053771 0.0023039923 -0.0246095332 -0.0013133185 -0.0021410843 0.0016886276 -0.0139084594 0.0074724829 0.0021471933 0.0281401932 0.0091685241 -0.0269786012 -0.0024230408 0.0016209113 -0.0033893832 -0.0004392836 -0.0019985230 0.0008297926 0.0137709551 0.0093648492 0.0119812539 -0.0003861790 0.0002583102 -0.0000551888 0.0016395025 -0.0007935224 -0.0001037846 -0.0004206412 -0.0006675824 -0.0000431799 0.0001294669 -0.0004222701 -0.0019168487 0.0007095612 0.0004909329 0.0004067058 0.0014134913 -0.0019238564 -0.0048152915 0.0010385756 0.0002952237 -0.0002137001 -0.0020795435 0.0007704728 0.0012999205 0.0106105706 -0.0069234542 -0.0030699119 0.0008364948 -0.0003685832 0.0018692965 -0.0000743945 0.0004646479 -0.0017328314 0.0043552347 -0.0134928004 0.0020152423 -0.0045822010 -0.0087751169 0.0062670603 0.0031105761 0.0020836815 0.0032879876 0.0019557045 0.0008400786 0.0015090595 -0.0085043207 0.0042203319 -0.0073851227 -0.0043315849 0.0030811754 0.0050698923 -0.0005180953 -0.0005659684 -0.0007808443 -0.0058042954 0.0004554939 -0.0026120485 0.0081914600 -0.0001649284 0.0034028052 -0.0003922109 -0.0007647300 -0.0002371023 0.0007819077 -0.0002169202 0.0023172534 0.0032583470 0.0001862727 0.0009895705 -0.0006170516 0.0003869452 0.0004691916 0.0010080540 -0.0003095567 -0.0000634043 0.0039772780 -0.0015523545 -0.0015460438 -0.0000697172 0.0003486997 0.0000827740 0.0012283738 -0.0020885916 -0.0005353899 0.0002872915 -0.0012062397 -0.0013930750 0.0002901697 -0.0000704947 -0.0008851359 -0.0000663844 -0.0019298440 -0.0022200887 0.0014593468 -0.0004339692 -0.0017483340 0.0005103398 -0.0083820359 0.0070363371 0.0346178991 -0.0085203172 0.0396296897 -0.1122965767 0.0953556381 -0.0243322882 -0.1066890497 0.0831697357 0.0092742831 0.0799550429 -0.0455169251 -0.0312289948 0.0423282893 0.0137636097 -0.0288419908 -0.4737138189 0.0914362969 0.5646338349 0.1814978514 -0.0310945138 -0.2017493950 0.0039651263 -0.0360688616 -0.0876477734 -0.2745092270 0.0676069820 0.4564572060 0.0544615825 0.0506170394 -0.0989180764 -0.0338092663 0.0157942975 0.0202907977 0.0034001209 -0.0079879571 -0.0027224482 -0.0152514724 0.0177352416 0.0436982371 -0.0042632274 -0.0005080321 0.0005144484 0.0080918362 -0.0034024421 0.0057329126 0.0158066435 0.0099470857 0.0152662052 0.0044270354 0.0097521603 -0.0009065097 0.0033188709 -0.0037627309 -0.0111881675 -0.0057071061 0.0174195066 0.0295924402 -0.0067025800 0.0143192563 0.0416984714 0.0049074522 0.0062319427 0.0015127673 0.0128173651 -0.0153859860 0.0091436177 -0.0474705945 0.0269482786 0.0043337537 0.0030287084 -0.0220775106 0.0052467022 -0.0190527309 0.0573311300 -0.0128273834 -0.0303988071 0.0782084211 -0.0241350265 -0.0050057400 0.0007058140 0.0032530226 -0.0112170492 -0.0002138304 0.0388691598 -0.1717845995 -0.0783351958 0.0292306159 0.3158777325 0.0830358681 -0.0624854080 -0.0544934418 0.0109162716 -0.0618364721 0.1519585648 -0.0041521522 0.0591913268 0.4522067873 -0.0236567433 0.2434619532 -0.0522503819 0.0017302046 -0.0676528794 0.3890141245 -0.0243600629 0.2189520384 0.2134777930 0.0068630821 0.0806206249 -0.0255308566 -0.0003953104 0.0293210654 0.4009846147 -0.1220680402 -0.1239930426 -0.1351779990 0.0315944825 0.0251759978 -0.0075522908 0.0065418153 0.0375345444 0.0617634943 -0.0327223859 0.0157184363 0.0208100499 -0.0787526727 -0.1497928809 0.0565617151 -0.0606953165 -0.1152922341 0.0012125214 -0.0013457829 -0.0016447605 0.0082334977 0.0142125294 -0.0004696679 -0.0267625183 -0.0178439622 0.0323859580 -0.0003801696 -0.0002464654 -0.0007529439 -0.0009423337 -0.0004597231 0.0020590994 0.0006548623 0.0020464131 0.0007056680 -0.0020812918 0.0029738404 0.0024547371 0.0007988729 -0.0011576826 -0.0000465841 0.0017451329 -0.0026488733 -0.0015333030 -0.0049683804 0.0004949433 0.0082928217 0.0010993412 -0.0001920559 -0.0000252349 -0.0088995207 0.0104932648 -0.0127761901 0.0091514615 0.0200298729 0.0004410826 0.0029568734 0.0007476786 -0.0023460181 -0.0028780459 -0.0052930571 0.0015805406 -0.0054770474 0.0491651888 0.0144835560 -0.0227619483 -0.0097174052 0.0002577343 0.0318681899 -0.0145285046 0.0402360789 0.0950569426 0.0686113088 0.0825802374 0.0301838986 0.0703559642 0.0158395641 0.0120078245 -0.0156084202 -0.0581120252 -0.0102178996 0.0976757555 0.1896213492 -0.0291745873 0.0797947152 0.1939840417 0.0323979472 0.0288678213 0.0033966446 0.0400466596 -0.0636298303 0.0566009406 -0.2595421788 0.1484958613 0.0275192654 0.0159514641 -0.1110608674 0.0269128397 -0.1077657376 0.2914078479 -0.0727391430 -0.1547310867 0.3982049520 -0.1232657708 -0.0143574229 0.0002284886 -0.0116375957 0.0495881360 0.0702413725 0.0001659422 -0.1392586782 -0.0464807079 0.0164350501 -0.3510521395 -0.2795323326 0.0489880215 0.0034032610 -0.0077721024 0.0237859998 -0.2558549380 0.0178059082 -0.1063168410 0.1376586372 -0.0249725940 0.1172679184 0.0227851445 -0.0142514686 -0.0004192516 0.0103270804 0.0096490481 0.0614859222 -0.1817627828 0.0029444050 -0.1391577062 0.0057288782 -0.0090469274 -0.0070181496 -0.0460276910 -0.0177203767 0.0078087423 -0.0354298026 -0.0044474795 -0.0184301189 -0.0002151998 0.0026326229 0.0021387408 -0.0025342638 0.0079246682 0.0041409651 -0.0000046669 0.0048770258 -0.0128474968 -0.0150944131 0.0097131216 0.0094445944 0.0014164408 0.0100151354 0.0142617046 0.0047339617 0.0028221536 -0.0428884443 -0.0677849423 -0.1589524646 0.1240703797 -0.0012848360 0.0030895489 -0.0018730040 0.0120714259 -0.0067298528 0.0062057769 0.0136429389 -0.0139227953 -0.0016365630 -0.0011443549 -0.0115716783 -0.0055451804 -0.0037554547 0.0008817429 0.0102428988 0.0204245615 -0.0002074506 -0.0162206270 0.0138320206 0.0015452148 -0.0416113223 0.0041768416 -0.0056225071 -0.0004460846 -0.0217100847 0.0136720907 0.0072435004 0.0269232481 0.0032922603 -0.0239966939 -0.0088497634 0.0095703154 -0.0050543499 0.0000449470 -0.0057193680 0.0012950847 0.0385504522 0.0003958382 0.0263334895 -0.0241342160 -0.0117920384 -0.0036625167 0.0426320405 -0.0112763659 0.0647118023 0.1096789854 0.0740111472 0.0913434828 0.0334852848 0.0897301471 0.0335072986 0.0086120441 -0.0199177231 -0.0607623186 -0.0091476930 0.0980615217 0.2032301322 -0.0272927097 0.0862500514 0.1977699337 0.0289503266 0.0226691777 0.0049553132 -0.0100897229 -0.0420525618 0.0772500457 -0.1838741107 0.1094818395 0.0261848536 0.0062908383 -0.0857517857 0.0263432851 -0.0878233447 0.1322698346 -0.0454366672 -0.1314444215 0.2894357949 -0.0757843961 0.0049763382 0.0569843927 -0.0196844847 -0.0870701248 -0.1145493255 0.0188984807 0.3756878777 0.2699356667 -0.1131852349 0.2787963588 0.2876339267 -0.0041401187 0.0126671873 0.0216855036 -0.0058530287 0.2813262330 -0.0108554938 0.1126361596 -0.2776712516 0.0033866162 -0.1471600273 -0.0062640419 0.0124311242 0.0110191700 -0.0824385578 0.0015416753 -0.0865829312 0.0998941658 -0.0078009268 0.0970062316 -0.0107649357 0.0105442943 0.0009332645 0.0044191591 0.0255133477 -0.0010684625 0.0753657075 -0.0068433867 0.0136215022 0.0073177972 -0.0049074417 -0.0084406132 -0.0335052813 0.0018999314 0.0010164469 0.0006443006 0.0087231609 0.0479578614 -0.0073977982 0.0036415564 0.0064926998 0.0005674098 -0.0165188793 -0.0109404858 0.0223983790 0.0174777062 0.0069593460 -0.0169483113 0.0070495607 0.0194172327 0.0011563255 -0.0023886607 0.0016950589 -0.0123315637 0.0069969311 -0.0042957565 -0.0115218047 0.0130095510 0.0018777347 0.0007704576 0.0111189306 0.0058401401 0.0062581537 -0.0020649904 -0.0083659999 -0.0245533342 0.0067922307 0.0276544118 -0.0139652234 0.0029458603 0.0229434110 -0.0065655058 0.0074091785 0.0015079597 0.0294800635 -0.0226314413 0.0069159056 -0.0170433958 -0.0255703281 -0.0014150523 0.0085757902 -0.0024383337 0.0007770563 -0.0027907372 -0.0024844751 0.0002021201 -0.0212696818 0.0256904724 -0.0068606668 -0.0323882647 -0.0142718222 -0.0258522909 0.1025696200 0.0229068132 0.2146092139 0.1792610876 0.1173216923 0.1298884727 0.0452629887 0.1800283781 0.1057730993 -0.0182992876 -0.0292837123 -0.0830050911 -0.0262035072 0.0744979903 0.1672925505 -0.1070378493 0.1551342941 0.4294035904 0.0928108380 -0.0679962749 -0.0120806949 -0.4724125517 0.2931838728 0.1882607519 -0.0854712830 0.0206025707 0.0433465171 -0.0215584599 0.0899759561 -0.0030646356 -0.0494367185 -0.1266012401 -0.0110950942 0.1046289349 -0.3195997935 0.1224698061 0.0136598224 -0.0169864059 0.0005094553 0.0084065051 0.0133770116 -0.0026802265 -0.0561671959 -0.0457274745 0.0210987412 0.0258901048 0.0026158312 -0.0113470142 -0.0046138639 0.0000306089 -0.0053726409 -0.0144744656 -0.0010006256 -0.0190293694 0.0559255493 0.0051012996 0.0212883870 -0.0062913326 0.0025747982 -0.0007040236 0.0367055619 0.0043086368 0.0432390225 -0.0404457160 -0.0165027717 -0.0020911094 0.0268527821 -0.0113617217 -0.0073640368 -0.0715383100 0.0241399294 0.0287062430 -0.0940160838 0.0331354986 0.0231197322 -0.0050919036 -0.0073366840 -0.0049053440 0.0004547530 0.0431779413 0.0010337710 -0.0127679063 0.0452690134 0.0264040318 -0.0092598400 0.0085578554 0.0411290779 -0.0028196810 0.0024769836 0.0009047746 -0.0104990444 -0.0083940627 0.0130486515 0.0156821370 0.0207262846 -0.0142952671 0.0011253701 -0.0008628259 0.0005773405 -0.0031819860 0.0021685722 -0.0014985055 -0.0036232665 0.0024608874 -0.0003713465 0.0011103725 0.0003552125 0.0004603439 -0.0011858849 0.0013975404 -0.0006190497 -0.0038453449 -0.0001339837 0.0017255327 0.0041627333 -0.0015291762 -0.0013356106 0.0002959536 -0.0016705430 -0.0016830754 -0.0015132629 -0.0023616296 0.0054190512 -0.0087304286 0.0021618853 0.0112303677 -0.0020675337 -0.0033994102 0.0061441513 0.0033705731 0.0077332101 -0.0025141770 -0.0103050058 -0.0610009644 -0.0265120315 0.0038679912 0.0028233232 0.0048139107 -0.0106748300 -0.0068641450 -0.0348966525 -0.0260038584 -0.0192217337 -0.0166152330 -0.0052007017 -0.0263626563 -0.0196787995 0.0059684821 0.0024244085 0.0098094354 -0.0080316903 -0.0027963587 -0.0200533358 0.0123712920 -0.0301885198 -0.0583515818 -0.0194233865 0.0145718217 0.0050584645 0.0889393431 -0.0589393714 -0.0301572886 0.0300177034 -0.0111665099 -0.0108657671 0.0037924306 -0.0157830965 -0.0002676392 0.0146392761 0.0089264933 0.0059033112 -0.0220434572 0.0579188491 -0.0204983403 -0.0017746182 0.0076764658 -0.0000179436 -0.0133656088 -0.0194732816 0.0183986218 -0.0318943568 0.0201807938 -0.0288040170 0.1463047239 0.1030513768 -0.0083685658 -0.0153768859 0.0184164183 -0.0256669755 0.0741730162 0.0021669312 -0.0141817815 0.1397039807 -0.0058316217 0.0779481560 -0.0323585735 0.0206876848 0.0046000633 0.1956827189 0.0063773214 0.1667555577 -0.2163754287 -0.0557039576 -0.0244008114 0.1392300085 -0.0601402608 -0.0410417832 -0.3826775775 0.1429821954 0.1529076546 -0.4908658124 0.1800625190 0.1378809810 -0.0183497291 -0.0477891997 -0.0347443683 -0.0446411606 0.2612206151 0.0146771892 -0.0696149039 0.2750202390 0.1920443937 -0.0789756713 0.0590678353 0.2463177576 0.0006430156 -0.0032655200 -0.0032649945 0.0054765176 0.0050171977 0.0046044714 -0.0072683196 0.0105300058 -0.0026084965 0.0017290779 -0.0018296668 -0.0010727007 -0.0118117228 0.0049511118 0.0044388751 -0.0061630260 0.0111059954 0.0006828677 -0.0042597212 0.0086356369 0.0091836389 0.0021654093 -0.0022249820 -0.0022404787 -0.0083804703 0.0002483832 0.0102758456 -0.0070336247 -0.0002330159 0.0139578924 -0.0007652707 0.0032416530 0.0012181371 -0.0037192060 0.0099048786 -0.0147782110 0.0093896894 0.0130368682 -0.0066115232 0.0069155897 -0.0011958355 -0.0086172712 -0.0054529186 -0.0092047802 0.0045152317 -0.0057161378 0.1159054559 0.0339751810 -0.0021578380 -0.0000874553 0.0006418555 0.0077133214 -0.0070869189 -0.0050671045 0.0032674659 -0.0038061800 0.0057275734 0.0030208677 0.0037466654 -0.0032405922 0.0049314461 -0.0021230507 -0.0012121057 -0.0056421238 0.0093015728 0.0138488568 0.0079911956 -0.0063350520 -0.0143885974 -0.0127697240 0.0120495380 0.0064673088 0.0580815650 -0.0415010325 -0.0128748875 0.0254559702 -0.0112037448 -0.0118657487 0.0043972164 -0.0094670793 0.0003799060 0.0045086667 -0.0099381132 0.0004823088 -0.0283751943 0.0594590784 -0.0137247011 -0.0024181020 -0.0010590228 -0.0102512963 -0.0052376215 -0.0000977910 0.0021272650 0.0061527088 -0.0185164901 0.0260428084 0.0785995774 0.0148999474 -0.0226399993 -0.0008466264 0.0026052783 -0.0054206730 0.0138288101 -0.0020252649 -0.0103910353 0.0185928226 0.0067920240 -0.0002459159 -0.0095309118 0.0024159394 -0.0037227840 0.0378507457 0.0021818371 0.0367263516 0.0031286892 -0.0137868253 0.0198636449 0.0127493166 -0.0051848119 -0.0021462493 -0.0222858058 0.0123443611 0.0115982242 -0.0469313756 0.0176521090 0.0138648472 -0.0017693341 -0.0050603376 -0.0032198757 -0.0030788904 0.0260853450 0.0013438964 -0.0063211572 0.0265849858 0.0174004222 -0.0069540350 0.0048371275 0.0237091563 0.0010342391 0.0016478544 0.0032101650 -0.0052199233 -0.0046246142 0.0039365587 0.0238029366 0.0169983986 -0.0112515117 -0.0242130743 0.0254594292 0.0154488937 0.1460457850 -0.0579758954 -0.0574602382 0.0757435896 -0.1401348764 -0.0060666894 0.0527973786 -0.1028006315 -0.1148388385 -0.0129906053 0.0158623751 0.0147785356 0.0507045813 -0.0146181126 -0.0643850852 0.0598580534 -0.0054471338 -0.0895679352 0.0093313531 -0.0272285462 -0.0183166663 0.0047169629 -0.0614436390 0.1222150506 -0.0742336877 -0.0622551367 0.0684419691 -0.0462453394 0.0160926108 0.0734451318 0.0370709013 0.0607207877 -0.0361925411 0.0025107527 -0.8646518254 -0.2682361170 -0.0393701817 -0.0209769502 0.0051155207 0.1106287669 -0.0580568267 0.0802169728 0.1390215008 0.0963956559 0.1269994054 0.0980206535 0.1771684744 0.0302736154 0.0388685350 -0.0635103951 -0.0936229230 -0.1127943413 0.2347109957 0.4575360736 0.0244472198 0.0175620469 0.0820991224 -0.1122927694 0.0873255634 0.0648283473 0.2083984431 -0.1994704419 0.0110478098 0.5299942012 -0.2654785463 -0.1647447893 0.0206792884 0.0254503812 -0.0373839601 0.1663015711 -0.2164890808 0.0718674874 -0.0391554463 -0.0081838045 0.0268642896 -0.0030497885 0.0037526765 0.0116419889 0.0129577570 0.0129720701 -0.0075226137 -0.0512819060 -0.0412614741 0.0116162451 -0.0291407061 -0.0103136731 0.0023391209 0.0014778094 -0.0037792467 0.0018025262 -0.0312845771 0.0020933481 -0.0053671119 0.0006691846 -0.0004223242 -0.0008885159 -0.0002968602 -0.0012969144 -0.0001947624 -0.0036734289 -0.0027070005 -0.0076399511 0.0087276014 0.0047198874 -0.0012511039 -0.0026547090 0.0012969390 0.0012903202 0.0084191019 -0.0035348959 -0.0030411702 0.0145016383 -0.0062830928 -0.0058841821 -0.0009848894 0.0042684295 0.0030036735 0.0086105429 -0.0245811431 -0.0028329224 0.0022640874 -0.0144797541 -0.0131558472 0.0067506760 -0.0051099229 -0.0207085688 0.0006266976 -0.0078497860 -0.0086804087 -0.0062295042 -0.0114279244 0.0104033818 0.0129361121 0.0413770549 -0.0480240278 0.0008609652 -0.0011613242 -0.0002935579 -0.0076598334 0.0037775016 -0.0000095622 -0.0035385748 0.0056800764 0.0002190671 -0.0009788070 0.0070422285 0.0043771251 0.0005692741 0.0000208442 -0.0034732170 -0.0057860723 -0.0097665212 0.0010611511 0.0035695129 -0.0068244554 0.0221516365 -0.0013779523 0.0016632416 0.0038989011 -0.0006485793 0.0069822091 -0.0206529107 0.0086633035 0.0112376721 -0.0032893505 0.0042935965 -0.0014468629 -0.0057983601 -0.0028942260 -0.0041604194 0.0025201853 0.0005347005 0.0601088280 0.0179306493 -0.0001923773 0.0007043630 -0.0000512688 0.0018727441 -0.0017627033 -0.0035256204 -0.0010443209 -0.0046212869 0.0004139787 -0.0012470817 -0.0020851128 -0.0017413826 0.0014075354 0.0007486576 0.0011609204 -0.0021383621 -0.0010991712 -0.0072787390 -0.0004438071 -0.0039376550 -0.0022638736 -0.0016617768 0.0024835759 0.0014378034 0.0178833499 -0.0117786457 -0.0043524553 -0.0054390133 0.0031795254 0.0001029848 0.0014658713 -0.0040553085 0.0008365225 -0.0028598905 -0.0027162327 -0.0021309206 -0.0141999799 0.0285648396 -0.0054796842 -0.0004749987 -0.0033841356 -0.0060558891 0.0030353294 0.0095147267 -0.0011957391 -0.0140769243 -0.0307036275 0.0295951157 0.0062380831 -0.0340810867 -0.0152458475 -0.0012227795 -0.0011756243 -0.0008406409 -0.0120911863 -0.0000557798 -0.0075852108 0.0194849654 0.0025296063 0.0065949985 -0.0005357210 -0.0000527926 -0.0013989682 0.0076952058 0.0024004811 0.0129005096 -0.0051603412 -0.0055152403 0.0009288402 0.0021733867 -0.0012041159 -0.0002097290 -0.0033121984 -0.0007305833 0.0015877341 -0.0103943899 0.0023001187 -0.0001071125 -0.0010499172 0.0001476358 0.0005401568 0.0044495433 0.0006579952 -0.0006055217 -0.0006155594 0.0008946148 -0.0033185504 0.0011515115 -0.0004350966 0.0005999471 0.0004338857 0.0024202246 0.0030648517 -0.0053743989 -0.0021108852 0.0008865409 0.0045961574 0.0043855825 -0.0043294020 0.0723335213 -0.0853735520 -0.0354806091 -0.4285461391 0.1724101812 0.1178345007 -0.2311486906 0.4150357330 0.0222732206 -0.1153934918 0.3165851830 0.3103209480 0.0216863721 -0.0062398673 -0.0359136972 -0.0776152884 0.1012206050 0.1030453766 -0.1143770304 0.0575006825 0.0517091566 -0.0529591547 0.0306233260 0.0652996869 0.2166555891 -0.1630625228 -0.0870829461 0.0480258651 -0.1938595378 -0.1545948753 0.0005414906 -0.0101318051 -0.0027368714 0.0122547209 0.0286806376 -0.0084466733 0.0442544363 -0.3172204489 -0.1094688481 -0.0027419865 -0.0049681343 -0.0054768083 0.0020339786 0.0064890982 0.0288177334 0.0204066328 0.0187223249 0.0087481872 0.0049969674 0.0213755153 0.0168472321 0.0004843393 0.0013345689 0.0027170791 0.0042039411 -0.0011664897 -0.0002394129 0.0045464975 -0.0025952511 -0.0127386556 -0.0030846924 0.0010326452 -0.0004890603 0.0073044537 -0.0088741143 -0.0019532073 0.0121641501 -0.0028026051 0.0036649648 0.0005216958 0.0017214241 -0.0009361043 0.0024897926 -0.0042594403 0.0002979909 0.0013283212 -0.0048813274 0.0020814571 -0.0000635661 -0.0035704699 0.0006244082 0.0018777271 0.0129765128 0.0056112139 -0.0280303989 -0.0418363486 0.0420884170 0.0523252108 -0.0415243362 -0.0285437743 -0.0276981924 -0.0035250522 -0.0153257570 0.0411804404 -0.0128743548 0.0159948879 0.1671156186 0.0076824379 0.0761668560 0.0338003694 -0.0171253828 -0.0113788357 -0.1322018148 0.0365765552 0.0158994333 0.0569577967 -0.0396449984 0.0222112312 -0.0867828325 0.0351521042 0.0295176657 0.2325062545 0.0057019227 -0.0746134568 0.2727819028 -0.0710261881 0.0000502134 0.0853551246 -0.0917347604 -0.0653009623 -0.3054638689 0.3421875570 0.0748853730 0.0110372137 0.4113288842 0.2175351899 -0.4371842350 0.1780786325 0.3090717302 -0.0000938498 0.0011348601 0.0011222842 -0.0002222215 0.0012211049 -0.0019975914 -0.0051362279 -0.0095455004 0.0099580566 0.0038575239 -0.0032747154 -0.0040435984 -0.0153828177 0.0034683459 0.0149775462 -0.0069394100 0.0187352240 -0.0003566074 -0.0101944049 0.0070551584 0.0162530659 -0.0048159125 0.0020783878 0.0056215973 0.0147966825 -0.0038815941 -0.0177685244 0.0103441466 -0.0022793597 -0.0145396899 0.0042034141 -0.0049947793 -0.0037532138 -0.0234733188 0.0179310709 -0.0046893161 0.0027905519 0.0277560306 0.0142611609 -0.0003271704 0.0007627532 0.0015285288 -0.0002694218 -0.0006935824 -0.0001776481 -0.0034955477 0.0052717962 0.0017397384 -0.0034578812 -0.0061047993 -0.0097672636 0.0046866591 0.0100052922 0.0413571033 0.0309441895 0.0181432002 0.0141243019 0.0019540226 0.0293632585 0.0297618163 -0.0001232516 0.0044117011 0.0079033788 0.0070557298 -0.0112101662 -0.0227746814 0.0046423278 -0.0063886622 -0.0195896414 -0.0001507071 -0.0006022008 -0.0022950793 0.0090513941 -0.0072865343 -0.0050355696 -0.0092340217 0.0074115034 0.0083639262 0.0018001686 -0.0009085314 0.0006105482 -0.0150794599 -0.0063686049 -0.0108128261 -0.0143543745 0.0026957895 0.0104610686 0.0016855712 -0.0017199176 -0.0023310871 0.0029019029 0.0129901228 -0.0010177151 -0.0127561288 -0.0393073408 0.0430038084 0.0056210267 -0.0557590427 -0.0234510782 -0.0063412868 -0.0019181961 -0.0025268786 -0.0052659464 -0.0021208601 -0.0041356171 0.0416933698 0.0041142469 0.0172526617 0.0073778329 -0.0019030134 0.0007986844 -0.0182886375 0.0066289115 0.0050952574 -0.0170092054 -0.0073794959 -0.0084453922 -0.0052838199 0.0015337898 0.0011432824 0.0070589808 -0.0026941969 -0.0033200897 0.0145203969 -0.0057692466 -0.0039017138 0.0044826259 -0.0045350091 -0.0026514134 -0.0113970203 0.0164498514 0.0033797642 0.0012919983 0.0239975929 0.0034363448 -0.0277143078 0.0107981139 0.0154903582 -0.0002345086 0.0007619997 0.0010427846 -0.0040271393 -0.0010951796 0.0005407531 -0.0048147362 -0.0013385590 -0.0000105478 -0.0642022619 0.0501802458 0.0686579861 0.2291891792 -0.0463757694 -0.2475767777 0.1056787662 -0.2825494677 0.0148854867 0.1731057411 -0.0925236848 -0.2628669398 0.0916850882 -0.0414140737 -0.1105708452 -0.2748232309 0.0699994190 0.3277221458 -0.2037520857 0.0428878731 0.2924448447 -0.0789735814 0.0699881034 0.0852181546 0.3086014498 -0.2107606651 -0.0894923037 0.0589524798 -0.2817418960 -0.2475302300 0.0181160816 -0.0203320435 -0.0301562940 -0.0012717918 0.0070898961 0.0049063840 0.0452600126 -0.0049309858 -0.0145963017 -0.0415994141 -0.0783039195 -0.1118933053 0.0420565955 0.1270534419 0.5119749413 0.3668569327 0.2602762783 0.1587959469 0.0403802127 0.3573331888 0.3434394280 -0.0068245139 0.0395445965 0.0863403292 0.1306136208 -0.1270785855 -0.1790436726 0.1138839962 -0.0249448204 -0.2808328351 -0.0223773507 0.0022263253 -0.0230998615 0.1157673668 -0.1005841311 -0.0638746101 0.0071457813 0.0312572076 0.0681765620 0.0130007817 -0.0096920670 0.0024590685 -0.0723994997 0.0104736243 -0.0589752532 -0.0533098575 -0.0012183337 0.0449124297 -0.0006751457 0.0049325099 -0.0013830601 0.0026670645 0.0018746883 -0.0017735588 -0.0096898680 -0.0027134269 -0.0039465654 -0.0063393769 0.0079826177 0.0037260895 0.0020869208 -0.0004396520 0.0016204057 -0.0061626313 -0.0000776825 -0.0042259479 -0.0088723519 0.0021980693 -0.0067981067 -0.0049869057 0.0012961688 0.0006028816 0.0254095279 -0.0100700789 -0.0085492561 0.0067460358 0.0148916575 -0.0055714546 0.0053610600 -0.0023552232 -0.0008878712 -0.0098194702 -0.0016428758 0.0039736932 -0.0208416917 0.0050191600 -0.0005157076 -0.0047965895 0.0039741100 0.0028644849 0.0177350582 -0.0099483784 -0.0039225038 -0.0009331187 -0.0220880052 -0.0109236289 0.0254843012 -0.0087882371 -0.0089533086 0.0005841782 -0.0006281593 -0.0003305796 -0.0014705954 -0.0057713086 0.0056674159 -0.0017495191 0.0131363507 -0.0164593221 0.0041504680 -0.0030817306 -0.0048501915 -0.0139920139 0.0018844056 0.0187140781 -0.0070205164 0.0195840717 -0.0009202074 -0.0127956826 0.0043106294 0.0181133896 -0.0058428421 0.0015918384 0.0080457401 0.0224136036 0.0034464005 -0.0225016757 0.0074980302 0.0010862515 -0.0262023733 0.0052049983 -0.0046291085 -0.0055055953 -0.0215779367 0.0154014919 0.0038021817 -0.0023712826 0.0213152898 0.0161313960 -0.0002284886 0.0012430909 0.0010805970 -0.0005396146 -0.0013879216 -0.0001894499 -0.0041052649 0.0111432677 0.0034665479 -0.0004485972 -0.0010478398 -0.0011726396 0.0001530649 0.0020523856 0.0075770412 0.0036167398 0.0048264314 0.0009769533 0.0011743589 0.0037387627 0.0025643471 -0.0011539315 -0.0007086731 0.0011491123 0.0094493726 -0.0042605005 0.0038920872 0.0097052801 0.0075420162 -0.0101013518 -0.0014813403 0.0016400209 -0.0002318586 0.0032203737 -0.0056198885 0.0005520610 0.0045668431 -0.0005051236 0.0002831813 -0.0003682723 -0.0023718142 0.0016542512 -0.0000135731 -0.0090091860 0.0019275218 -0.0020573748 0.0067208607 -0.0018478252 0.0040213582 0.0059272186 -0.0042742176 0.0116897616 -0.0152585559 0.0247360153 -0.0970287872 -0.0066882611 -0.0404639794 0.1665743965 0.1058166930 0.0027819065 -0.1289690825 0.0035676618 -0.0552391672 0.3701829594 -0.1016133348 0.0154282095 0.4259494180 0.1244116716 0.1099186953 0.1386935255 -0.0114378798 0.0749111107 -0.4362935039 0.0795928456 -0.1282443697 -0.4124578792 -0.0664561886 -0.1935241093 -0.0158106412 -0.0023560804 -0.0277953497 -0.1911133231 0.0111697776 0.0284877926 0.0910415432 -0.0342628197 -0.0197151406 -0.0097033335 0.0267974938 0.0236718668 0.0978815982 -0.1351702633 -0.0210472917 0.0138199337 -0.0520282335 -0.1519332257 -0.0021727328 -0.0132341349 -0.1144971139 -0.0005072010 -0.0024654581 -0.0018626583 -0.0002797687 0.0045028816 0.0078266828 -0.0048172337 0.0186180643 -0.0044988722 0.0010076492 -0.0011067390 -0.0009891343 -0.0050191033 0.0012037228 0.0040024304 -0.0027223766 0.0066629324 0.0001322240 -0.0027610306 0.0028505560 0.0048913728 -0.0013485068 0.0010192714 0.0005897659 0.0028186445 -0.0056184185 -0.0059703731 0.0052074746 -0.0028121457 0.0012424918 0.0011497369 -0.0048092179 -0.0008019486 -0.0214397328 0.0174021592 -0.0191630879 0.0075993519 0.0370032528 0.0135154272 0.0012210821 -0.0009768946 0.0051030927 0.0004927403 0.0019507186 -0.0018024490 -0.0136367535 -0.0244195869 -0.0140718605 0.0004334142 -0.0000014897 -0.0002480319 -0.0085557286 0.0044240550 0.0006376723 0.0056150889 0.0039582333 0.0036826274 -0.0060595866 -0.0055070091 0.0040907605 -0.0022625586 -0.0021864117 -0.0010013564 0.0203738207 -0.0067114496 0.0118348018 0.0174806933 0.0203234389 -0.0081374775 -0.0026978660 0.0024882146 0.0011097089 0.0060820862 -0.0073943606 0.0005513071 0.0110834465 -0.0040127791 -0.0019248510 0.0016205075 -0.0001331478 0.0011473124 -0.0049226822 -0.0211322106 -0.0033077493 -0.0123719917 0.0133557681 0.0036281963 0.0023414198 -0.0079892288 -0.0155372408 -0.0572108948 0.0470729846 -0.0165609901 0.4141364893 -0.1917382308 0.4599866817 0.3015172300 -0.4377583784 -0.2886262059 -0.0024242461 0.0099220358 0.0190901309 0.0471379588 -0.0488980961 -0.1315999101 0.0025560976 0.0992460488 -0.0683331127 0.0092921910 0.0020059135 -0.0121506049 -0.0647897154 0.0726904825 0.1393419399 -0.0897095778 -0.1242195792 0.0557691192 0.0071141850 0.0007869544 -0.0022280708 -0.0294279424 -0.0393827550 0.0047177874 -0.0279022184 -0.0021444016 -0.0352330270 -0.0031418050 0.0056985794 0.0054064113 0.0140207465 -0.0296253203 -0.0027117060 0.0008497525 -0.0132292450 -0.0150878661 0.0111912402 -0.0085429886 -0.0300410620 -0.0011603623 0.0051729909 0.0087045760 -0.0022707089 -0.0020100596 -0.0003796985 -0.0032062966 -0.0231037001 0.0258198609 0.0038718189 0.0004873112 -0.0056294284 0.0093866080 -0.0089493465 0.0198427992 -0.0039932767 0.0018309397 -0.0079132766 -0.0174463324 -0.0193447253 0.0135519536 -0.0125713955 0.0042747333 0.0183526460 0.0407857886 0.0113973790 -0.0382045291 0.0185898446 0.0018894668 -0.0589736516 0.0104592391 0.0170134023 -0.0263493200 0.0811744715 -0.0832900894 0.1696842503 -0.1140801096 -0.1582318701 0.0299117912 0.0022428322 -0.0007831312 -0.0057988026 -0.0034142972 -0.0062509592 0.0040890788 -0.0086780367 0.1085902088 0.0295270327 -0.0003778697 -0.0005833614 0.0004601271 0.0011972224 -0.0002593159 0.0027098356 -0.0015584032 0.0043494369 -0.0019414155 0.0037828862 0.0021572580 -0.0036494912 -0.0003456362 -0.0006682915 -0.0007372793 0.0033571457 0.0006023015 0.0064574701 0.0027541813 0.0035402201 -0.0006691105 -0.0009338661 -0.0007169731 0.0013939378 -0.0003041222 0.0094826600 -0.0058345940 0.0048399183 -0.0073953133 -0.0097737959 0.0004314765 0.0032085964 -0.0017352963 0.0028278815 0.0004641376 -0.0004590771 0.0026564511 -0.0122006687 0.0057875329 -0.0025736144 -0.0037007686 0.0076300245 0.0168862112 -0.0139917239 0.0088327326 -0.1603671428 0.0432936289 -0.1378043685 -0.0804157458 0.1264919596 0.0860681627 -0.0053706985 -0.0026770621 -0.0160251422 -0.0132799108 0.0283029996 0.0760057073 0.0269183539 -0.0576938100 0.0563425714 0.0004964271 -0.0035820954 0.0155599567 0.0378788214 -0.0550895161 -0.1075285892 0.0281147057 0.0977740941 -0.0675224141 -0.0044014538 -0.0018201293 -0.0010182931 0.0034841096 0.0273977199 -0.0000167002 0.0197504979 -0.0000602538 0.0228666107 0.0016144625 -0.0021810282 -0.0027299788 -0.0070938190 0.0148224455 0.0014111757 -0.0002077060 0.0041987098 0.0051406871 -0.0058306489 0.0054208435 0.0164081325 0.0006229621 -0.0000740304 -0.0011325839 0.0043146609 0.0071976057 -0.0056401263 -0.0059251344 -0.0083199901 0.0100962375 0.0071883799 0.0019024541 -0.0109937822 0.0280718717 -0.0199517578 0.0275008891 -0.0090343281 -0.0104608913 -0.0216216708 -0.0359798132 -0.0390019773 0.0271018542 -0.0275663129 0.0096019990 0.0379840632 0.0881352184 0.0160711030 -0.0892212573 0.0368063917 0.0003671714 -0.1007170065 0.0188319857 0.0612598384 -0.0616194706 0.3253643356 -0.3077869968 0.4647501214 -0.3322603013 -0.5277682008 0.0531694533 -0.0010200467 -0.0021690255 -0.0060219294 -0.0025400838 -0.0054521771 0.0048594184 -0.0186776523 0.1407557034 0.0384915967 -0.0019692551 0.0011437636 0.0001869230 0.0154095985 -0.0157554717 -0.0215901937 0.0038787184 -0.0278489858 0.0137669685 -0.0011235575 0.0122995239 0.0148438241 -0.0003373589 0.0003616847 -0.0020078643 0.0134342994 0.0025797010 0.0179086210 0.0056684108 0.0080068776 -0.0012955533 0.0011450029 -0.0032367957 0.0102415086 0.0228723103 0.0695876720 -0.0538199576 -0.0414739214 -0.0234336237 -0.0763697223 0.0038474877 0.0008464826 -0.0006988485 -0.0228432785 -0.0045487859 -0.0178104725 -0.0249548074 -0.0039806292 0.0221410653 -0.0018748946 0.0003916159 0.0064468435 -0.0170313804 0.0172474074 -0.0005703656 0.1365422042 -0.0680043647 0.1637437586 0.1453539653 -0.1481462327 -0.1113050751 -0.0189845148 0.0134294177 -0.0315202792 -0.0292298913 0.0762339470 0.1443071708 0.0194002613 -0.1434557115 0.1430709655 -0.0087066350 -0.0203943276 0.0769140555 0.2440931054 -0.2737618208 -0.4732544648 0.0778726276 0.4859320963 -0.3598628427 -0.0056836418 -0.0104497542 -0.0103270464 -0.0290932069 0.0919112144 0.0109517070 0.0414279326 0.0079032214 0.0805316098 0.0025805062 0.0021604892 -0.0140296336 -0.0937941291 0.0418829755 0.0150561837 -0.0062571121 -0.0712810545 0.1040328196 0.0719670476 -0.0047654061 0.0429980561 0.0007350305 -0.0015685574 -0.0010747769 0.0003844880 0.0007664209 -0.0054318939 -0.0014424022 -0.0138414259 0.0106236561 -0.0008176584 -0.0006287635 0.0007595985 -0.0063831911 0.0031991196 -0.0010112161 0.0048639492 0.0026404870 0.0044110732 0.0059262284 0.0072915407 -0.0044975454 0.0024766380 0.0001084229 -0.0035291024 -0.0097937785 -0.0087532822 0.0074571417 0.0025920068 -0.0030074709 0.0114358547 -0.0015593688 -0.0083929962 0.0068840336 -0.0438639246 0.0392948767 -0.0508644365 0.0413765322 0.0632034654 -0.0076548661 -0.0012795094 0.0019092478 0.0004755691 0.0005252286 0.0001537022 -0.0005986762 0.0068393795 -0.0225168742 -0.0037586047 0.0101305917 -0.0191810714 0.0095263899 -0.1345205059 0.1250858660 0.1918584571 -0.0530594937 0.3067803341 -0.1426768505 0.0585508554 -0.0934181117 -0.1926597508 0.0152763973 -0.0014878879 -0.0005517018 -0.1415249053 0.0376190448 -0.0705535696 -0.0865836950 -0.0939496270 0.0676061395 -0.0022075112 0.0115199171 -0.0524414611 -0.1350637130 -0.3442914382 0.2801548084 0.1912157589 0.1263662978 0.3994413561 -0.0409258033 -0.0089453396 0.0017243725 0.2459784146 0.1325339585 0.1890627352 0.2878877926 -0.0004959099 -0.2353455123 -0.0033798427 0.0047726177 0.0038002943 -0.0035335104 0.0034464152 0.0005340535 0.0248830755 -0.0062025912 0.0250375686 0.0191546805 -0.0268109846 -0.0172694006 -0.0031696740 0.0004446512 -0.0013822476 0.0035270437 0.0008549562 0.0033969554 0.0074586995 -0.0018495112 0.0061542148 -0.0021837615 -0.0019473348 0.0103095404 0.0362726094 -0.0392305861 -0.0693333485 0.0131846694 0.0679216567 -0.0478664023 -0.0002274034 -0.0011072351 -0.0005871276 -0.0053873054 0.0046826414 0.0020333816 0.0009860303 -0.0002442345 0.0026543101 -0.0004073059 0.0003380812 -0.0015630255 -0.0045558780 0.0093600072 0.0006652513 -0.0003677322 -0.0120291874 0.0071868459 0.0124715356 -0.0003132749 0.0102966993 0.0007016481 -0.0017243323 -0.0020547227 0.0012217653 -0.0006484916 -0.0023380045 0.0026700801 -0.0105350133 0.0085552362 -0.0003025624 -0.0019758818 0.0001635181 -0.0159403194 0.0104886694 -0.0131957987 0.0117641445 -0.0069848247 0.0029346263 0.0116998144 0.0248189373 -0.0054459782 -0.0018301704 0.0075624838 -0.0019299947 -0.0210960529 -0.0691624044 -0.0044282932 0.0454441580 -0.0294135243 0.0451739980 -0.0005096524 0.0008173530 0.0004758585 0.0040119123 -0.0035784804 0.0037534072 -0.0008595547 -0.0074158554 -0.0032193188 -0.0011664956 0.0011521987 0.0001327555 0.0000726703 0.0001611384 -0.0001898314 0.0049934736 -0.0133916681 -0.0020073393 -0.0033655916 0.0117049942 -0.0067077903 0.1209084119 -0.0907381578 -0.1176214691 0.0035969806 -0.2113205424 0.0602600816 -0.0042030744 0.0860873876 0.1043952568 0.0327944158 0.0230469854 0.0090183684 -0.3076002281 0.1195021443 -0.1233291044 -0.2209137578 -0.2866394279 0.0553485853 0.0075097509 0.0095753509 -0.0307655268 -0.0505712340 -0.1890205607 0.1445241518 0.0703342013 0.0896680069 0.2072847947 0.0275726304 -0.0002916265 -0.0009168792 -0.1999779597 -0.0734425286 -0.1538562245 -0.2215008715 -0.0023639186 0.1762163086 0.0080143350 0.0290451391 -0.0063458358 0.0121733701 0.0081775062 -0.0055647897 -0.0397965046 -0.0162080504 -0.0089372335 -0.0340711524 0.0153311681 0.0178462465 -0.0148178816 -0.0132925982 0.0458784435 0.1186581643 -0.1675764335 -0.3151002148 0.1125683157 0.3027601587 -0.1997622811 -0.0246320794 -0.0036887544 0.0066260052 0.0993786552 -0.0732346292 -0.0999902749 0.0746125819 0.1196757970 -0.0555743849 0.0017697868 -0.0047491510 0.0009215019 0.0269670811 0.0530031384 -0.0007874777 0.0177535597 0.0060393482 0.0443660808 0.0030506909 -0.0003891614 -0.0017035115 -0.0273980308 -0.0226685488 0.0026712124 -0.0023560598 0.0216294745 0.0243413013 -0.0214636010 0.0011073380 -0.0204014785 0.0001007060 -0.0115694295 -0.0083483905 -0.0132041833 -0.0221038687 0.0268727557 0.0362153747 0.0579982240 -0.0504892471 0.0011589075 0.0026305622 -0.0009468394 0.0244264861 -0.0149836350 0.0149445639 -0.0221833610 0.0081504167 -0.0086305377 -0.0213092156 -0.0337495380 0.0139686244 0.0011304122 -0.0052184872 0.0022099844 0.0185873556 0.0531949153 0.0006386336 -0.0347321689 0.0233649728 -0.0354154943 0.0009451349 0.0010919957 -0.0026099958 0.0024689629 -0.0029254596 0.0101401436 -0.0096513138 -0.0038132113 0.0076844930 0.0015855812 -0.0045146260 -0.0002266017 0.0001637900 0.0013589281 0.0005392558 -0.0092848245 0.0238196662 0.0036599852 -0.0000371560 -0.0078053233 0.0043370654 -0.0566622848 0.0477230474 0.0767573386 -0.0090198826 0.1282673912 -0.0415008253 0.0163933154 -0.0392200231 -0.0733548641 -0.0173482746 -0.0129917807 -0.0051547433 0.1717812570 -0.0655203847 0.0706232834 0.1224519489 0.1600277524 -0.0242223834 -0.0014457692 -0.0084850787 0.0263816938 0.0511209020 0.1684919715 -0.1290387682 -0.0928869492 -0.0649227051 -0.1823193318 -0.0214834602 -0.0087201086 0.0040479478 0.1370136771 0.0562080707 0.1113831903 0.1511959225 0.0225503615 -0.1349178975 0.0004612901 0.0053145091 -0.0029937989 0.0056472777 -0.0016582695 0.0016047641 -0.0245907373 0.0244812759 -0.0389339849 -0.0599388380 0.0167499747 0.0345225697 -0.0129166304 -0.0137272285 0.0570116285 0.1353967722 -0.1981398272 -0.3796622197 0.1329926328 0.3553566203 -0.2303181053 -0.0286726504 -0.0033335067 -0.0033798765 0.1062154101 -0.0533613419 -0.0419929697 0.0608123917 0.0800764311 -0.0346826153 -0.0024687089 -0.0273847718 -0.0170750817 0.0996468116 0.2897285828 -0.0175534949 0.0825027572 0.0528609791 0.2811116486 0.0043140657 0.0052071120 0.0007207586 -0.0928673589 -0.1002910813 0.0108143718 -0.0103868068 0.0332932985 0.0799283958 -0.0311866705 -0.0167703328 -0.1055780198 -0.0005655896 -0.0008136941 -0.0005609581 0.0011250652 -0.0005397597 0.0000585882 -0.0142377848 0.0008866552 -0.0052862803 -0.0023514587 -0.0058011158 0.0008416801 -0.0578669801 0.0337106531 -0.0267142260 0.0572064828 -0.0174441553 0.0216102363 0.0494184336 0.0753311495 -0.0341564103 -0.0058895961 0.0116842778 -0.0018353510 -0.0332854071 -0.1191510394 -0.0107574862 0.0833832229 -0.0560896161 0.0734579208 -0.0004124944 0.0032778402 -0.0003164757 0.0147236974 -0.0103861908 0.0059111319 -0.0077802958 -0.0180105299 -0.0030245252 -0.0000814046 0.0011347661 -0.0009833343 -0.0003823276 -0.0007420084 0.0001704371 0.0046183092 -0.0017525801 0.0008011166 0.0004020132 0.0016869719 -0.0023679922 0.0135767830 -0.0103658659 -0.0171132708 0.0057442229 -0.0331545482 0.0117420522 -0.0057783666 0.0116895628 0.0238021632 0.0076741273 0.0054773442 0.0030623284 -0.0717909457 0.0242743122 -0.0371638865 -0.0506184379 -0.0671998366 0.0100875082 -0.0000657301 0.0027356517 -0.0104422200 -0.0205933598 -0.0671892546 0.0504836094 0.0390989905 0.0249820561 0.0746123235 0.0072170985 0.0049416893 -0.0018737848 -0.0437425421 -0.0207633740 -0.0366862571 -0.0480099771 -0.0107429791 0.0455398946 -0.0012871169 -0.0088485387 0.0005848261 -0.0059582495 0.0032482179 -0.0018310396 0.0272533778 -0.0111590109 0.0296843273 0.0215659350 -0.0258335021 -0.0220997331 0.0160414865 0.0095623044 -0.0232351119 -0.1104698024 0.1081739358 0.1844307027 -0.0779486219 -0.1971822867 0.1314679472 0.0110825771 0.0018438673 -0.0132308658 -0.0495483133 0.0579540377 0.1063498456 -0.0733359087 -0.1047030096 0.0364817378 -0.0102844353 -0.0530855450 -0.0391265622 0.1302150806 0.5346701127 -0.0251639069 0.1551029649 0.0935266621 0.5140680735 0.0037018831 0.0119623265 0.0195461126 -0.0369951937 -0.2569145946 -0.0058341446 -0.0104825950 0.1394703117 -0.0066550012 -0.1521846542 -0.0205568680 -0.2495453553 0.0002138801 0.0031574569 0.0028213546 0.0013409567 0.0031028023 -0.0047254279 0.0019862982 -0.0140932142 0.0146678982 0.0016445441 0.0037386379 -0.0001154501 0.0377719329 -0.0209103754 0.0131413323 -0.0395117373 0.0089692297 -0.0156843351 -0.0323756549 -0.0473191115 0.0234475087 0.0042013960 -0.0075218901 0.0007534600 0.0198159903 0.0762758460 0.0086212962 -0.0541740818 0.0363192684 -0.0458840606 -0.0000151871 -0.0022921968 0.0008669656 -0.0098939806 0.0073506274 -0.0061863501 0.0071742665 0.0124243199 0.0001737169 -0.0000901143 -0.0000530363 0.0003278609 0.0001105279 0.0001058743 -0.0000230000 -0.0009458633 0.0000431792 -0.0002050875 0.0125603406 -0.0012896654 0.0096593914 -0.1539730577 0.0766329191 0.0108981789 0.0083528025 0.1157791484 -0.0241622025 -0.0600731120 -0.1373756982 -0.0481154986 -0.0236145967 -0.0160161664 -0.0123127918 0.2072685312 -0.0686933405 0.1082326104 0.1423608552 0.1940014459 -0.0350596015 -0.0039104499 0.0061790569 -0.0092101791 -0.0361999010 -0.0723670907 0.0644237204 0.0614023133 0.0156169476 0.0721383665 0.0064250021 0.0043759093 -0.0005143807 -0.0278249831 -0.0294237926 -0.0244705553 -0.0375149346 -0.0043300071 0.0353429023 0.0004974152 -0.0085995759 -0.0089926367 0.0034277628 -0.0027210198 0.0003598140 -0.0179179979 0.0068421636 -0.0201575092 -0.0153051877 0.0194578342 0.0146750586 -0.0053576553 -0.0030978526 0.0112926340 0.0396859128 -0.0459746256 -0.0827075603 0.0376540993 0.0817714019 -0.0498197115 -0.0060490550 -0.0012221093 0.0026409626 0.0318922010 -0.0228579722 -0.0315452034 0.0215950888 0.0381115065 -0.0196911000 -0.0013952317 0.0006158203 -0.0007794632 0.0113881857 0.0020647824 -0.0048479125 0.0016893768 0.0030530647 0.0083877913 -0.0008222710 0.0002449572 -0.0060017982 -0.0379312353 0.0402353473 0.0085511510 -0.0023780597 -0.0511101347 0.0473605056 0.0570136005 -0.0066255372 0.0321666868 0.0005811977 0.0046884357 0.0055356280 -0.0012427308 0.0011911229 0.0019973859 -0.0027412684 0.0082976333 -0.0068694056 0.0175300570 0.0261082133 0.0019511280 0.2743864896 -0.1313538684 0.0146284796 -0.3403428475 0.0179787211 -0.1578516362 -0.2562424592 -0.3049943032 0.2152504538 0.0269396294 -0.0338676576 0.0001276038 0.0891456957 0.3680088628 0.0518851498 -0.2767130825 0.1877726315 -0.2064133580 -0.0028387370 -0.0075587555 0.0064152317 -0.0278909974 0.0183541153 -0.0172198268 0.0305196992 0.0341709855 -0.0088691081 0.0000784137 -0.0015675497 0.0004490779 0.0004639382 0.0012473312 0.0002285895 -0.0025565127 -0.0040131300 -0.0028788127 0.0181055226 0.0096350680 0.0097155709 -0.1707057271 0.0514096839 -0.1031162139 0.0372014355 -0.0059426228 0.0376823930 -0.1325324970 -0.1655069583 0.0467365345 -0.0381209269 -0.0156614782 -0.0158938253 0.3049927932 -0.0953734268 0.1591941261 0.1949378523 0.2643177138 -0.0776111186 -0.0020314256 0.0144502005 -0.0339535109 -0.0930197622 -0.2150136721 0.1806518922 0.1365345351 0.0746237901 0.2267375596 0.0287330229 0.0073038343 -0.0023809435 -0.1749598442 -0.0646528487 -0.1397059490 -0.1887845259 -0.0230637427 0.1676435854 0.0020545852 0.0041451459 -0.0030679642 0.0068163226 0.0038932904 -0.0044932324 -0.0335867251 -0.0220513773 -0.0001250090 -0.0040222673 0.0156572645 0.0034163816 -0.0009812963 -0.0007667587 -0.0011037318 -0.0071092247 0.0016545625 0.0014912056 0.0126370691 -0.0021960787 0.0073677881 0.0017137293 -0.0002744872 -0.0005337531 -0.0010523148 0.0022666869 0.0040986485 -0.0040059767 -0.0041357457 -0.0009710104 -0.0047638438 -0.0027924665 -0.0060838924 0.0240844816 0.0428849218 -0.0112811836 0.0166510915 0.0122303839 0.0539813603 -0.0023473567 0.0021277653 -0.0070882514 -0.0547783797 0.0482253470 0.0122275318 -0.0038752608 -0.0806743238 0.0667865890 0.0885342228 -0.0136813677 0.0351322103 0.0001709054 -0.0016038438 -0.0012272281 -0.0060679113 -0.0093530035 0.0150389467 0.0099138025 0.0494057874 -0.0504465392 -0.0220988942 -0.0161245332 -0.0058467049 -0.1901527979 0.0537726790 0.1386369650 0.3343154028 0.0771080050 0.1918187008 0.2200902986 0.1369246080 -0.2372612399 -0.0124612192 -0.0084216056 0.0023400768 0.0024197405 0.0290748589 -0.0037509939 0.0137320836 -0.0194016898 -0.0292759741 0.0028478806 0.0019216836 -0.0032475808 0.0107616325 -0.0055788513 -0.0043890575 -0.0161718215 -0.0045207928 0.0120862988 0.0007866819 0.0001328966 0.0002353352 0.0000719247 -0.0003817167 0.0001356437 -0.0047132328 0.0102512419 0.0006788289 0.0018380243 0.0095602299 0.0015747385 0.0139804573 -0.0359138745 -0.0977706783 0.0129815795 -0.1152073603 0.0500092963 -0.0437258515 -0.0013674907 0.0752325466 -0.0218945117 -0.0021267256 -0.0040756621 0.1535763064 -0.0493547795 0.0699304508 0.0891314156 0.1188931628 -0.0556473530 0.0016347817 0.0057626061 -0.0199301568 -0.0491749172 -0.1101693022 0.0921078880 0.0556435266 0.0471108207 0.1222562203 0.0097555789 -0.0015195797 0.0003723560 -0.0699952830 -0.0034470516 -0.0532808258 -0.0634108448 -0.0067594304 0.0547913025 0.0018480345 0.0145882812 0.0012868204 0.0050214852 0.0069017446 -0.0044981023 -0.0208427778 -0.0248411462 0.0132661242 0.0032945965 0.0003496698 -0.0056983929 0.0007777034 -0.0000845881 -0.0040639229 -0.0204272967 0.0148730321 0.0239355373 0.0022660605 -0.0250304934 0.0212815462 0.0045815207 0.0002237243 -0.0024012437 -0.0185099797 0.0151716628 0.0225038677 -0.0143015335 -0.0252234418 0.0106347585 -0.0050009355 -0.0020606365 -0.0056931822 0.0208824511 0.0349949699 -0.0109537197 0.0162785948 0.0097999654 0.0453959099 -0.0027478507 0.0022395815 -0.0060586006 -0.0437608211 0.0468513495 0.0102649241 -0.0029193013 -0.0778085025 0.0549504211 0.0843988510 -0.0123873520 0.0353517200 -0.0004403564 -0.0060555168 -0.0057190636 -0.0060945454 -0.0120822088 0.0149247397 0.0110498124 0.0424261547 -0.0448713931 0.0272663183 -0.0007636288 0.0216183720 0.0357730883 0.0970188160 -0.4506367847 -0.3136562878 -0.2838277986 -0.2506820448 -0.1312893652 0.1798319655 0.2566941144 -0.0041810519 0.0405372256 0.0077285384 -0.0543379301 -0.3650729884 -0.0534607243 0.2121776654 -0.1237001173 0.1984667853 -0.0004733000 0.0022590510 -0.0032591987 -0.0052662254 0.0034513048 0.0206379167 0.0072798370 -0.0088651091 -0.0145415251 -0.0010016287 0.0004876326 -0.0015654916 0.0000481116 -0.0003138972 -0.0002138135 0.0042295013 -0.0018261600 0.0020947166 -0.0096003171 0.0005525795 -0.0034256504 0.1176263522 -0.0545510504 0.0049301945 -0.0240039414 -0.0653009054 0.0001402590 0.0610994078 0.1003303135 0.0057367451 0.0083349533 0.0066672192 0.0067019605 -0.0915477511 0.0266550232 -0.0505804008 -0.0604560310 -0.0829964592 0.0111212686 0.0005033429 -0.0023251139 0.0033772410 0.0123310296 0.0236171000 -0.0215340054 -0.0146319196 -0.0085257720 -0.0239042693 -0.0093004540 -0.0016713902 0.0008056528 0.0570544100 0.0189166729 0.0448157170 0.0639051560 0.0056377762 -0.0547483914 -0.0001491109 -0.0040527556 -0.0020209809 -0.0007627986 0.0003123102 0.0035405326 -0.0149154610 0.0055484302 -0.0091942294 0.0007524571 0.0046069569 0.0043955042 -0.0042399874 -0.0008233543 -0.0043726167 0.0068361508 0.0005898028 0.0101046211 0.0532386373 -0.0039945310 0.0298104739 0.0214565006 0.0008660433 -0.0121834928 -0.1028641350 0.0762681478 0.1035984747 -0.0631272180 -0.1220297227 0.0552488947 -0.0280976531 -0.0043133992 -0.0261100898 0.1070997842 0.1300696229 -0.0601338063 0.0824131662 0.0392053141 0.1869516371 -0.0172691891 0.0125318275 -0.0364465352 -0.2310528422 0.3000429047 0.0560521817 -0.0139051457 -0.4700133358 0.3016478642 0.5070786211 -0.0670172795 0.2382698527 -0.0002157770 0.0020303096 0.0020341311 0.0020620566 0.0032595896 -0.0043304305 -0.0063422265 -0.0185536372 0.0200378082 -0.0026910938 0.0019345634 -0.0044163829 0.0143209007 -0.0262650338 0.0776220631 0.0245924131 0.0508832056 0.0283749602 -0.0002643240 -0.0527311521 -0.0232846517 0.0012771993 -0.0033336592 -0.0030761189 0.0001583492 0.0359533333 0.0090621156 -0.0218844504 0.0124605687 -0.0139221779 -0.0004995764 0.0006567768 0.0006606851 0.0054773317 -0.0047048573 0.0009505138 -0.0040081590 -0.0048250540 0.0019530449 0.0005777357 -0.0008020282 0.0001629515 -0.0001774348 0.0002528169 0.0000476763 -0.0015369287 0.0018595625 -0.0005220555 -0.0267402714 0.0157960909 0.0022114795 0.3681430711 -0.2232313520 -0.1479483525 -0.0796979093 -0.3527981137 0.0593070598 0.1324086495 0.2876759326 0.0960207628 -0.0422875724 0.0072174009 0.0049894744 0.2336730522 -0.0885352291 0.0710267804 0.1190466727 0.1572154763 -0.1151806895 0.0041841848 -0.0006534947 -0.0249540712 -0.0675202522 -0.1113261837 0.0992700834 0.0472303130 0.0570996226 0.1467111791 -0.0252510303 -0.0102628276 0.0049050653 0.1431802651 0.0883005022 0.1141275592 0.1905161543 0.0036768441 -0.1546058716 0.0008295432 0.0115087171 -0.0039637478 0.0016643103 0.0043102237 -0.0018535295 -0.0019115359 -0.0071179146 0.0076610633 0.0015272649 -0.0031982334 -0.0039313024 0.0007325883 -0.0002581160 0.0004907973 -0.0067919225 0.0013812620 -0.0013867072 -0.0053274670 -0.0007836080 -0.0021472570 -0.0039081520 -0.0001752969 0.0020826852 0.0220049484 -0.0145441138 -0.0180746292 0.0106015054 0.0226741612 -0.0112577385 0.0046393234 0.0000599471 0.0034002203 -0.0148501159 -0.0145517758 0.0088720319 -0.0136433577 -0.0036343179 -0.0219267889 0.0031766740 -0.0017319104 0.0051229505 0.0242683296 -0.0491149221 -0.0066272134 0.0013342024 0.0709605435 -0.0356050637 -0.0760406628 0.0085383944 -0.0415442229 -0.0000724257 -0.0031807125 -0.0024734948 -0.0026756691 -0.0079582788 0.0082976439 -0.0069293531 0.0117224645 -0.0159664857 -0.0020181088 0.0118925331 -0.0204052785 0.1098350626 -0.1219548918 0.2802610236 -0.0086880569 0.1945231264 0.0519931734 -0.0792773512 -0.2506534014 -0.0080974969 0.0041117358 0.0149408136 -0.0220132277 -0.0706985538 -0.0971413014 0.0239269285 0.0578899230 -0.0417737897 0.1047441665 -0.0055163821 0.0025270902 0.0079804551 0.0151289637 -0.0122347510 -0.0064729244 0.0004510042 -0.0155578295 -0.0073385659 0.0010014022 -0.0018066731 -0.0016677624 -0.0000329171 0.0017190436 -0.0000433448 0.0042936865 -0.0130629263 -0.0046403887 -0.0185558899 0.0054968542 0.0018774919 0.2397875678 -0.1302951499 -0.0458681403 -0.0664320835 -0.1711046570 0.0073163223 0.1166903988 0.1920098403 0.0148536430 -0.0173780826 0.0051898445 0.0052003664 0.0755425262 -0.0331721950 0.0133897017 0.0342667657 0.0443127430 -0.0495973393 0.0005836437 -0.0019507275 -0.0088907589 -0.0269453185 -0.0380406009 0.0347857577 0.0243119251 0.0164805801 0.0548320845 -0.0188225142 -0.0020081678 0.0021084351 0.1193901999 0.0448185976 0.0916418318 0.1429255786 0.0008012788 -0.1133282853 -0.0019112226 -0.0108948160 -0.0059087224 -0.0035387857 -0.0043485107 0.0032522011 0.0145697688 0.0189702384 -0.0104126957 0.0002957350 0.0028494521 0.0041658833 -0.0010365429 0.0003797278 0.0018948721 0.0142811060 -0.0086012219 -0.0126229961 0.0023573865 0.0139308296 -0.0094816643 -0.0021725516 -0.0002027857 0.0016789787 0.0126788374 -0.0099993771 -0.0150143614 0.0071845799 0.0165889661 -0.0089535301 0.0015245582 0.0004346914 0.0015747129 -0.0052032234 -0.0091148667 0.0029825216 -0.0054539767 -0.0021238394 -0.0115055264 0.0010486599 -0.0007515516 0.0013461377 0.0079329933 -0.0125105800 -0.0020050594 0.0005429972 0.0213104829 -0.0112097179 -0.0229423303 0.0031447273 -0.0101314727 0.0005908961 0.0059559547 0.0062187426 0.0043650522 0.0070142664 -0.0085399946 -0.0156488823 -0.0314383658 0.0317917598 -0.0034000464 -0.0178555264 0.0311065785 -0.1708467495 0.1699731210 -0.3584093778 0.0727843546 -0.2563274107 -0.0315540488 0.1541778604 0.3514122507 -0.0436340137 -0.0007500771 -0.0479682213 0.0372580986 0.1615549362 0.3774408236 -0.0118513414 -0.2333386583 0.1561130782 -0.2993884156 0.0093846532 -0.0061601467 -0.0121890249 -0.0269050626 0.0205001184 0.0063428647 -0.0007430696 0.0324384531 0.0168161936 -0.0002111468 0.0035913435 0.0034268676 -0.0012785040 -0.0039839671 0.0003977338 -0.0101994674 0.0222153850 0.0038289680 0.0003267602 -0.0003220888 -0.0011469422 -0.0037475474 0.0030380968 0.0026963219 0.0049738737 0.0017154146 0.0023056568 -0.0034949310 -0.0004887079 0.0056493319 0.0017395388 0.0010737438 0.0009958847 -0.0132066592 0.0028918470 -0.0108103065 -0.0090377171 -0.0124832949 0.0019703550 -0.0002511390 -0.0003354926 -0.0006712964 -0.0015775307 -0.0035845624 0.0022615445 0.0032921981 0.0011149784 0.0054761554 0.0003319507 0.0015011440 -0.0006482367 -0.0005798672 0.0004189159 -0.0013913560 0.0002723731 -0.0046084544 0.0026966873 -0.0011323993 -0.0039887588 0.0027949651 0.0011114148 -0.0000250926 0.0053197019 -0.0328941031 0.0023381529 -0.0151388262 0.0062246822 0.0129387261 0.0065951120 -0.0035766943 -0.0019548115 -0.0103110030 0.0027955083 0.0114906278 0.0344045121 0.0572836140 -0.0216712568 0.0411526052 -0.0039822548 -0.0010679846 -0.0036072949 -0.0336085563 0.0147849815 0.0169671277 0.0113917986 -0.0238634741 0.0299035291 0.0335509434 0.0295285290 0.0080677576 -0.0843539331 -0.2017424006 0.0236911405 -0.1207897473 0.0162395852 -0.1642280268 0.0389147574 0.0246410017 -0.0104900711 -0.5664123001 -0.3564547780 0.0841373606 -0.0245976374 0.0149205609 0.5015931209 -0.0119502267 -0.0892990604 -0.4208815965 0.0001409331 0.0011450849 0.0005904971 0.0020079728 0.0034320138 -0.0044466519 -0.0040508889 -0.0102952382 0.0099314352 0.0000645626 -0.0000039531 0.0000699782 0.0002528037 0.0003419699 -0.0020238860 -0.0011179535 -0.0013780189 -0.0010356885 -0.0004273947 0.0008409469 0.0009371021 -0.0000512285 0.0000551565 0.0001653289 0.0006511850 -0.0004287755 -0.0007813837 0.0000305651 0.0000289844 0.0001628267 0.0000066152 0.0005408978 -0.0001920877 0.0036870332 -0.0033189846 0.0029345290 -0.0018913149 -0.0047486040 -0.0004530537 -0.0002668350 0.0003251525 0.0001490247 0.0000570834 -0.0000181059 -0.0001080379 0.0006220534 -0.0024423424 -0.0002678190 -0.0221779537 -0.0187925395 0.0359097264 0.2768928616 -0.0667303855 0.2379732139 -0.3167317098 0.2182171981 -0.3091240592 0.3984296273 0.1713429845 -0.4994795062 -0.0204201811 -0.0096630188 0.0195716557 0.0544565305 -0.0636975114 -0.0195735912 0.0589565050 0.0641089384 -0.0375974390 0.0088554524 0.0023964981 -0.0046067250 -0.0118846664 0.0078671529 0.0061058506 -0.0016475466 0.0012387869 -0.0175151714 0.0300998371 0.0029428030 0.0006133836 -0.1951528416 -0.0740578104 -0.1485151470 -0.2355530433 0.0202164232 0.1787391483 0.0030038439 0.0106180910 -0.0036669486 0.0035823501 0.0042917527 -0.0033716236 -0.0111272692 -0.0156442943 0.0081851233 0.0025242531 0.0016354849 -0.0036407725 0.0009476578 -0.0000088338 -0.0015093021 -0.0106422872 0.0070964648 0.0104671376 -0.0047778667 -0.0113558097 0.0061313891 0.0002413367 0.0001984658 -0.0006899025 -0.0022669914 0.0030284797 0.0056604633 -0.0006784298 -0.0051907047 0.0039077732 0.0003939671 0.0001277668 0.0000243579 -0.0006383792 -0.0007666965 0.0002541410 -0.0014817051 0.0005718587 -0.0003649278 0.0004438214 0.0002095191 0.0000760065 -0.0051618771 -0.0052940032 0.0006410992 -0.0002927346 0.0021941259 0.0043038171 -0.0022156867 -0.0008180444 -0.0058187459 -0.0002454380 -0.0044649649 -0.0026423080 -0.0058881146 -0.0102138222 0.0124023689 0.0127720065 0.0348146958 -0.0344514640 0.0004916473 0.0000656607 -0.0007494124 -0.0009744304 0.0006222093 -0.0000409563 -0.0017509344 0.0000017000 -0.0019799011 -0.0025649641 0.0011569456 0.0033220063 -0.0011429216 0.0034856220 -0.0006705413 -0.0078173962 -0.0338454876 -0.0038293222 0.0219069839 -0.0145516336 0.0201019487 -0.0003928547 0.0006222582 -0.0000947221 -0.0020921738 0.0024061925 -0.0015309321 -0.0005122823 0.0035801658 0.0015843982 0.0007888741 -0.0051503183 -0.0003111385 0.0007059385 0.0024799008 0.0004225302 -0.0033124884 0.0080399750 0.0011190108 -0.0038602230 0.0007705868 -0.0003674525 0.0726158355 -0.0369782643 -0.0082835517 -0.0215950341 -0.0523060397 -0.0002387243 0.0397799496 0.0666781040 0.0079479027 -0.0056343553 -0.0004454550 0.0048193580 0.0039265101 -0.0035738698 0.0090263741 0.0117825680 -0.0025890414 -0.0459312826 -0.0148269610 0.0065448407 -0.0161030676 -0.0419311143 -0.1148213602 0.0780490956 0.1831696734 -0.0109583625 0.1046098289 0.0321114932 0.0632025412 -0.0258916919 -0.0968531457 -0.0292230005 -0.1163161660 -0.1023318551 -0.1308066689 0.1735357937 -0.0521942066 -0.2146319053 0.0913702764 -0.0525427408 -0.0654999072 0.0525611544 0.1762235791 0.2330434058 -0.1186845463 -0.0518607156 -0.0625091987 0.0457473995 -0.0074744864 0.0015537723 0.0173581682 0.1213562056 -0.0734222331 -0.1077033201 0.0401433771 0.1161611608 -0.0662345665 -0.0051988429 -0.0002611140 0.0017482167 0.0320205248 -0.0184136639 -0.0216151710 0.0044783492 0.0299379156 -0.0207879011 0.0012341646 -0.0013987181 0.0006246481 -0.0011621103 -0.0008935390 0.0019512176 -0.0062362685 -0.0004645390 -0.0027885706 -0.0017435062 -0.0012882791 0.0003475066 0.0240746842 0.0146784609 -0.0034576458 0.0007252335 0.0029280298 -0.0201365866 -0.0014539163 0.0039072139 0.0175026737 0.0026188405 0.0713500487 0.0476303563 0.0949371416 0.1627998040 -0.2182505414 -0.2087057238 -0.4718873841 0.4337978661 0.0008655294 0.0005059610 -0.0026921398 0.0094593858 -0.0070061012 0.0063635587 -0.0173831973 0.0099134052 -0.0075849371 -0.0180995894 -0.0088234441 0.0176408799 0.0011408801 0.0140482397 -0.0069798948 -0.0404348888 -0.1330791243 -0.0052587728 0.0725652196 -0.0477084167 0.0907831272 -0.0030117238 -0.0036533239 0.0107699874 0.0056840530 -0.0015721919 -0.0301207380 0.0373481272 -0.0106769011 -0.0400967325 -0.0108218911 0.0257608219 -0.0019477820 -0.0003293773 -0.0105929083 -0.0018620991 0.0580781158 -0.0810059618 0.0048763289 -0.0022425868 0.0004139581 -0.0007997226 0.0085865157 -0.0025678059 0.0001110569 0.0072641182 -0.0024184331 0.0077624622 0.0025046970 0.0076893702 0.0046753875 0.0081731679 -0.0005284833 -0.0018254170 -0.0493403545 0.0211704726 -0.0148759435 -0.0244278819 -0.0312490504 0.0141813344 -0.0049655661 0.0126952714 0.0066449284 0.0553631796 -0.0779228282 0.0121647405 0.0234102058 0.0067718052 0.0182197715 -0.0119236524 0.0133853353 0.0462498956 0.0027004766 -0.3034663922 0.0363700875 -0.0169320573 0.2998239024 -0.1138484961 0.0652072032 -0.2993382407 -0.5338505794 0.0131112664 -0.0125961176 -0.0183628884 -0.0251674174 0.0192462888 -0.0951557040 0.0245483371 0.1847409416 0.0502874107 -0.0000323956 0.0110460756 -0.0043700561 0.0458450916 0.0058872743 0.0375651075 -0.0374606769 -0.0266515747 0.0064265415 -0.0070358240 -0.0008188280 0.0052522321 0.0499201916 -0.0400369430 -0.0785736526 0.0633986404 0.0748090867 -0.0384409765 -0.0001494951 0.0010865891 0.0041014074 0.0106027282 -0.0048534345 -0.0008201473 -0.0055029030 0.0014870726 -0.0048836304 0.0005368050 -0.0011919127 -0.0003957432 -0.0047317878 -0.0019061311 -0.0005780748 -0.0008372770 0.0090828955 0.0059400056 -0.0061373497 -0.0010600971 -0.0034165018 -0.0137728433 0.2103146482 0.2484370205 -0.0649532332 -0.0155247493 0.1609687352 0.0568346588 0.0131483036 0.1844871953 0.0029296173 0.0012080221 0.0019227072 -0.0215365991 0.0155301532 -0.0062209157 0.0015084734 -0.0031605160 -0.0023750902 0.0073164432 0.0040769852 -0.0083723522 -0.0049445706 0.0105174121 -0.0085376189 -0.0721148739 -0.1431121683 0.0404831449 0.0900405817 -0.0669279072 0.0599648613 -0.0036692993 0.0153623924 -0.0155289565 -0.0452167630 0.0467734454 -0.0000179126 -0.0602453035 0.0732048379 0.0808736852 0.0201440777 -0.1425862745 0.0123646746 0.0111665488 0.0775851859 -0.0020148319 -0.1601064831 0.1972371827 0.0189116890 0.0006633120 -0.0027662058 0.0033210480 0.0078484627 -0.0044209189 0.0028312527 -0.0123357783 0.0088753410 -0.0144711849 0.0200634025 0.0137712008 -0.0208630514 0.0023208746 0.0007540252 0.0007729765 -0.0270923740 0.0141052158 -0.0047924947 -0.0148672508 -0.0231740863 -0.0014214711 -0.0017604731 -0.0014890998 -0.0018889590 -0.0078259570 0.0077902266 -0.0013080579 0.0091734727 -0.0021642915 0.0007831720 -0.0015688344 0.0044140298 0.0155039479 -0.0243580969 -0.0851669919 -0.0038694852 0.0067095430 -0.0319087202 0.0125939910 0.0287348498 -0.0387073999 -0.1527587662 0.0007206226 -0.0017393808 -0.0104820277 -0.0122520444 -0.0119357034 -0.0143896406 0.0132297705 0.0595615236 0.0142364528 0.0007950466 0.0027600642 -0.0011185010 0.0134466955 -0.0016470316 0.0122567217 -0.0088715330 -0.0058366051 0.0018323649 -0.0000496406 0.0001153888 0.0006173075 -0.0040988234 -0.0043185194 -0.0176241562 0.0108370841 0.0103079668 -0.0057379281 -0.0008500623 0.0008604579 0.0010633562 0.0053055808 -0.0017148232 -0.0027021953 0.0037066535 -0.0015154446 -0.0018108931 0.0007161782 -0.0000943724 -0.0000547072 -0.0037263811 -0.0001279323 0.0005892856 -0.0004210237 -0.0001642155 0.0015972925 -0.0014956413 0.0005686384 -0.0009676939 -0.0050434447 0.0425230682 0.0587956689 -0.0088324116 -0.0296118164 0.0805413349 0.0189765052 0.0727095461 -0.0026300626 -0.0033702571 -0.0078213236 0.0057727525 0.0155472211 -0.0160047247 -0.0047060499 -0.0218823204 0.0353819002 0.0082417202 0.0040752078 -0.0078005142 -0.0029568205 0.0009346453 0.0147694126 -0.0112401573 -0.0231991450 -0.0044127240 0.0015641489 -0.0187767935 0.0334800361 0.0538613504 -0.0058359222 -0.0509769870 0.0133976789 0.1790268533 -0.1727784004 -0.1015929485 0.0324450328 -0.1075343628 -0.0410773113 0.1015759111 0.6383662187 -0.0013612888 -0.1055151426 -0.4044553766 0.0114170231 0.2357702116 -0.3265212714 -0.2922205481 0.0001197376 -0.0001468711 0.0004050692 -0.0000499596 -0.0005865485 0.0003220712 0.0019003137 -0.0004892876 -0.0026126564 -0.0023340322 0.0025347794 -0.0020472294 -0.0001344779 0.0000436287 -0.0000437401 0.0001654762 0.0004347604 -0.0002205875 0.0009436462 -0.0006937804 0.0004360212 -0.0001136142 -0.0001593825 -0.0001148161 0.0006457316 0.0010883640 0.0012731419 0.0002092473 0.0003964263 -0.0001660692 0.0003634140 0.0002874129 0.0006490867 -0.0000155201 -0.0002541478 0.0000546334 -0.0033177267 -0.0055785618 -0.0054456430 0.0003196588 0.0000900001 -0.0002193546 0.0000567923 -0.0000487104 0.0010651498 0.0021823887 -0.0019590772 -0.0010352533 -0.0054024251 -0.0014132705 -0.0083805857 -0.0001277997 -0.0001940459 0.0001704765 0.0000386897 0.0008813112 -0.0003452858 -0.0000069163 -0.0000301793 -0.0003047725 0.0000056639 -0.0000052838 0.0000483046 0.0004274636 0.0010407456 -0.0002734092 0.0003927365 -0.0006903118 -0.0006496488 0.0000391483 0.0000184016 0.0001198679 -0.0001880813 0.0001234889 -0.0010935075 -0.0001549656 -0.0004123238 0.0001089922 0.0000412884 -0.0000234446 0.0000348850 -0.0001319752 0.0000258100 -0.0003105648 -0.0004277343 -0.0000611523 -0.0000114763 0.0001044765 0.0003288993 -0.0000962705 -0.0001810085 0.0000601868 0.0001791440 -0.0004297443 0.0005378674 0.0010317552 0.0004250060 -0.0075678742 -0.0063461823 0.0003437641 -0.0000960119 -0.0005766934 0.0023251496 0.0035468640 0.0010336242 -0.0023471597 -0.0028070615 0.0058094209 -0.0037450846 0.0010999455 -0.0024100300 -0.0001226882 -0.0000247679 0.0004319298 0.0042969708 -0.0010939565 0.0042020944 -0.0048721863 -0.0031165387 0.0012680735 0.0045919157 -0.0056695455 0.0059235367 0.0413073619 0.0351473143 0.0062509673 -0.0979286180 0.0414705802 -0.0890319345 0.0473569587 0.0253632820 -0.0640578170 -0.0000786128 0.0015152667 0.0003703876 -0.5531683118 -0.3241782885 0.7477521664 0.0000184987 -0.0001437321 -0.0001356991 0.0007390608 0.0014680350 -0.0006209179 -0.0015125868 0.0004426010 0.0018060107 0.0006518748 -0.0003258052 0.0005006796 0.0001377777 -0.0000932490 0.0000550962 -0.0002981052 0.0002391339 0.0000052494 -0.0013994651 0.0007996492 -0.0005928949 -0.0000951597 -0.0003438897 0.0003300581 -0.0012624436 -0.0010444492 -0.0017453252 0.0021757271 0.0050349549 -0.0022913265 -0.0005502874 -0.0001055539 0.0001530215 0.0030682554 -0.0009387512 -0.0043814329 0.0022977514 0.0016844174 0.0034255208 0.0008523811 -0.0004334097 -0.0012798399 0.0337672379 -0.0326702496 0.0557573503 -0.0779228228 0.1486872627 0.1673209215 -0.3204393786 0.2507725746 -0.8378611990 0.0068133777 0.0109659929 -0.0100532330 -0.0503596244 -0.2022141113 0.0672858990 -0.0326143556 0.0681999567 0.0640870343 0.0000088426 -0.0006023510 -0.0001559505 0.0017479644 0.0102757402 -0.0042856404 -0.0012846207 0.0007730802 0.0006785082 0.0000875636 -0.0000907774 0.0002840646 -0.0008107758 -0.0001611593 -0.0025771574 -0.0008198852 -0.0001884270 -0.0002484581 0.0001266243 -0.0001021425 0.0002686143 -0.0004880575 0.0005160815 -0.0026297747 -0.0007798380 -0.0000704476 0.0000860503 0.0003091031 0.0009447496 -0.0002092766 -0.0001078511 0.0004202321 0.0003053717 -0.0005032533 -0.0014892527 0.0002965896 -0.0041559201 0.0067261668 0.0063314428 0.0000810991 -0.0000047782 -0.0000857885 0.0003805683 0.0005621045 0.0002092797 -0.0002516132 -0.0006526353 0.0012822632 -0.0004262321 0.0000049371 -0.0007698322 0.0003039565 0.0002471174 0.0004435492 -0.0028157884 0.0011300335 -0.0035044207 -0.0012204857 -0.0028773833 -0.0012127097 -0.0056561677 0.0039677651 -0.0056228367 -0.0116897696 -0.0106970628 -0.0016974879 0.0779359053 -0.0353026501 0.0687706033 0.0010693332 0.0004315329 -0.0001311472 -0.0001128241 -0.0002443843 -0.0001524572 -0.0093968632 -0.0028826341 0.0026637325 0.0000431822 0.0001589674 0.0002056404 -0.0010684109 -0.0022508175 0.0008707466 0.0020001761 -0.0006249218 -0.0023387543 -0.0013951376 0.0009850809 -0.0009112290 -0.0001982952 0.0001246031 -0.0000852720 0.0003438703 -0.0000477770 0.0000087634 0.0019408153 -0.0012069192 0.0008616167 0.0000861348 0.0004325225 -0.0004979156 0.0020585416 0.0018707391 0.0028199065 -0.0029396036 -0.0070089342 0.0031352266 -0.0000233380 0.0000398098 0.0000898287 0.0006320390 -0.0000245315 -0.0007488032 -0.0000728995 -0.0003836512 -0.0002967810 -0.0000150727 -0.0000629077 0.0004108940 -0.0034069973 0.0036001362 -0.0054675087 0.0101422761 -0.0175561713 -0.0195081282 0.0320881955 -0.0264843693 0.0856373169 -0.0018544375 -0.0031386446 0.0028219813 0.0137418421 0.0538394549 -0.0181586109 0.0081876689 -0.0165818622 -0.0159070410 -0.0000732274 0.0000889069 0.0000381371 0.0000643402 -0.0010472346 0.0005794331 0.0006326005 -0.0006610739 -0.0006889919 -0.0000518995 -0.0000558114 -0.0000789973 0.0004621336 0.0000023292 0.0012513936 0.0003578396 0.0008298883 -0.0001885469 -0.0000974496 0.0000266546 -0.0000530014 0.0000910384 -0.0000961347 0.0003872346 0.0009585414 0.0000682106 0.0000676238 -0.0000664568 -0.0003205457 0.0000969575 -0.0000681835 -0.0000883341 -0.0001075989 -0.0001110652 0.0005829321 0.0002118248 0.0000113672 -0.0030600380 -0.0025583082 0.0015315925 -0.0011420429 0.0002995454 0.0084481532 0.0138639961 0.0026795205 -0.0028917301 -0.0060039051 0.0117787705 -0.0167422292 0.0034797231 -0.0188977378 0.0015230292 -0.0000488175 0.0030134823 -0.0300856757 0.0099244775 -0.0281812205 -0.0025708505 -0.0082158352 -0.0025280134 -0.0470385332 0.0365971570 -0.0465573313 -0.1143538223 -0.1201019378 -0.0377005466 0.6902712450 -0.3103866397 0.5960546698 0.0060337504 0.0029245961 -0.0106103295 0.0000075140 0.0001401269 0.0002810559 -0.0795186569 -0.0414205465 0.1094971792 -0.0000047378 -0.0002917723 -0.0003413567 0.0017111698 0.0035532181 -0.0013872069 -0.0036424985 0.0011230428 0.0041940595 0.0019838566 -0.0013948828 0.0011854399 0.0002697066 -0.0001409351 0.0000657582 -0.0006141021 -0.0002471044 0.0004979885 -0.0026284789 0.0016840433 -0.0010549949 -0.0002751870 -0.0012512453 0.0012093607 -0.0044039256 -0.0037784724 -0.0058722076 0.0074521101 0.0185253783 -0.0083442084 -0.0004605573 -0.0001723543 0.0000424736 0.0027761193 -0.0005405124 -0.0037080654 0.0025917351 0.0019934454 0.0037038525 0.0002933895 -0.0001575549 -0.0007232025 0.0098770462 -0.0089130432 0.0137245949 -0.0244597918 0.0427816433 0.0459148886 -0.0844343542 0.0622272099 -0.2080727136 -0.0293620685 -0.0455316203 0.0450491166 0.2187307641 0.8082371800 -0.2719606191 0.1346692520 -0.2637743040 -0.2561045057 -0.0007335265 0.0020071606 -0.0015074570 -0.0075360210 -0.0255593785 0.0091581356 0.0040946372 -0.0024757632 -0.0015667497 0.0017537386 0.0041420954 0.0011429383 -0.0061397926 0.0043517858 -0.0276937862 -0.0107665255 -0.0504827654 0.0182792032 0.0001559744 -0.0002031873 -0.0016662971 0.0037631956 -0.0033267725 0.0217130082 -0.0076348020 -0.0007020239 -0.0016023460 0.0012605059 0.0057643856 -0.0019642324 -0.0001234350 0.0002143977 0.0002513109 -0.0003592458 -0.0004311420 -0.0004206860 -0.0020084947 0.0054382055 0.0060293915 -0.0005006004 0.0004061968 0.0000562999 -0.0029884404 -0.0050822027 -0.0011183391 0.0021579487 0.0020813239 -0.0050163886 0.0062906286 -0.0016380906 0.0055731717 0.0000417669 -0.0000316327 -0.0000380895 0.0004888117 0.0000329975 -0.0000189213 0.0002095503 0.0005240935 0.0000006883 0.0015759971 -0.0013495852 0.0015321154 0.0048939525 0.0049439204 0.0020802620 -0.0253927203 0.0113423696 -0.0209697671 0.0001817447 0.0001091848 0.0009020880 -0.0001558134 -0.0003026119 -0.0000882496 0.0029314605 0.0026841200 -0.0072951348 0.0013053775 0.0000090245 -0.0002377704 -0.0015774191 -0.0046874351 0.0045878335 -0.0039277684 0.0023839012 0.0050790157 -0.0096022746 0.0073585703 -0.0057375278 -0.0157863291 0.0086365998 -0.0068208565 0.0035315373 0.0203328514 -0.0083459272 0.1828993910 -0.1325728419 0.0845122808 -0.0048022281 -0.0455123180 0.0524653632 -0.2301817112 -0.1988306106 -0.2942150217 0.2867187984 0.7445120115 -0.3250272307 0.0065289284 0.0008483913 -0.0047798704 -0.0589343358 0.0024249941 0.0916803474 -0.0202171678 -0.0165606148 -0.0332602026 0.0004352604 0.0008639397 -0.0004032738 -0.0003829807 0.0003450313 -0.0006865748 0.0005107149 -0.0008811845 -0.0011614869 0.0035494322 -0.0027694856 0.0092611189 0.0005811855 0.0006539663 -0.0008957020 -0.0039787837 -0.0140580207 0.0046350218 -0.0030899908 0.0060111501 0.0058393242 -0.0000361642 -0.0001160262 0.0001068082 0.0005224490 0.0018147059 -0.0004054352 0.0002462609 -0.0004929186 -0.0004656372 -0.0003282847 -0.0005229211 -0.0003315404 0.0019200696 -0.0006715582 0.0061835321 0.0018444764 0.0067144560 -0.0023930871 -0.0000853555 0.0000061152 0.0000492946 -0.0000953152 0.0000881769 -0.0007319700 0.0009935106 -0.0000345666 0.0001189828 0.0001106456 0.0000322698 0.0000753165 -0.0000950484 -0.0002703927 -0.0000802902 0.0000704608 -0.0002166837 0.0001851267 -0.0002730011 0.0009055544 0.0006874381 0.0006857461 -0.0005388353 -0.0001630949 0.0041635724 0.0069948420 0.0016019835 -0.0034217937 -0.0030555171 0.0076840684 -0.0085191293 0.0022397787 -0.0073650829 -0.0000516423 0.0000239064 -0.0000120352 0.0001432412 0.0002432409 0.0003814486 -0.0001966745 -0.0002442100 -0.0001222519 -0.0003086715 0.0003198924 -0.0003261351 -0.0013146118 -0.0013561453 -0.0004334868 0.0055442440 -0.0025128274 0.0045464591 -0.0001460261 -0.0000993707 -0.0001356895 0.0000651136 0.0000995566 0.0000417361 -0.0001925334 -0.0003146951 0.0007752811 -0.0003192662 -0.0004248049 -0.0004257308 0.0032440302 0.0070451228 -0.0027569158 -0.0043585486 0.0014073640 0.0049642821 0.0047298389 -0.0035797543 0.0025859850 0.0013651664 -0.0004248738 0.0003811667 -0.0020665814 -0.0048866383 0.0020114184 -0.0138452263 0.0100199020 -0.0061910094 -0.0000325247 0.0005008465 -0.0006833599 0.0035729234 0.0029094804 0.0043428748 -0.0032473628 -0.0088423105 0.0037475310 0.0003850512 0.0001018037 -0.0000921547 -0.0026179963 0.0003120152 0.0034238179 -0.0020393696 -0.0011750370 -0.0025170141 -0.0000594039 0.0000372109 0.0000339843 0.0001450248 -0.0001926861 0.0001843537 -0.0005848747 0.0009033913 0.0010590578 -0.0011942895 0.0010412170 -0.0032027238 -0.0002617627 -0.0002294993 0.0003962751 0.0017237162 0.0057447709 -0.0018130530 0.0015579566 -0.0029804867 -0.0029398722 0.0000869176 -0.0001705506 -0.0002318288 -0.0000735958 -0.0001694391 -0.0000533469 -0.0013253650 0.0023464582 0.0025610025 0.0013478380 0.0023647630 0.0010722366 -0.0073981580 0.0024834106 -0.0229001935 -0.0084869162 -0.0304294620 0.0105190710 -0.0002851280 0.0000103541 0.0000270416 -0.0004980248 0.0001720401 -0.0013866309 0.0043862149 0.0004809465 0.0006044859 -0.0004107676 -0.0009351845 0.0002661442 0.0000762056 0.0000014808 0.0000098352 0.0000534208 -0.0000332423 -0.0000028067 -0.0001969324 0.0004591547 0.0001509646 0.0384356758 -0.0341527147 -0.0099289684 0.2572146996 0.4343203212 0.1000631109 -0.1981457743 -0.1736925737 0.4417085143 -0.5083224189 0.1382774689 -0.4313309152 -0.0028616152 0.0008255715 -0.0005803576 0.0198487094 -0.0080528483 0.0159125487 0.0054408568 0.0063221618 0.0003514596 0.0016350602 -0.0008547270 0.0017602135 -0.0008380923 -0.0018877875 -0.0011294322 -0.0197688009 0.0097173335 -0.0198043539 -0.0006450008 -0.0000704899 0.0007296972 0.0000462905 -0.0000548520 -0.0000510044 0.0075153042 0.0030245508 -0.0099563285 0.0005034091 0.0011419767 0.0008398318 -0.0077027932 -0.0165679805 0.0065826024 0.0105309617 -0.0033187182 -0.0117823916 -0.0086686073 0.0066197759 -0.0044947984 0.0003555081 0.0000838948 -0.0000570078 -0.0015073628 -0.0035720146 0.0014317187 -0.0028943778 0.0021748239 -0.0011602812 -0.0000016074 -0.0003946846 0.0005405707 -0.0025934893 -0.0022778076 -0.0032047512 0.0027183663 0.0070892276 -0.0030390051 0.0002559461 0.0000566762 -0.0001604159 -0.0021398467 0.0001413683 0.0031751430 -0.0008906233 -0.0006991601 -0.0014226886 -0.0000420946 -0.0000435682 -0.0000006908 -0.0006972115 0.0005416718 -0.0005961403 0.0019200128 -0.0038177472 -0.0042802989 0.0058229372 -0.0035223495 0.0129119494 0.0016558317 0.0017074758 -0.0030854806 -0.0097469965 -0.0410910010 0.0156763215 -0.0092904184 0.0181226293 0.0178599899 0.0014653273 -0.0056560093 -0.0039941044 0.0071113650 0.0194067079 -0.0089435095 -0.0285607224 0.0515723054 0.0553355097 0.0317085083 0.0552277460 0.0244389237 -0.1735410953 0.0582167108 -0.5315369164 -0.2006893126 -0.7133868227 0.2470204954 -0.0120788838 0.0038577339 0.0034527295 -0.0251620792 0.0116477932 -0.0929467623 0.1956739396 0.0187454770 0.0249829539 -0.0266571508 -0.0788572180 0.0234720510 0.0000500531 0.0000237289 -0.0000121495 0.0000358927 0.0000322303 0.0000586201 0.0000694478 -0.0004229509 -0.0005287159 -0.0015827521 0.0014238896 0.0004019116 -0.0106804276 -0.0180244366 -0.0041482359 0.0081737540 0.0071320855 -0.0181828612 0.0210837990 -0.0057526116 0.0178587601 0.0001158419 0.0000066940 0.0000183609 -0.0006925352 0.0002700948 -0.0004472525 -0.0004657907 -0.0007022236 -0.0000976123 -0.0001854155 0.0001625561 -0.0002005247 -0.0006112465 -0.0004790521 -0.0001508121 0.0031267835 -0.0014213036 0.0026442741 -0.0001032904 -0.0000763994 -0.0000601965 0.0000375097 0.0000670484 0.0000095093 0.0000080374 -0.0001182742 0.0003125413 0.0135225010 0.0350827107 0.0282050057 -0.2383308617 -0.5103000822 0.2020333742 0.3489443113 -0.1084787179 -0.3882328487 -0.2682940357 0.2055036146 -0.1383565047 0.0314402601 -0.0102867387 0.0064466892 -0.0471542051 -0.1221670019 0.0527638323 -0.3292423963 0.2409249416 -0.1419959277 -0.0026220984 -0.0082550923 0.0043909224 -0.0036073638 -0.0040097074 -0.0033938305 0.0372575427 0.1002808325 -0.0437015351 -0.0007182284 -0.0004260361 -0.0012313655 -0.0013822483 -0.0001633001 0.0033118345 0.0079578270 0.0053938254 0.0085979505 0.0000558615 0.0001514722 -0.0001427008 0.0000790641 -0.0000873671 0.0001072303 -0.0002927557 0.0005449761 0.0005803673 -0.0007615319 0.0005656557 -0.0018126260 -0.0000585127 -0.0002699535 0.0000933934 0.0008227006 0.0031356039 -0.0012012159 -0.0000996904 0.0002161284 0.0002706836 -0.0000552957 0.0002514747 0.0001343769 -0.0002485203 -0.0013367159 0.0005302443 0.0010904246 -0.0018070941 -0.0020587100 -0.0008505633 -0.0013139886 -0.0008509943 0.0051625156 -0.0017744028 0.0159117088 0.0048567134 0.0174438601 -0.0060240096 0.0004950263 -0.0000926785 -0.0002379208 0.0012270196 -0.0004370527 0.0045256250 -0.0077427510 -0.0005743319 -0.0009867685 0.0006076211 0.0020119690 -0.0005640291 -0.0000258692 -0.0000275975 0.0000113364 -0.0001014037 0.0001947439 0.0002022948 -0.0002538581 -0.0024397423 -0.0023283596 0.0001516012 -0.0001560987 -0.0000441878 0.0011698469 0.0019742266 0.0004539553 -0.0008459599 -0.0007165938 0.0018731361 -0.0021053289 0.0005847884 -0.0017932605 -0.0000122806 -0.0000400174 0.0000013869 -0.0001267483 0.0000636843 -0.0001507585 0.0003076187 0.0005077699 0.0000585349 0.0000978770 -0.0000275877 0.0000799914 -0.0000108405 0.0000899179 0.0000882221 -0.0011136226 0.0005189633 -0.0009210661 -0.0001776850 -0.0001988684 0.0001988300 -0.0000069144 0.0000584666 -0.0000113689 0.0016183500 0.0009957778 -0.0022326986 0.0150744646 0.0160571629 0.0144833999 -0.1286454963 -0.2810396668 0.1076820356 0.1470598185 -0.0495819790 -0.1686737321 -0.1910942667 0.1459031202 -0.1009661370 -0.0597998381 0.0112538227 -0.0119346403 0.1194406317 0.2867059122 -0.1181553245 0.5799656574 -0.4224953281 0.2533412294 0.0084731001 0.0175607176 -0.0059217241 -0.0233502956 -0.0151182713 -0.0253702005 -0.0752344652 -0.1943216851 0.0891799442 -0.0081860217 -0.0029654697 0.0013964758 0.0528376413 -0.0022829082 -0.0805465261 0.0482470506 0.0351868514 0.0665199971 -0.0000903486 -0.0002193646 0.0001323889 0.0002028691 -0.0002092649 0.0003052071 -0.0005895939 0.0012597607 0.0013335899 -0.0016095964 0.0013487921 -0.0044999217 -0.0005320678 0.0011838572 0.0010420549 -0.0003366008 -0.0011770849 0.0006877939 0.0067528819 -0.0128422908 -0.0131212495 0.0001609679 -0.0001954612 -0.0004015040 -0.0007063425 -0.0018336129 0.0002918848 -0.0020036076 0.0037466592 0.0039339464 0.0003277238 0.0007741964 0.0005387461 -0.0023515294 0.0006782846 -0.0080571117 -0.0021856031 -0.0089925468 0.0028198711 0.0023935566 -0.0031827644 -0.0016124761 0.0088350066 -0.0048691662 0.0377526753 -0.0504556015 -0.0041338984 -0.0056637817 0.0141760906 0.0462103118 -0.0137386309 0.0000275900 0.0001441798 0.0000169422 0.0000918229 -0.0003801425 -0.0004157269 -0.0001154084 0.0026161913 0.0038532895 0.0007378724 -0.0007272023 -0.0002291171 0.0054372654 0.0092302327 0.0021356458 -0.0040211810 -0.0034886945 0.0089362550 -0.0102014760 0.0028432312 -0.0085628136 -0.0000480356 0.0000530000 -0.0000219363 0.0006860335 -0.0004831181 0.0004474230 0.0001354444 -0.0000679148 0.0000136185 0.0002695976 -0.0001766291 0.0002704221 0.0004303126 0.0005026146 0.0002233115 -0.0041333764 0.0019260857 -0.0034541735 -0.0000683569 -0.0001333779 0.0002488117 -0.0000570607 0.0000323067 -0.0000523022 0.0015913107 0.0010572730 -0.0025437878 0.0013511679 0.0013386230 0.0012475742 -0.0110776593 -0.0242113329 0.0092474198 0.0124507746 -0.0042084196 -0.0142836480 -0.0169136643 0.0129556895 -0.0089364315 -0.0047628563 0.0012147231 -0.0011038983 0.0083026138 0.0202613305 -0.0082196541 0.0475697428 -0.0347586928 0.0208097899 0.0005648130 0.0013670020 -0.0007006976 -0.0000982900 0.0003210720 0.0002275853 -0.0064595907 -0.0166594745 0.0075454489 -0.0010505678 -0.0003749924 0.0001710579 0.0068086209 -0.0003543922 -0.0101830616 0.0059651049 0.0043726949 0.0083380660 0.0000229549 0.0000733698 0.0000365806 -0.0002844000 0.0009466314 0.0023613985 0.0092826847 -0.0172631708 -0.0171239899 -0.0054448298 0.0041318624 -0.0129451698 0.0021214915 -0.0143155658 -0.0051341451 0.0234481272 0.0837452252 -0.0304344357 -0.0473453247 0.0887651966 0.0929506069 -0.0008081114 0.0030752767 0.0028448877 -0.0042598340 -0.0063774737 0.0027045772 0.0168767181 -0.0319601109 -0.0338604851 -0.0057776720 -0.0148109419 -0.0039138822 0.0281643967 -0.0081859421 0.0914978607 0.0481556808 0.1745984660 -0.0575705384 -0.0275448243 0.0369386218 0.0202265775 -0.1082030549 0.0573537861 -0.4559418150 0.5895062579 0.0468364656 0.0659770977 -0.1646389013 -0.5335867814 0.1589339079 -0.0000494574 -0.0000354192 -0.0000018642 -0.0000758939 -0.0000609700 -0.0000597737 -0.0000326196 0.0015039951 0.0009939208 0.0002307432 -0.0002552487 -0.0000851994 0.0019286793 0.0032550055 0.0007481066 -0.0013658416 -0.0011704144 0.0030090599 -0.0033295734 0.0009201985 -0.0028012702 -0.0000114553 -0.0000571385 0.0000129628 -0.0001756577 0.0000503064 -0.0002747294 0.0004046385 0.0006991821 0.0001315532 0.0001091511 -0.0001327197 0.0001214298 0.0006532699 0.0006347382 0.0002258243 -0.0022483190 0.0009952773 -0.0017958219 0.0000830427 0.0000635333 0.0000860482 -0.0000378345 -0.0000653165 -0.0000150219 0.0001116833 0.0002105308 -0.0005317551 0.0001594170 0.0002498741 -0.0002599453 -0.0012462675 -0.0028329777 0.0010882381 -0.0013640807 0.0003521363 0.0015116757 0.0006532066 -0.0004567429 0.0004322531 0.0002062505 -0.0001372657 0.0000740415 -0.0002381141 -0.0005907284 0.0005957569 -0.0023305375 0.0018241234 -0.0010976767 -0.0003924779 -0.0004881885 -0.0002055560 0.0031835736 0.0025700906 0.0041204831 0.0015294068 0.0035175704 -0.0017842184 0.0005013801 0.0001808048 0.0001003796 -0.0024859493 0.0000678701 0.0037574282 -0.0032984855 -0.0024198219 -0.0046105457 -0.0000772288 -0.0002342880 -0.0001351392 0.0068401905 -0.0139328681 -0.0214178893 -0.1059852367 0.1983860774 0.2008155341 0.0226690084 -0.0212022896 0.0609856937 -0.0167762538 0.0712305140 0.0373253357 -0.0923872451 -0.3194884851 0.1167767209 0.2987366370 -0.5398164462 -0.5618630533 0.0058700853 -0.0076436432 -0.0100660322 0.0012509000 -0.0116603836 0.0032663481 -0.0697979152 0.1107640608 0.1166516204 -0.0008297555 -0.0077843505 0.0064305561 -0.0150505121 0.0034208417 -0.0477936719 0.0232777695 0.0849319394 -0.0281634982 -0.0078694308 0.0089555148 -0.0023999022 -0.0067000343 0.0035272466 -0.0181881792 0.1293877981 0.0102886096 0.0115901393 -0.0364157795 -0.1178542124 0.0346559195 0.0000587373 0.0001252046 -0.0000567023 0.0002191932 -0.0000469034 -0.0002910335 -0.0001072459 -0.0045368183 -0.0011099538 -0.0000478785 0.0000232932 0.0000425739 -0.0002561382 -0.0004325735 -0.0000970040 0.0003620302 0.0002984479 -0.0007687969 0.0004878686 -0.0001398286 0.0003982255 -0.0000097940 0.0000264735 -0.0000108048 0.0001505540 -0.0000717314 0.0002100036 -0.0001232003 -0.0002602202 -0.0000815544 -0.0001694663 0.0000030152 -0.0001092191 0.0004621850 0.0007456721 -0.0001000850 0.0018857041 -0.0006923003 0.0015395135 0.0001155629 0.0000279011 -0.0001864566 -0.0000193524 -0.0000125524 0.0000145351 -0.0008947942 -0.0004869807 0.0020693834 -0.0008880974 -0.0052796372 -0.0011260108 0.0266476698 0.0581188655 -0.0226049430 -0.0232220288 0.0078371498 0.0284974308 0.0086317109 -0.0073357919 0.0020747770 0.0093843183 -0.0024182524 0.0015116956 -0.0142577867 -0.0347001362 0.0148119480 -0.0910746110 0.0652281977 -0.0372300516 0.0153505531 0.0120594933 0.0200449464 -0.1739949538 -0.1464293812 -0.2338080340 -0.0040430816 -0.0039725931 0.0039752751 -0.0613273495 -0.0195712298 0.0071927909 0.3844256019 -0.0254839053 -0.5590923901 0.3342994781 0.2514361401 0.4791985149 0.0001014429 0.0017505259 0.0007006028 -0.0000437242 -0.0001786094 -0.0013920210 -0.0037687739 0.0065919006 0.0068283920 0.0041001093 -0.0040966653 0.0111943245 0.0001062156 0.0008883718 -0.0000425613 -0.0028231020 -0.0089863337 0.0030067335 0.0014496172 -0.0022555071 -0.0026701128 -0.0003079930 -0.0006292413 0.0004259783 0.0028712829 0.0094144556 -0.0028132002 0.0010160454 -0.0018671217 -0.0016775713 0.0000032953 0.0009034021 -0.0010401100 0.0028705861 -0.0007523879 0.0090179839 -0.0029872400 -0.0101551445 0.0033267048 -0.0001533204 -0.0001910079 -0.0000090127 0.0001607040 -0.0000201645 0.0005208626 0.0008565994 0.0000486198 0.0001197594 0.0007450540 0.0022784438 -0.0005870279 -0.0000037443 -0.0001509298 -0.0004660037 -0.0001686920 -0.0000574392 -0.0000575285 0.0002403108 -0.0024859137 -0.0033123400 0.0000650539 -0.0000933094 -0.0003608534 0.0012568904 0.0022931007 0.0005217967 -0.0015278667 -0.0014022931 0.0034303503 -0.0004403603 0.0002166670 -0.0002525293 -0.0000137796 0.0013170138 -0.0003439332 0.0074885297 -0.0031083642 0.0069537607 -0.0070619403 -0.0130364055 -0.0020561108 -0.0000662973 -0.0000430424 -0.0000013911 -0.0001208089 0.0000964264 -0.0002800548 0.0005022551 -0.0000081561 -0.0000809852 0.0002650526 0.0007725494 -0.0004460665 -0.0000425625 -0.0002414992 -0.0001470734 -0.0026970449 -0.0029941099 0.0043729566 -0.0000190261 -0.0001802131 0.0000140405 0.0008845565 0.0020027041 -0.0007033972 -0.0005615023 0.0002165696 0.0006498315 0.0000265688 -0.0000858426 -0.0000727728 0.0001751681 0.0004448338 -0.0001777573 -0.0019869535 -0.0045753403 0.0020251655 0.0001729031 -0.0001500670 0.0001261321 -0.0017597948 -0.0024800918 -0.0010463919 0.0153667830 0.0126209861 0.0203740974 0.0059751824 0.0167759641 -0.0077332286 -0.0020201275 -0.0004820010 0.0007042716 0.0144360012 -0.0008778503 -0.0210612686 0.0087813167 0.0065836814 0.0126676562 0.0001955506 -0.0001647028 -0.0002516821 -0.0021409340 0.0049961632 0.0071816207 0.0337892871 -0.0660325434 -0.0672786597 -0.0098431002 0.0077103146 -0.0218984563 0.0031206591 -0.0100340418 -0.0056897117 0.0107327630 0.0402579615 -0.0164047115 -0.0459563202 0.0824266922 0.0852387417 0.0290728015 0.0149799067 -0.0433961844 -0.1434010312 -0.5185651707 0.1706311669 -0.2018359455 0.3331831329 0.3435154750 0.0037336590 -0.0313791154 0.0473077550 -0.1497066040 0.0389737005 -0.4548569761 0.0978795709 0.3382354653 -0.1082378687 0.0011646162 0.0032611086 -0.0063930240 0.0186121742 -0.0092314113 0.0747428052 -0.0222963843 -0.0011999927 -0.0041175559 -0.0092107150 -0.0310344295 0.0079772907 0.0001566376 0.0001718673 0.0001621376 0.0000780699 -0.0000473785 0.0001977048 -0.0002576907 0.0010502910 0.0004874033 -0.0000011531 0.0000219704 0.0000347949 -0.0002401760 -0.0004073296 -0.0000940547 0.0001878884 0.0001583532 -0.0004149208 0.0001007397 -0.0000312758 0.0000907480 -0.0000128389 0.0001505502 -0.0000570884 0.0009648993 -0.0003480434 0.0009571887 -0.0008646464 -0.0015394496 -0.0002294323 0.0000872112 0.0001164641 0.0000239462 -0.0009711111 -0.0013314603 -0.0002837237 0.0001914121 -0.0001178819 0.0000349867 -0.0000803247 -0.0000191867 -0.0000533689 0.0000296653 0.0000436757 -0.0000002382 -0.0001054558 -0.0002391719 0.0003626031 -0.0019495093 0.0012788438 -0.0012267289 -0.0019178733 -0.0047025876 0.0000564062 0.0007426133 -0.0002776191 -0.0006948947 0.0203688175 -0.0150353711 0.0104674685 0.0068269518 -0.0126253238 0.0066501267 0.0357563297 0.0797242466 -0.0309989049 -0.1114885745 0.0779834038 -0.0470402923 0.0473169318 0.0596679794 0.0366360375 -0.4444172447 -0.3690603890 -0.5927980827 -0.1263280851 -0.3432803251 0.1592648314 0.0210931974 0.0039223600 -0.0133947145 -0.1784681440 0.0086596012 0.2584325762 -0.0667137984 -0.0474898305 -0.0966495823 0.0002118472 -0.0003909244 -0.0001650346 0.0000130060 0.0001947138 0.0006316749 0.0019856967 -0.0037505247 -0.0038668709 -0.0018019269 0.0014708876 -0.0042827900 -0.0000098415 -0.0002615746 0.0000710007 0.0007754078 0.0032295703 -0.0013785131 -0.0003794186 0.0005304819 0.0005476786 0.0013235382 0.0003595167 -0.0020290206 -0.0061718174 -0.0218257536 0.0074478531 -0.0098757088 0.0163985694 0.0168920371 0.0000279544 -0.0014240215 0.0017952254 -0.0054376399 0.0012722677 -0.0163552587 0.0047333633 0.0159397235 -0.0052157370 -0.0000707846 0.0004452925 -0.0003058929 0.0005625793 -0.0001454310 0.0020805233 0.0018862395 0.0001675324 0.0000757151 -0.0016505381 -0.0053277789 0.0016892981 -0.0001597173 -0.0002307315 -0.0000673618 0.0000147347 -0.0003038204 -0.0002311760 -0.0007108889 0.0040126849 0.0037250533 0.0000101094 0.0002743585 0.0000197346 -0.0015885727 -0.0027800271 -0.0006582841 0.0000958779 0.0000398858 -0.0001214482 0.0012145405 -0.0003393992 0.0008794992 -0.0001030942 -0.0020384970 0.0004636862 -0.0107432483 0.0034246059 -0.0096513147 0.0117877266 0.0210457696 0.0039929105 -0.0000039044 0.0000181484 -0.0000447750 0.0000471387 -0.0001899593 0.0000584227 -0.0000454923 -0.0000144153 0.0002779252 0.0002023948 0.0000536835 -0.0000239569 -0.0000313869 -0.0000893729 0.0000360684 -0.0010479172 -0.0000670483 0.0008538227 0.0000161905 0.0000026762 0.0000554721 -0.0000939596 -0.0002098231 0.0000760446 0.0004435754 -0.0001560122 -0.0005043389 -0.0005646371 0.0004139184 -0.0003036212 0.0000979793 0.0000670774 -0.0000403709 -0.0007571070 -0.0018068029 0.0006112737 -0.0005892252 0.0005715234 -0.0002538825 0.0002470884 0.0002915057 0.0002147943 -0.0023825074 -0.0019660539 -0.0032402654 -0.0005019026 -0.0015414690 0.0006841866 -0.0000406455 -0.0000789088 -0.0000380571 0.0002952922 0.0000579130 -0.0003132539 0.0006170437 0.0004648659 0.0008896334 -0.0002106527 0.0001129067 0.0001021268 0.0056060988 -0.0128385715 -0.0185956012 -0.0892813501 0.1679958248 0.1719664800 0.0233001640 -0.0178854833 0.0552036827 0.0006262338 -0.0054830826 -0.0032736485 0.0082351329 0.0308632751 -0.0117945105 -0.0231428829 0.0384156752 0.0392418515 -0.0240158325 -0.0004542310 0.0374238201 0.0874466754 0.3162339798 -0.1021392017 0.1951197442 -0.3151156983 -0.3303560310 0.0089088956 -0.0334289999 0.0587469759 -0.2005601306 0.0503640542 -0.5868834485 0.1035483286 0.3531061657 -0.1138937299 0.0008606156 0.0044994999 -0.0109167601 0.0294731697 -0.0144338989 0.1182466296 -0.0209110569 0.0014329521 -0.0038197101 -0.0156732858 -0.0434581286 0.0134042096 -0.0001083674 -0.0000173946 -0.0001611835 -0.0001217843 0.0005946592 0.0002920336 0.0028789337 -0.0069421445 -0.0061391954 -0.0000519326 -0.0000687783 -0.0000066203 0.0003489519 0.0006130513 0.0001949308 0.0001464893 0.0001682433 -0.0003190784 0.0001955664 -0.0000733966 0.0001982920 0.0001546876 0.0008379648 -0.0000916847 0.0033442017 -0.0008424918 0.0029370069 -0.0050547676 -0.0089277989 -0.0019188974 -0.0003126159 -0.0002736988 -0.0001138744 0.0024257879 0.0035808139 0.0006819867 0.0008344434 -0.0002831263 0.0008353403 0.0000778190 -0.0000107505 0.0000094581 -0.0000311913 -0.0000030329 0.0000061530 0.0002083916 0.0001456715 -0.0001073486 -0.0002951799 -0.0001087832 0.0003898250 0.0009442694 0.0019650989 -0.0007183926 0.0030357488 -0.0009695684 -0.0035197227 -0.0005294103 0.0006151397 -0.0002903913 -0.0002459424 0.0002114950 -0.0000949557 -0.0001698747 0.0004007290 -0.0003259427 0.0030362951 -0.0023755650 0.0013448423 0.0002200349 0.0004530061 -0.0000107137 -0.0015628185 -0.0011936396 -0.0019731543 -0.0015587172 -0.0047878770 0.0021570022 0.0010202547 0.0005211850 0.0009745064 -0.0017308057 0.0001255522 0.0026314816 -0.0091724310 -0.0067863811 -0.0130521222 -0.0002805235 -0.0006216632 -0.0014235313 0.0197927981 -0.0430371805 -0.0628974704 -0.3072577123 0.5670301424 0.5794196172 0.0711911209 -0.0571507590 0.1822117901 0.0056219185 -0.0233368384 -0.0134484587 0.0303280184 0.0962044428 -0.0334937236 -0.1026527479 0.1818026276 0.1873153925 0.0080211404 0.0082841439 -0.0115610703 -0.0501597166 -0.1738639727 0.0573355350 -0.0435501723 0.0749025348 0.0807626034 -0.0019208167 0.0087102354 -0.0138766753 0.0471002898 -0.0116480030 0.1366775200 -0.0267920948 -0.0914190249 0.0297547741 0.0019822502 -0.0031472354 0.0049524538 -0.0104063709 0.0051818202 -0.0462410027 -0.0242043134 -0.0026530285 -0.0011926538 0.0116173988 0.0347671392 -0.0104187514 0.0001630403 0.0007790648 0.0002788385 -0.0004581007 0.0017013908 0.0017166923 0.0098124543 -0.0222910257 -0.0195425939 -0.0007935566 -0.0017484376 0.0015573344 0.0064463992 0.0109594391 0.0029182626 0.0081721430 0.0075615775 -0.0184665939 -0.0041377047 0.0007010690 -0.0030240825 0.0010207267 0.0103317602 -0.0020290860 0.0503655513 -0.0126708315 0.0452512001 -0.0624517002 -0.1092735489 -0.0223943097 -0.0017252144 -0.0014249062 -0.0006502190 0.0140947785 0.0192942471 0.0035871037 0.0059544160 -0.0025959255 0.0054111831 0.0003975730 0.0002346623 -0.0002813562 -0.0001600597 -0.0000939122 0.0000885968 -0.0010831661 -0.0009845263 0.0032283018 -0.0000739973 0.0001580365 -0.0000103101 -0.0005462245 -0.0012902934 0.0004439534 0.0006101060 -0.0002060242 -0.0007559656 0.0007158789 -0.0004737554 0.0003852104 0.0000662766 -0.0005932992 0.0002834363 0.0022287406 0.0050451761 -0.0020085025 -0.0030593227 0.0021219174 -0.0013047771 0.0009711799 0.0013151630 0.0006356264 -0.0090132769 -0.0071930481 -0.0118352284 -0.0030040167 -0.0087237038 0.0039754078 0.0014050272 0.0004050222 -0.0006385946 -0.0115980611 0.0017637492 0.0169367875 -0.0056861850 -0.0052375144 -0.0094597341 -0.0001719667 0.0004742611 0.0007702220 -0.0030652351 0.0066085758 0.0094417229 0.0465143776 -0.0864110074 -0.0883632373 -0.0101728654 0.0082137636 -0.0260402110 -0.0008709324 0.0034040366 0.0020641498 -0.0041621273 -0.0131667156 0.0046192191 0.0154613231 -0.0273647828 -0.0281603384 -0.0009237263 -0.0012369601 0.0012994640 0.0064703159 0.0224619722 -0.0074214130 0.0042747241 -0.0076567040 -0.0083122296 0.0001515097 -0.0009268011 0.0013241926 -0.0043812749 0.0010658167 -0.0127227790 0.0028845052 0.0098041017 -0.0032306016 -0.0002758874 0.0004809230 -0.0005887091 0.0010750549 -0.0005284278 0.0050046183 0.0038927801 0.0003815778 0.0002070395 -0.0017977750 -0.0054723058 0.0016220064 -0.0000907180 -0.0003577543 -0.0003019764 0.0000208276 -0.0002976134 -0.0004824449 -0.0013725751 0.0038357200 0.0032583919 -0.0074914620 -0.0132536071 0.0093393487 0.0562101824 0.0950640898 0.0238786182 0.0554518190 0.0511301840 -0.1266759164 -0.0150129970 0.0007504354 -0.0094351633 0.0062034888 0.0680645631 -0.0139367915 0.3383209098 -0.0836916694 0.3038842285 -0.4142755623 -0.7220128004 -0.1459569808 -0.0058940698 -0.0053711489 -0.0021430384 0.0562954628 0.0712764402 0.0150091232 0.0185851494 -0.0108945020 0.0164223557 -0.0002780528 0.0013827818 0.0003993724 -0.0004226389 -0.0005934973 0.0003297904 0.0050096535 0.0007856433 -0.0067742778 -0.0293744200 -0.0309691995 0.0454093377 0.1751531591 0.3897073507 -0.1486385334 0.3026153736 -0.1063018776 -0.3358941636 -0.1292650417 0.0869762218 -0.0554323203 0.0052948352 0.0596097348 -0.0266017373 -0.2627641621 -0.5763403614 0.2397496846 0.2015634053 -0.1409509354 0.0838139643 0.0053660286 0.0094899754 0.0005757480 -0.0330156153 -0.0289197373 -0.0463865206 -0.0308721713 -0.0790160285 0.0348785156 0.0022537240 -0.0007686574 -0.0052682606 -0.0344615414 0.0017259275 0.0492855069 0.0103005484 0.0063927089 0.0121114663 0.0000855237 -0.0002207443 -0.0001995263 -0.0000926685 0.0000777359 0.0005261183 0.0014713332 -0.0024771692 -0.0026132012 -0.0012229767 0.0012153231 -0.0034673953 -0.0001790524 0.0002722160 0.0003612515 0.0002798670 0.0005504146 -0.0002620660 0.0021161407 -0.0037558920 -0.0038786247 0.0000588132 -0.0002202895 -0.0001094343 0.0003261387 0.0011739366 -0.0003132125 -0.0010964054 0.0016747841 0.0017557695 -0.0000190903 0.0001360138 -0.0001605462 0.0004811384 -0.0002157280 0.0014960903 -0.0001662404 -0.0011817666 0.0003488016 0.0016203482 0.0014585652 -0.0006329547 0.0013396052 -0.0003167667 0.0047152682 -0.0155778930 -0.0009082486 -0.0018978111 -0.0049642188 -0.0161337980 0.0046731757 -0.0000221846 0.0000507384 0.0000550924 -0.0006209789 0.0018651755 0.0013395898 0.0034713867 -0.0189855726 -0.0163372352 0.0002611046 -0.0000930848 0.0006046736 -0.0007594241 -0.0014131653 -0.0002345431 0.0016863482 0.0014334493 -0.0035483134 -0.0040704769 0.0011270690 -0.0033817020 -0.0000544923 0.0000548450 -0.0000700819 0.0010301256 -0.0001448438 0.0008595559 -0.0002719662 -0.0004369177 -0.0001603598 0.0000292013 -0.0000701433 0.0000277074 0.0004907292 0.0005811640 0.0001951258 -0.0010372528 0.0004796301 -0.0006517993 -0.0000036084 -0.0000135202 0.0002034987 -0.0000254961 -0.0000428808 -0.0000306065 0.0010411126 0.0008162117 -0.0017470929 -0.0004244522 -0.0001600983 0.0004036465 0.0014727298 0.0033026366 -0.0012498702 0.0033276802 -0.0011408828 -0.0037293175 0.0001647064 -0.0002098113 0.0002136716 0.0000189420 0.0003214691 -0.0001475963 -0.0014271080 -0.0030335292 0.0013022868 0.0011830793 -0.0008325058 0.0005299377 0.0000837487 0.0001242377 0.0000594545 -0.0006905837 -0.0005907874 -0.0009441211 -0.0003083282 -0.0007921366 0.0003275374 0.0002856929 0.0002834958 0.0007109193 0.0017486413 -0.0004598724 -0.0022125882 -0.0046961395 -0.0032319114 -0.0063770679 0.0001138213 -0.0001691583 -0.0004328030 -0.0000146383 -0.0000277214 -0.0002275138 -0.0006502554 0.0010054664 0.0009126838 0.0006487672 -0.0004273534 0.0016690253 0.0000144625 -0.0000132416 -0.0000247659 -0.0000122651 -0.0001066364 0.0000378908 -0.0001397964 0.0002529412 0.0002728103 0.0000570380 0.0001319329 -0.0000767234 -0.0005341791 -0.0018578399 0.0006004724 -0.0001243321 0.0002934762 0.0002585659 -0.0000097451 0.0000448079 -0.0000663496 0.0002484981 -0.0000615874 0.0006819181 -0.0001383760 -0.0004595256 0.0001520266 0.0000452679 -0.0000412291 0.0000788088 -0.0001509045 0.0000849856 -0.0007446292 -0.0005431483 -0.0000447317 -0.0000438199 0.0001470362 0.0004462632 -0.0001261281 -0.0000169120 0.0001475311 0.0002026740 0.0000808607 -0.0000764344 0.0001989042 -0.0002682261 0.0003657459 0.0002327366 -0.0463761711 -0.0084499584 -0.0779093946 0.2283797215 0.4083423686 0.0809872516 -0.1997667082 -0.1629969976 0.4078579467 0.5273272955 -0.1469251173 0.4393588471 0.0135223434 0.0057578900 0.0096748710 -0.1123951380 0.0320559701 -0.1045933386 -0.0554452622 -0.0981248552 -0.0173405142 -0.0025661929 -0.0032582112 -0.0006525504 0.0316448965 0.0392137956 0.0075642539 0.0021818455 -0.0023299873 0.0045775752 -0.0004117688 0.0000769295 0.0002924636 0.0000089879 0.0000166517 0.0000382587 0.0025959967 0.0006119177 -0.0029229718 0.0027593975 0.0012314830 -0.0026523933 -0.0106427071 -0.0236355444 0.0087294010 -0.0210971041 0.0072680491 0.0239209810 -0.0013223681 0.0015496350 -0.0012930403 0.0004689431 0.0028007275 -0.0012339506 -0.0126173387 -0.0279668899 0.0114580880 0.0076688334 -0.0053763522 0.0032647832 -0.0000406412 0.0001046531 -0.0002042739 0.0014695113 0.0007723393 0.0016289592 -0.0009273217 -0.0017644611 0.0010282974 -0.0002063546 -0.0008845771 -0.0028597921 -0.0107714989 0.0003831325 0.0152757934 0.0134330336 0.0105670668 0.0188299749 0.0000787247 -0.0001034240 -0.0000826968 -0.0005127001 0.0009355497 0.0005948308 0.0022992527 -0.0076337547 -0.0083425652 0.0011776070 0.0000433449 0.0008190126 -0.0000042283 0.0001412965 0.0000102994 -0.0001781096 -0.0006322923 0.0001984189 0.0005981172 -0.0010103309 -0.0009333895 0.0000556193 -0.0004771853 -0.0001558722 0.0008828136 0.0029090574 -0.0010129719 -0.0017116058 0.0027525690 0.0029160354 0.0000062616 -0.0000155414 0.0000173249 -0.0001123333 0.0000273783 -0.0002253590 0.0000385718 0.0001037009 -0.0000208530 0.0002159571 0.0001901047 -0.0000985211 0.0002357630 -0.0000817211 0.0008525475 -0.0022311857 -0.0001274570 -0.0002519945 -0.0006126380 -0.0020398811 0.0005952716 0.0000317891 0.0000280715 0.0000992438 -0.0002321130 0.0003149307 0.0002908687 0.0005485335 -0.0031207355 -0.0024735661 0.0080534333 0.0061571467 0.0023471700 -0.0442908992 -0.0739731654 -0.0154888932 -0.0109052785 -0.0087089294 0.0277189386 -0.0422502109 0.0128440700 -0.0366731016 0.0076499982 -0.0040155330 0.0063464919 -0.1016263084 0.0279196534 -0.0877147146 0.0139119247 0.0209205686 0.0016056290 -0.0579505310 -0.0587443102 -0.0206311314 0.6006076717 0.7402684245 0.1596275892 0.1035958954 -0.0554255792 0.0905505451 -0.0027215780 -0.0008342066 0.0020930005 0.0001704230 0.0006546420 -0.0001589980 0.0162292812 0.0057629651 -0.0205288462 -0.0472633050 -0.0225252820 0.0461646167 0.1887958859 0.4198298853 -0.1547064800 0.3631279966 -0.1253747636 -0.4103865644 0.0153050655 -0.0221955966 0.0186352192 -0.0092930931 -0.0519929677 0.0229095589 0.2368252390 0.5208355571 -0.2138721656 -0.1385526030 0.0980465746 -0.0590108042 -0.0036651550 -0.0072475034 -0.0003894435 0.0223547319 0.0217185919 0.0326242723 0.0261571084 0.0626637438 -0.0315955413 -0.0003930595 0.0025845631 0.0096347584 0.0436238381 -0.0020178037 -0.0622599359 -0.0386912328 -0.0294443021 -0.0536419024 -0.0001690175 0.0000544007 0.0005078423 0.0000210627 0.0001420866 0.0000095128 0.0003989015 -0.0013931326 -0.0011356819 0.0001404405 -0.0001466879 0.0004925209 0.0000015079 -0.0000073231 -0.0000019089 -0.0000298200 0.0002215510 -0.0001179550 0.0000169521 0.0000866902 0.0000624989 0.0000022976 -0.0007489539 -0.0000348786 0.0019851340 0.0064486629 -0.0022549977 -0.0015248476 0.0023014724 0.0024586047 -0.0002135212 -0.0007977942 0.0003534939 -0.0004384703 0.0002142988 -0.0015029323 0.0023058972 0.0084971908 -0.0027752767 -0.0077662604 -0.0053428072 -0.0000173635 0.0012159849 -0.0018879465 0.0100932526 0.0736444501 0.0048844665 0.0081567442 0.0176899416 0.0610194782 -0.0179065576 0.0000622763 -0.0000215900 -0.0001498661 0.0006663384 -0.0018287634 -0.0015239101 -0.0042837170 0.0204741265 0.0171584275 0.0014810815 0.0015502008 -0.0003085262 -0.0090854794 -0.0156420854 -0.0035681743 -0.0047290328 -0.0039750069 0.0108321425 -0.0038884370 0.0013306127 -0.0034850122 0.0003189892 -0.0001989722 0.0002583854 -0.0045269052 0.0010014104 -0.0037711606 0.0010190417 0.0013680605 0.0001743784 -0.0033255859 -0.0033273917 -0.0011837637 0.0341397792 0.0422206901 0.0091199358 0.0065430597 -0.0034558116 0.0054419530 -0.0004334615 -0.0003332142 0.0001768862 0.0000809824 0.0002208371 0.0000014406 0.0020367632 0.0010572816 -0.0024335528 0.0074486577 -0.0103553283 0.0033537495 0.0252339744 0.0524444498 -0.0199809382 -0.0228835603 0.0065737369 0.0275319774 -0.0870571284 0.0643090633 -0.0468724050 -0.0010068306 -0.0065342615 0.0031125134 0.0291208271 0.0639940126 -0.0264855901 -0.0219586242 0.0151939566 -0.0098556317 -0.0052995459 -0.0054941863 -0.0062160648 0.0619842019 0.0475103531 0.0787737875 0.0059838202 0.0161222646 -0.0066720432 -0.0027837791 -0.0221059854 -0.0757445034 -0.3101578061 0.0158112818 0.4416896361 0.3408718875 0.2501068829 0.4697239336 0.0005356342 -0.0009602891 -0.0017886147 0.0000471446 -0.0002382880 -0.0002672876 -0.0011336867 0.0034439486 0.0030670335 0.0000366251 0.0001611531 -0.0001997404 -0.0001700921 0.0016672848 0.0004825697 -0.0023684232 -0.0102681432 0.0038563587 0.0042376172 -0.0088223348 -0.0090776871 -0.0009437259 0.0163554930 0.0030876484 -0.0342654043 -0.1210341816 0.0420574051 0.0464618907 -0.0728090344 -0.0793045236 -0.0006369882 -0.0006694532 -0.0006693180 0.0037352003 -0.0008927838 0.0103662357 0.0008679281 0.0075504569 -0.0021219706 -0.0257399163 -0.0174188558 -0.0018561200 0.0088440620 -0.0090905008 0.0554235309 0.2412837322 0.0164366884 0.0265337196 0.0575680211 0.1998394557 -0.0600749777 -0.0003092298 0.0004241891 0.0007455684 -0.0001422670 0.0004827314 0.0005726411 0.0010519774 -0.0062395346 -0.0029664048 -0.0177229561 -0.0232663735 0.0127678880 0.1181121064 0.2061131269 0.0495691137 0.0925161136 0.0764481209 -0.2047253797 -0.0001351822 -0.0035892521 0.0035716987 0.0018897490 -0.0044320220 0.0029247094 -0.0444224476 0.0128060172 -0.0405238656 0.0205515433 0.0369579068 0.0075254675 0.0002504170 0.0001450332 0.0000664929 -0.0003457280 -0.0010816366 -0.0008498101 -0.0026222095 0.0012989250 -0.0020745777 0.0005790365 0.0003327973 -0.0003333102 -0.0001769836 -0.0000585850 -0.0002072568 -0.0031203847 -0.0019505065 0.0039988122 -0.0003412366 -0.0061370094 0.0047727890 0.0253759312 0.0546511080 -0.0202930792 0.0162355248 -0.0062381809 -0.0177262315 -0.0351419585 0.0251395480 -0.0183004805 -0.0015933172 -0.0092548862 0.0041598791 0.0417192686 0.0921018212 -0.0380020907 -0.0264256874 0.0183949263 -0.0113518282 -0.0030837046 -0.0035963871 -0.0031104177 0.0333424344 0.0260860696 0.0429322142 0.0063001066 0.0158003120 -0.0071481051 -0.0014020524 -0.0104108867 -0.0356385104 -0.1454679758 0.0074770549 0.2071895901 0.1609400634 0.1179587686 0.2216981374 0.0001178479 -0.0004781014 -0.0009053101 0.0002434534 -0.0007654792 -0.0012320953 -0.0062468474 0.0103476313 0.0104116628 0.0020199611 -0.0011499271 0.0052974455 0.0004690589 -0.0039358449 -0.0012935961 0.0054040873 0.0225766065 -0.0083543569 -0.0108807140 0.0221051291 0.0227713398 0.0022710999 -0.0357448662 -0.0071040017 0.0738081551 0.2612441010 -0.0911727401 -0.1031789889 0.1622495631 0.1765353178 0.0016490315 0.0021478625 0.0013376100 -0.0082698425 0.0019850824 -0.0232943005 -0.0041073794 -0.0241991053 0.0071747902 0.0635901171 0.0420476941 0.0058924830 -0.0248828407 0.0238574189 -0.1497669200 -0.5964420697 -0.0408334318 -0.0652979093 -0.1388510767 -0.4835512157 0.1454527416 -0.0001036332 0.0002611764 0.0003366238 -0.0000587280 0.0000350709 0.0001244391 0.0001762049 -0.0005060323 0.0004496791 0.0015190079 0.0023462734 -0.0016848099 -0.0110067690 -0.0191488554 -0.0047263023 -0.0103003146 -0.0084358819 0.0224847720 0.0033474294 -0.0005974994 0.0023604577 -0.0002000167 0.0004645695 -0.0003057327 0.0047388641 -0.0010682641 0.0042375169 -0.0022921718 -0.0040686478 -0.0008511681 0.0006710723 0.0007403243 0.0002114350 -0.0078009774 -0.0093467401 -0.0019841605 -0.0009240667 0.0005593374 -0.0004542362 0.0002426934 0.0002340711 -0.0001502759 -0.0000892867 -0.0000634300 -0.0000850990 -0.0012867391 -0.0009163608 0.0015956246 0.0036724208 -0.0032767168 0.0003248669 0.0051234478 0.0099948389 -0.0039443353 -0.0152663944 0.0047977361 0.0178435707 -0.0323153204 0.0241503938 -0.0175823546 -0.0001491837 -0.0010600460 0.0005486340 0.0045523105 0.0102641862 -0.0042454357 -0.0042841990 0.0028667597 -0.0019956572 -0.0016810574 -0.0015722646 -0.0021785942 0.0205835844 0.0157462677 0.0260500446 0.0008852568 0.0022329208 -0.0007619055 -0.0006295233 -0.0077356774 -0.0269922330 -0.1128795699 0.0061377045 0.1609465424 0.1192320158 0.0871253460 0.1637764270 0.0001301178 -0.0001708604 -0.0005011347 -0.0000642936 0.0000735852 0.0000819863 0.0007410913 -0.0008426424 -0.0010335197 -0.0000608461 0.0000426221 -0.0000298822 -0.0001148043 0.0007772058 0.0002899773 -0.0010039078 -0.0042950803 0.0016440684 0.0023556506 -0.0046910588 -0.0048066461 -0.0004169946 0.0071370165 0.0013626550 -0.0148961489 -0.0526040698 0.0182836923 0.0203286995 -0.0319229002 -0.0347876441 -0.0003275303 -0.0003652019 -0.0003311573 0.0019167087 -0.0004601494 0.0052778243 0.0006229415 0.0041589569 -0.0012234058 -0.0119817689 -0.0080792994 -0.0008481358 0.0040341722 -0.0041934124 0.0255070147 0.1125463995 0.0076729873 0.0123525186 0.0266579222 0.0926836056 -0.0278682501 -0.0001504027 0.0000445823 0.0002014203 -0.0000064620 0.0000768380 0.0001160546 0.0001527232 -0.0013970499 -0.0004403557 0.0460550485 0.0620145474 -0.0360846414 -0.3100381896 -0.5410010491 -0.1307314726 -0.2523609489 -0.2080705361 0.5568121973 0.0158616132 0.0050822229 0.0030932831 -0.0051493450 0.0122359387 -0.0080144319 0.1226556578 -0.0334492732 0.1113387033 -0.0579800089 -0.1036858197 -0.0211874240 0.0031313438 0.0035085749 0.0010872204 -0.0395786273 -0.0467021517 -0.0084057495 -0.0012915833 0.0010182503 0.0005026674 0.0002458709 0.0007244304 -0.0000869859 -0.0001764721 -0.0003735174 -0.0000097127 -0.0006247829 -0.0009062062 0.0006477693 -0.0027202031 -0.0003601041 0.0017333770 0.0076012390 0.0169823101 -0.0060670142 0.0170692492 -0.0059351468 -0.0194568162 0.0080446727 -0.0064434983 0.0047462302 -0.0004875233 -0.0028588007 0.0012947915 0.0130320859 0.0290729818 -0.0119689418 -0.0075028543 0.0050972241 -0.0031318604 -0.0000192482 -0.0002511225 0.0003245792 -0.0015447726 -0.0010565030 -0.0016406181 0.0017595784 0.0040991514 -0.0021733974 -0.0002027293 0.0004161791 0.0018145793 0.0090364432 -0.0004375746 -0.0128575497 -0.0067109618 -0.0049852954 -0.0090760311 0.0001754617 0.0001473769 0.0004125041 -0.0006540370 0.0016221467 0.0022839268 0.0138426573 -0.0210341316 -0.0216851699 -0.0030422416 0.0019010673 -0.0083750019 -0.0019370561 0.0127641495 0.0044690235 -0.0170252635 -0.0725968268 0.0269422988 0.0387585136 -0.0748648363 -0.0793597047 -0.0056769058 0.0804387101 0.0157815601 -0.1732815087 -0.5917349687 0.2077002062 0.2328487572 -0.3668679694 -0.3956444724 0.0028386842 0.0105112636 -0.0038432184 0.0038229633 -0.0020000969 0.0094857833 -0.0369342037 -0.1171883663 0.0389976499 0.0339581707 0.0204226697 0.0054364873 -0.0195583254 0.0157630610 -0.1051450169 -0.3161936448 -0.0230132623 -0.0338948558 -0.0663772113 -0.2432336694 0.0714349399 -0.0000551952 -0.0001942608 -0.0000894588 0.0004003997 -0.0005570255 -0.0004899279 -0.0021849011 0.0056076715 0.0048700524 0.0002528447 0.0003124076 -0.0000080598 -0.0019324408 -0.0033876716 -0.0007711477 -0.0005537441 -0.0004902510 0.0013190029 -0.0004631796 0.0001476610 -0.0004440884 -0.0000317786 -0.0000179536 -0.0000287352 0.0001783441 -0.0000514358 0.0003251941 0.0001107742 0.0002106919 0.0000606325 -0.0003787343 -0.0003221425 -0.0001561595 0.0035803877 0.0043800139 0.0009340584 0.0015553474 -0.0007644887 0.0010939004 -0.0001599678 -0.0000697383 -0.0000450811 0.0000449671 0.0000603320 0.0000079211 0.0003006179 -0.0000411367 0.0000201118 -0.0006460570 0.0004808346 -0.0000749617 -0.0003156387 -0.0005607276 0.0003701354 0.0022180394 -0.0006661094 -0.0026198187 0.0060137589 -0.0043636311 0.0031505674 -0.0003929244 -0.0009549014 0.0004103477 0.0049745293 0.0113918381 -0.0049380692 -0.0004869529 0.0000349803 -0.0000947082 -0.0002085525 -0.0002468649 -0.0001774540 0.0018927614 0.0016482940 0.0027006359 0.0005544843 0.0011900228 -0.0005585402 -0.0000335825 -0.0001424332 -0.0004463495 -0.0017596370 0.0000539027 0.0025273082 0.0021852506 0.0015714466 0.0030236670 0.0000143789 -0.0000296987 -0.0001403657 0.0002562060 -0.0004789299 -0.0007271947 -0.0041687648 0.0065620405 0.0067646428 0.0012370245 -0.0008014396 0.0027358189 0.0015130284 -0.0041095973 -0.0033223585 0.0030498999 0.0076158588 -0.0027487873 -0.0255045630 0.0425172221 0.0432442784 0.0006713726 0.0023572392 -0.0007836944 -0.0099738470 -0.0279307668 0.0095581503 0.0013989961 -0.0022239351 -0.0014480269 -0.0016255819 0.0085667764 -0.0131390716 0.0400241022 -0.0100759600 0.1254637436 -0.0228095543 -0.0880838157 0.0285704000 -0.0194498016 0.0422027698 -0.0789739225 0.1856646510 -0.0912886039 0.8122453825 0.1876523048 0.0197679270 0.0110123586 -0.1349342677 -0.4341297048 0.1184151513 0.0000060900 0.0000381949 0.0000689121 -0.0000124793 -0.0000420728 0.0000541405 0.0000755261 0.0004128181 0.0001894939 -0.0000177508 0.0000343210 -0.0001211910 0.0000543362 0.0001120412 0.0000040411 -0.0004607483 -0.0003658904 0.0009764017 0.0006361310 -0.0001725594 0.0005147357 -0.0001399761 -0.0000274267 -0.0001129690 0.0012483526 -0.0003293082 0.0011641196 0.0003923652 0.0006967611 0.0001471034 0.0000113132 0.0000249007 0.0000034906 -0.0002148768 -0.0002935678 -0.0000774856 0.0000396053 -0.0000173411 0.0000723652 0.0000569294 0.0000453903 -0.0000516229 -0.0000111643 -0.0000212862 0.0000034102 -0.0004247551 -0.0002613963 0.0006314325 0.0631624465 -0.0636208276 0.0148533048 0.1112934857 0.2205771511 -0.0867146639 -0.2223554862 0.0689236017 0.2556058881 -0.6424836291 0.4739643424 -0.3398778578 0.0040194008 -0.0119095247 0.0056971095 0.0362503452 0.0808942142 -0.0318106411 -0.0832340706 0.0568716964 -0.0382768887 0.0004247394 -0.0000328565 0.0015142969 -0.0090911143 -0.0065090664 -0.0114083089 0.0041586522 0.0081194220 -0.0049013896 0.0026427148 0.0049650310 0.0145914112 0.0476855323 -0.0025244181 -0.0684607370 -0.0783415937 -0.0584457852 -0.1113651241 -0.0000821650 0.0002119057 0.0002931739 0.0000285614 0.0000934581 -0.0000622775 0.0002678338 -0.0011161609 -0.0007342024 0.0002327470 -0.0003171309 0.0009224705 0.0000266114 0.0001314479 -0.0000234782 -0.0004080689 -0.0013777809 0.0004551991 0.0000411300 -0.0000737226 -0.0001673442 -0.0000205960 0.0003578500 0.0000622059 -0.0007615908 -0.0027451916 0.0010355621 0.0010061771 -0.0016328940 -0.0016980457 0.0000395093 0.0001553021 -0.0000879527 0.0000935200 -0.0000420361 0.0004351733 -0.0005420596 -0.0017790409 0.0006201019 0.0003077497 0.0006406464 -0.0005877520 0.0013433579 -0.0005473542 0.0053798828 -0.0029976758 -0.0001916330 -0.0003872527 -0.0019896232 -0.0070436708 0.0020179966 0.0000514220 -0.0001267150 -0.0001328565 0.0003618656 -0.0012948061 -0.0009378690 -0.0042542944 0.0145660436 0.0102801418 -0.0000110023 -0.0000241712 0.0000790232 -0.0000237861 -0.0000341898 0.0000172704 0.0003725572 0.0002947286 -0.0007808253 -0.0001874241 0.0000554021 -0.0001437636 0.0001957050 0.0000299846 0.0001527580 -0.0019574672 0.0005126543 -0.0016687061 -0.0004473024 -0.0008520351 -0.0002404062 -0.0001781295 -0.0001240366 -0.0000624454 0.0017121586 0.0024049739 0.0005609171 0.0010544961 -0.0005214241 0.0005848363 -0.0004540322 -0.0004883040 0.0001104268 0.0001224546 0.0002391536 0.0000659383 0.0018082615 0.0010849556 -0.0020043195 -0.0001359312 0.0001633261 -0.0000647428 -0.0003403152 -0.0007035904 0.0002782314 0.0003344194 -0.0000961331 -0.0003608617 0.0016740066 -0.0012395392 0.0008673195 0.0000053091 0.0000617517 -0.0000223769 -0.0002570736 -0.0005755818 0.0002548331 0.0001761303 -0.0001289294 0.0001017741 0.0000074353 0.0000148168 0.0000217650 0.0000487022 -0.0000943255 -0.0000276093 -0.0000813770 0.0001852031 -0.0000600008 0.0000182034 -0.0001089076 0.0000379256 0.0015934786 -0.0015323172 -0.0014298332 0.0001230298 0.0008659533 0.0010537931 0.0002977971 -0.0003417650 -0.0006992460 -0.0000067657 0.0000363279 -0.0000306464 0.0001688903 -0.0002430508 -0.0001719674 0.0000657429 -0.0002146838 0.0005503526 0.0000054581 0.0000333366 -0.0000013346 -0.0002029914 -0.0005303948 0.0001952309 0.0001229881 -0.0001096106 -0.0001149263 0.0000123723 0.0000471147 -0.0000114534 -0.0001471211 -0.0005178116 0.0002002324 0.0000177862 -0.0000181805 -0.0000463296 -0.0000051945 0.0000368056 -0.0000486796 0.0001478417 -0.0000350446 0.0005000140 -0.0001169679 -0.0003976019 0.0001525979 -0.0000295973 0.0000870931 -0.0001476321 0.0003354311 -0.0001670333 0.0015290332 0.0003175048 0.0000268780 0.0000586086 -0.0002762109 -0.0009219694 0.0002853558 0.0002314395 0.0001882926 0.0003269696 0.0001736895 -0.0004837087 -0.0000961235 -0.0013634577 0.0048646300 0.0040475318 0.0138791508 0.0066889722 0.0108023640 -0.0640676643 -0.1189485155 -0.0274033101 0.0074005929 0.0047761682 -0.0133726610 -0.1150989705 0.0357440339 -0.0920159121 0.0703644569 0.0196039960 0.0536943493 -0.6088464039 0.1698674888 -0.5531705733 -0.2312220832 -0.4071824872 -0.0803656295 0.0098151461 0.0061660379 0.0044847311 -0.0751973087 -0.0891929262 -0.0169092251 -0.0404592872 0.0211507422 -0.0413332822 -0.0000476692 0.0003143346 0.0000070177 -0.0001612128 -0.0001448594 0.0001385461 0.0005808831 -0.0001438177 0.0005368821 -0.0004554082 0.0006824306 -0.0001851549 -0.0026235608 -0.0057318860 0.0020991626 0.0021403789 -0.0004451921 -0.0021787070 0.0067195150 -0.0060880091 0.0039140845 0.0008584072 0.0028252471 -0.0012111184 -0.0137942550 -0.0328823319 0.0136768771 0.0061684648 -0.0053152681 0.0030717049 0.0000057120 0.0001032344 -0.0002914942 0.0012922474 0.0006945745 0.0017166922 -0.0013030079 -0.0014509888 0.0010938931 -0.0002184559 -0.0002098126 -0.0014785039 -0.0024836389 0.0015948884 0.0046521649 0.0068706708 0.0049430566 0.0084618460 -0.0005451965 -0.0026080851 0.0032243075 0.0016340593 0.0001916844 -0.0036738201 -0.0096179831 0.0187662787 0.0187671554 0.0038865072 -0.0074576582 0.0166879488 0.0004380732 -0.0003607446 -0.0004817678 -0.0020584692 -0.0015361687 0.0007102948 -0.0055201141 0.0047818876 0.0059008864 0.0000145137 -0.0003162065 -0.0000383108 0.0007397107 0.0018420032 -0.0009808615 -0.0007466930 0.0018135007 0.0021496995 0.0000140224 -0.0000719214 0.0000859926 -0.0005106746 0.0001476709 -0.0010254901 0.0002341338 0.0008662992 -0.0002127450 -0.0001193151 -0.0002091027 0.0000051846 0.0001137306 -0.0001922366 0.0005803469 0.0005796493 0.0001881869 0.0001271562 0.0006012168 0.0024743406 -0.0008145330 -0.0000699947 0.0006768986 0.0004969942 0.0161419211 -0.0626475655 -0.0550192953 -0.1917422482 0.7557771739 0.6176194391 -0.0001230197 -0.0001005104 0.0000266532 0.0005373848 0.0011056779 0.0002910122 0.0004649180 0.0003770556 -0.0009898697 0.0005062959 -0.0001880370 0.0003942183 -0.0004220444 -0.0001597525 -0.0002743321 0.0031872299 -0.0009687351 0.0031015305 0.0018530640 0.0029617776 0.0004666419 -0.0003751527 -0.0001560394 -0.0000256539 0.0013564396 0.0030625612 0.0003388606 0.0023297326 -0.0010337104 0.0011138318 -0.0003597767 -0.0005930066 -0.0011398996 0.0000408919 0.0007383663 0.0001096105 -0.0050425976 -0.0029346885 0.0097313161</array>
                  </module>
                  <molecule cmlx:templateRef="atom" id="molecule-rot">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="0.76261325" y3="-3.46167288" z3="-0.89579722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="0.32187543" y3="-4.41159156" z3="-0.53773937">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="1.47351894" y3="-3.70424859" z3="-1.7068587">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-0.05592399" y3="-2.86237899" z3="-1.33089533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="1.45835239" y3="-2.71880225" z3="0.24449584">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="1.88608323" y3="-1.77668313" z3="-0.14135786">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="2.31018757" y3="-3.32619342" z3="0.60906865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="0.53903115" y3="-2.40236936" z3="1.42945289">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="1.13287951" y3="-1.90922331" z3="2.22256487">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="0.1821798" y3="-3.36156018" z3="1.85795783">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-0.67618798" y3="-1.5152278" z3="1.11783131">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-1.3107714" y3="-1.48199148" z3="2.02075802">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-1.28093539" y3="-1.94726543" z3="0.29990124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-0.31387829" y3="-0.05855336" z3="0.79417053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="0.50339227" y3="1.60413705" z3="-0.91445006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="0.10856974" y3="2.32287875" z3="-0.17200377">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="0.1187747" y3="1.91983659" z3="-1.91004671">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="2.0378431" y3="1.73067401" z3="-0.94609362">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="2.32742172" y3="2.74356914" z3="-1.29982515">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="2.43144163" y3="1.01491251" z3="-1.6947301">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="2.69161338" y3="1.47166022" z3="0.41105013">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="2.4023061" y3="0.46333104" z3="0.75743219">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="2.25391827" y3="2.16313508" z3="1.15235992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="4.21763615" y3="1.59860598" z3="0.42632979">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="4.57131932" y3="1.50832171" z3="1.47095775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="4.5110887" y3="2.61329978" z3="0.09079824">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="4.94200864" y3="0.55739292" z3="-0.42796662">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="4.70709315" y3="0.6753611" z3="-1.50003194">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="6.03925574" y3="0.63287958" z3="-0.31594973">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="4.63891329" y3="-0.46479503" z3="-0.13605527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-0.35714199" y3="0.77584945" z3="1.72868788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-0.01027367" y3="0.24280873" z3="-0.54850571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="0.21775438" y3="-0.58274981" z3="-1.23059994">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-4.51454986" y3="1.68154972" z3="1.07517052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-3.98118323" y3="2.62522293" z3="1.2918507">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-4.95585609" y3="1.32490409" z3="2.02367549">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-5.34704682" y3="1.91844564" z3="0.38467172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-3.56562444" y3="0.64554528" z3="0.47837903">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-2.76415072" y3="0.43086343" z3="1.20299614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-4.09887992" y3="-0.30203977" z3="0.28853488">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-2.92385579" y3="1.11076133" z3="-0.82314703">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-2.24463901" y3="1.96206025" z3="-0.64484408">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-3.71493666" y3="1.4757405" z3="-1.51753836">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-2.18271161" y3="0.01881781" z3="-1.58331604">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-2.51606744" y3="-1.15982903" z3="-1.54947566">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-1.58895271" y3="0.41314626" z3="-2.44565493">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:.7626,-3.4617,-.8958;.3219,-4.4116,-.5377;1.4735,-3.7042,-1.7069;-.0559,-2.8624,-1.3309;1.4584,-2.7188,.2445;1.8861,-1.7767,-.1414;2.3102,-3.3262,.6091;.539,-2.4024,1.4295;1.1329,-1.9092,2.2226;.1822,-3.3616,1.858;-.6762,-1.5152,1.1178;-1.3108,-1.482,2.0208;-1.2809,-1.9473,.2999;-.3139,-.0586,.7942;.5034,1.6041,-.9145;.1086,2.3229,-.172;.1188,1.9198,-1.91;2.0378,1.7307,-.9461;2.3274,2.7436,-1.2998;2.4314,1.0149,-1.6947;2.6916,1.4717,.4111;2.4023,.4633,.7574;2.2539,2.1631,1.1524;4.2176,1.5986,.4263;4.5713,1.5083,1.471;4.5111,2.6133,.0908;4.942,.5574,-.428;4.7071,.6754,-1.5;6.0393,.6329,-.3159;4.6389,-.4648,-.1361;-.3571,.7758,1.7287;-.0103,.2428,-.5485;.2178,-.5827,-1.2306;-4.5145,1.6815,1.0752;-3.9812,2.6252,1.2919;-4.9559,1.3249,2.0237;-5.347,1.9184,.3847;-3.5656,.6455,.4784;-2.7642,.4309,1.203;-4.0989,-.302,.2885;-2.9239,1.1108,-.8231;-2.2446,1.9621,-.6448;-3.7149,1.4757,-1.5175;-2.1827,.0188,-1.5833;-2.5161,-1.1598,-1.5495;-1.589,.4131,-2.4457;</scalar>
</formula>
</molecule>
                  <molecule cmlx:templateRef="atom" id="molecule-rot">
                     <atomArray>
                        <atom elementType="C" id="a1" x3="0.76261325" y3="-3.46167288" z3="-0.89579722">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a2" x3="0.32187543" y3="-4.41159156" z3="-0.53773937">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a3" x3="1.47351894" y3="-3.70424859" z3="-1.7068587">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a4" x3="-0.05592399" y3="-2.86237899" z3="-1.33089533">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a5" x3="1.45835239" y3="-2.71880225" z3="0.24449584">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a6" x3="1.88608323" y3="-1.77668313" z3="-0.14135786">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a7" x3="2.31018757" y3="-3.32619342" z3="0.60906865">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a8" x3="0.53903115" y3="-2.40236936" z3="1.42945289">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a9" x3="1.13287951" y3="-1.90922331" z3="2.22256487">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a10" x3="0.1821798" y3="-3.36156018" z3="1.85795783">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a11" x3="-0.67618798" y3="-1.5152278" z3="1.11783131">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a12" x3="-1.3107714" y3="-1.48199148" z3="2.02075802">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a13" x3="-1.28093539" y3="-1.94726543" z3="0.29990124">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a14" x3="-0.31387829" y3="-0.05855336" z3="0.79417053">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="C" id="a15" x3="0.50339227" y3="1.60413705" z3="-0.91445006">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a16" x3="0.10856974" y3="2.32287875" z3="-0.17200377">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a17" x3="0.1187747" y3="1.91983659" z3="-1.91004671">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a18" x3="2.0378431" y3="1.73067401" z3="-0.94609362">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a19" x3="2.32742172" y3="2.74356914" z3="-1.29982515">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a20" x3="2.43144163" y3="1.01491251" z3="-1.6947301">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a21" x3="2.69161338" y3="1.47166022" z3="0.41105013">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a22" x3="2.4023061" y3="0.46333104" z3="0.75743219">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a23" x3="2.25391827" y3="2.16313508" z3="1.15235992">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a24" x3="4.21763615" y3="1.59860598" z3="0.42632979">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a25" x3="4.57131932" y3="1.50832171" z3="1.47095775">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a26" x3="4.5110887" y3="2.61329978" z3="0.09079824">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a27" x3="4.94200864" y3="0.55739292" z3="-0.42796662">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a28" x3="4.70709315" y3="0.6753611" z3="-1.50003194">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a29" x3="6.03925574" y3="0.63287958" z3="-0.31594973">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a30" x3="4.63891329" y3="-0.46479503" z3="-0.13605527">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="O" id="a31" x3="-0.35714199" y3="0.77584945" z3="1.72868788">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="C" id="a32" x3="-0.01027367" y3="0.24280873" z3="-0.54850571">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a33" x3="0.21775438" y3="-0.58274981" z3="-1.23059994">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a34" x3="-4.51454986" y3="1.68154972" z3="1.07517052">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a35" x3="-3.98118323" y3="2.62522293" z3="1.2918507">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a36" x3="-4.95585609" y3="1.32490409" z3="2.02367549">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a37" x3="-5.34704682" y3="1.91844564" z3="0.38467172">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a38" x3="-3.56562444" y3="0.64554528" z3="0.47837903">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a39" x3="-2.76415072" y3="0.43086343" z3="1.20299614">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a40" x3="-4.09887992" y3="-0.30203977" z3="0.28853488">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a41" x3="-2.92385579" y3="1.11076133" z3="-0.82314703">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="H" id="a42" x3="-2.24463901" y3="1.96206025" z3="-0.64484408">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="H" id="a43" x3="-3.71493666" y3="1.4757405" z3="-1.51753836">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                        <atom elementType="C" id="a44" x3="-2.18271161" y3="0.01881781" z3="-1.58331604">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                        </atom>
                        <atom elementType="O" id="a45" x3="-2.51606744" y3="-1.15982903" z3="-1.54947566">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                        </atom>
                        <atom elementType="H" id="a46" x3="-1.58895271" y3="0.41314626" z3="-2.44565493">
                           <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                        </atom>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a3" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a5" order="S"/>
                        <bond atomRefs2="a1 a4" order="S"/>
                        <bond atomRefs2="a5 a7" order="S"/>
                        <bond atomRefs2="a5 a8" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a11 a14" order="S"/>
                        <bond atomRefs2="a11 a12" order="S"/>
                        <bond atomRefs2="a11 a13" order="S"/>
                        <bond atomRefs2="a14 a32" order="S"/>
                        <bond atomRefs2="a14 a31" order="S"/>
                        <bond atomRefs2="a15 a18" order="S"/>
                        <bond atomRefs2="a15 a16" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a32" order="S"/>
                        <bond atomRefs2="a18 a19" order="S"/>
                        <bond atomRefs2="a18 a20" order="S"/>
                        <bond atomRefs2="a18 a21" order="S"/>
                        <bond atomRefs2="a21 a24" order="S"/>
                        <bond atomRefs2="a21 a23" order="S"/>
                        <bond atomRefs2="a21 a22" order="S"/>
                        <bond atomRefs2="a24 a26" order="S"/>
                        <bond atomRefs2="a24 a25" order="S"/>
                        <bond atomRefs2="a24 a27" order="S"/>
                        <bond atomRefs2="a27 a29" order="S"/>
                        <bond atomRefs2="a27 a30" order="S"/>
                        <bond atomRefs2="a27 a28" order="S"/>
                        <bond atomRefs2="a32 a33" order="S"/>
                        <bond atomRefs2="a34 a37" order="S"/>
                        <bond atomRefs2="a34 a35" order="S"/>
                        <bond atomRefs2="a34 a36" order="S"/>
                        <bond atomRefs2="a34 a38" order="S"/>
                        <bond atomRefs2="a38 a39" order="S"/>
                        <bond atomRefs2="a38 a41" order="S"/>
                        <bond atomRefs2="a38 a40" order="S"/>
                        <bond atomRefs2="a41 a42" order="S"/>
                        <bond atomRefs2="a41 a43" order="S"/>
                        <bond atomRefs2="a41 a44" order="S"/>
                        <bond atomRefs2="a44 a46" order="S"/>
                        <bond atomRefs2="a44 a45" order="S"/>
                     </bondArray>
                     <formula concise="C15H29O2">
                        <atomArray count="15 29 2" elementType="C H O"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">212.15929999999994</scalar>
                     </property>
                  <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:.7626,-3.4617,-.8958;.3219,-4.4116,-.5377;1.4735,-3.7042,-1.7069;-.0559,-2.8624,-1.3309;1.4584,-2.7188,.2445;1.8861,-1.7767,-.1414;2.3102,-3.3262,.6091;.539,-2.4024,1.4295;1.1329,-1.9092,2.2226;.1822,-3.3616,1.858;-.6762,-1.5152,1.1178;-1.3108,-1.482,2.0208;-1.2809,-1.9473,.2999;-.3139,-.0586,.7942;.5034,1.6041,-.9145;.1086,2.3229,-.172;.1188,1.9198,-1.91;2.0378,1.7307,-.9461;2.3274,2.7436,-1.2998;2.4314,1.0149,-1.6947;2.6916,1.4717,.4111;2.4023,.4633,.7574;2.2539,2.1631,1.1524;4.2176,1.5986,.4263;4.5713,1.5083,1.471;4.5111,2.6133,.0908;4.942,.5574,-.428;4.7071,.6754,-1.5;6.0393,.6329,-.3159;4.6389,-.4648,-.1361;-.3571,.7758,1.7287;-.0103,.2428,-.5485;.2178,-.5827,-1.2306;-4.5145,1.6815,1.0752;-3.9812,2.6252,1.2919;-4.9559,1.3249,2.0237;-5.347,1.9184,.3847;-3.5656,.6455,.4784;-2.7642,.4309,1.203;-4.0989,-.302,.2885;-2.9239,1.1108,-.8231;-2.2446,1.9621,-.6448;-3.7149,1.4757,-1.5175;-2.1827,.0188,-1.5833;-2.5161,-1.1598,-1.5495;-1.589,.4131,-2.4457;</scalar>
</formula>
</molecule>
               </property>
               <property dictRef="cc:thermochemistry">
                  <module cmlx:templateRef="thermo">
                     <scalar dataType="xsd:double" dictRef="cc:temp" units="si:k">298.15</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:press" units="nonsi:atm">1.00</scalar>
                     <list cmlx:templateRef="state"/>
                     <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724162996131</scalar>
                     <scalar cmlx:templateRef="zpe" dataType="xsd:double" dictRef="cc:zpe.correction" units="nonsi:hartree">0.417504320256</scalar>
                     <scalar cmlx:templateRef="elec-zpe" dataType="xsd:double" dictRef="cc:zpe.sumelectzpe" units="nonsi:hartree">-738.306658675875</scalar>
                     <scalar cmlx:templateRef="thermal-tr" dataType="xsd:double" dictRef="cc:ethermo.trans" units="nonsi:hartree">0.001416276854</scalar>
                     <scalar cmlx:templateRef="thermal-rot" dataType="xsd:double" dictRef="cc:ethermo.rot" units="nonsi:hartree">0.001416276854</scalar>
                     <scalar cmlx:templateRef="thermal-vib" dataType="xsd:double" dictRef="cc:ethermo.vib" units="nonsi:hartree">0.435764963529</scalar>
                     <scalar cmlx:templateRef="enthalpy-corr" dataType="xsd:double" dictRef="cc:zpe.thermalcorrenthalpy" units="nonsi:hartree">0.439541701805</scalar>
                     <scalar cmlx:templateRef="enthalpy" dataType="xsd:double" dictRef="cc:zpe.sumelectthermalent" units="nonsi:hartree">-738.284621294326</scalar>
                     <scalar cmlx:templateRef="entropy-el" dataType="xsd:double" dictRef="cc:s.elect" units="nonsi2:hartree.K-1">0.000000000000</scalar>
                     <scalar cmlx:templateRef="entropy-tr" dataType="xsd:double" dictRef="cc:s.trans" units="nonsi2:hartree.K-1">0.000067476929</scalar>
                     <scalar cmlx:templateRef="entropy-rot" dataType="xsd:double" dictRef="cc:s.rot" units="nonsi2:hartree.K-1">0.000053553236</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:symmnumber" units="nonsi2:hartree.K-1">1</scalar>
                     <list cmlx:templateRef="entropy-rot"/>
                     <scalar cmlx:templateRef="entropy-vib" dataType="xsd:double" dictRef="cc:s.vib" units="nonsi2:hartree.K-1">0.000123641856</scalar>
                     <scalar cmlx:templateRef="gibbs-corr" dataType="xsd:double" dictRef="cc:zpe.thermalcorrgfe" units="nonsi:hartree">0.366592738878</scalar>
                     <scalar cmlx:templateRef="gibbs" dataType="xsd:double" dictRef="cc:zpe.sumelectthermalfe" units="nonsi:hartree">-738.357570257253</scalar>
                  </module>
                  <module cmlx:templateRef="thermo">
                     <scalar dataType="xsd:double" dictRef="cc:temp" units="si:k">298.15</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:press" units="nonsi:atm">1.00</scalar>
                     <list cmlx:templateRef="state"/>
                     <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724162996131</scalar>
                     <scalar cmlx:templateRef="zpe" dataType="xsd:double" dictRef="cc:zpe.correction" units="nonsi:hartree">0.417504320256</scalar>
                     <scalar cmlx:templateRef="elec-zpe" dataType="xsd:double" dictRef="cc:zpe.sumelectzpe" units="nonsi:hartree">-738.306658675875</scalar>
                     <scalar cmlx:templateRef="thermal-tr" dataType="xsd:double" dictRef="cc:ethermo.trans" units="nonsi:hartree">0.001416276854</scalar>
                     <scalar cmlx:templateRef="thermal-rot" dataType="xsd:double" dictRef="cc:ethermo.rot" units="nonsi:hartree">0.001416276854</scalar>
                     <scalar cmlx:templateRef="thermal-vib" dataType="xsd:double" dictRef="cc:ethermo.vib" units="nonsi:hartree">0.435764963529</scalar>
                     <scalar cmlx:templateRef="enthalpy-corr" dataType="xsd:double" dictRef="cc:zpe.thermalcorrenthalpy" units="nonsi:hartree">0.439541701805</scalar>
                     <scalar cmlx:templateRef="enthalpy" dataType="xsd:double" dictRef="cc:zpe.sumelectthermalent" units="nonsi:hartree">-738.284621294326</scalar>
                     <scalar cmlx:templateRef="entropy-el" dataType="xsd:double" dictRef="cc:s.elect" units="nonsi2:hartree.K-1">0.000000000000</scalar>
                     <scalar cmlx:templateRef="entropy-tr" dataType="xsd:double" dictRef="cc:s.trans" units="nonsi2:hartree.K-1">0.000067476929</scalar>
                     <scalar cmlx:templateRef="entropy-rot" dataType="xsd:double" dictRef="cc:s.rot" units="nonsi2:hartree.K-1">0.000053553236</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:symmnumber" units="nonsi2:hartree.K-1">1</scalar>
                     <list cmlx:templateRef="entropy-rot"/>
                     <scalar cmlx:templateRef="entropy-vib" dataType="xsd:double" dictRef="cc:s.vib" units="nonsi2:hartree.K-1">0.000123641856</scalar>
                     <scalar cmlx:templateRef="gibbs-corr" dataType="xsd:double" dictRef="cc:zpe.thermalcorrgfe" units="nonsi:hartree">0.366592738878</scalar>
                     <scalar cmlx:templateRef="gibbs" dataType="xsd:double" dictRef="cc:zpe.sumelectthermalfe" units="nonsi:hartree">-738.357570257253</scalar>
                  </module>
               </property>
            </propertyList>
            <molecule cmlx:templateRef="atom" id="molecule">
               <atomArray>
                  <atom elementType="C" id="a1" x3="-0.88822271" y3="0.97980917" z3="3.81869987">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a2" x3="-1.2088664" y3="1.31827429" z3="2.81499188">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a3" x3="0.18209461" y3="1.23137418" z3="3.9335323">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a4" x3="-1.4557588" y3="1.56735753" z3="4.56109899">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a5" x3="-1.12429145" y3="-0.52056523" z3="3.9899488">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a6" x3="-0.79718796" y3="-0.82844968" z3="4.99872809">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a7" x3="-0.4897786" y3="-1.07394477" z3="3.26979252">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a8" x3="-2.58280433" y3="-0.94534183" z3="3.78571969">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a9" x3="-2.65279584" y3="-2.04570028" z3="3.88157375">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a10" x3="-2.87182894" y3="-0.70426703" z3="2.7419984">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a11" x3="-3.60591354" y3="-0.31405166" z3="4.74259269">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a12" x3="-4.61421984" y3="-0.60316883" z3="4.39790866">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a13" x3="-3.54594102" y3="0.78908014" z3="4.71277569">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a14" x3="-3.48887804" y3="-0.81040588" z3="6.19099189">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="C" id="a15" x3="-2.30452849" y3="-0.64716978" z3="8.4096683">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a16" x3="-3.19755286" y3="-1.20499487" z3="8.74884317">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a17" x3="-2.15073089" y3="0.18928098" z3="9.12765575">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a18" x3="-1.08197544" y3="-1.57821909" z3="8.50998523">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a19" x3="-0.90055441" y3="-1.85255881" z3="9.57147591">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a20" x3="-0.18729916" y3="-1.01624524" z3="8.17617294">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a21" x3="-1.22852447" y3="-2.85581519" z3="7.68378038">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a22" x3="-1.40684228" y3="-2.57793545" z3="6.62955433">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a23" x3="-2.14890797" y3="-3.37776023" z3="7.99956874">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a24" x3="-0.03828198" y3="-3.81596775" z3="7.76455207">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a25" x3="-0.29774215" y3="-4.74939867" z3="7.22987671">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a26" x3="0.1359654" y3="-4.10640855" z3="8.81981571">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a27" x3="1.25827125" y3="-3.25826055" z3="7.17584595">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a28" x3="1.62159724" y3="-2.38514878" z3="7.74514014">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a29" x3="2.06313825" y3="-4.01614313" z3="7.17644733">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a30" x3="1.10169383" y3="-2.92789054" z3="6.13263629">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="O" id="a31" x3="-4.23063338" y3="-1.75645981" z3="6.54624314">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                  </atom>
                  <atom elementType="C" id="a32" x3="-2.58929231" y3="-0.12550165" z3="7.03207812">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a33" x3="-1.83762727" y3="0.52530662" z3="6.57355386">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a34" x3="-7.4425461" y3="0.8588308" z3="7.71897064">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a35" x3="-7.3572105" y3="0.05183726" z3="8.46958948">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a36" x3="-8.22617201" y3="0.56029876" z3="6.99895812">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a37" x3="-7.7958335" y3="1.76779206" z3="8.24331491">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a38" x3="-6.10591767" y3="1.09532893" z3="7.02081749">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a39" x3="-5.80144174" y3="0.17219446" z3="6.50251688">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a40" x3="-6.2047641" y3="1.88422443" z3="6.25518512">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a41" x3="-4.99566105" y3="1.49207383" z3="7.98631571">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="H" id="a42" x3="-4.74986257" y3="0.65914966" z3="8.66723983">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="H" id="a43" x3="-5.34427014" y3="2.3339526" z3="8.62733824">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
                  <atom elementType="C" id="a44" x3="-3.72440755" y3="1.98970317" z3="7.31120695">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">6</scalar>
                  </atom>
                  <atom elementType="O" id="a45" x3="-3.72791822" y3="2.58014267" z3="6.23749911">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">8</scalar>
                  </atom>
                  <atom elementType="H" id="a46" x3="-2.87374375" y3="2.12221795" z3="8.02568847">
                     <scalar dataType="xsd:integer" dictRef="cc:atomicNumber">1</scalar>
                  </atom>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a4" order="S"/>
                  <bond atomRefs2="a1 a3" order="S"/>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a1 a5" order="S"/>
                  <bond atomRefs2="a5 a7" order="S"/>
                  <bond atomRefs2="a5 a6" order="S"/>
                  <bond atomRefs2="a5 a8" order="S"/>
                  <bond atomRefs2="a8 a10" order="S"/>
                  <bond atomRefs2="a8 a9" order="S"/>
                  <bond atomRefs2="a8 a11" order="S"/>
                  <bond atomRefs2="a11 a14" order="S"/>
                  <bond atomRefs2="a11 a12" order="S"/>
                  <bond atomRefs2="a11 a13" order="S"/>
                  <bond atomRefs2="a14 a31" order="S"/>
                  <bond atomRefs2="a14 a32" order="S"/>
                  <bond atomRefs2="a15 a18" order="S"/>
                  <bond atomRefs2="a15 a17" order="S"/>
                  <bond atomRefs2="a15 a32" order="S"/>
                  <bond atomRefs2="a15 a16" order="S"/>
                  <bond atomRefs2="a18 a20" order="S"/>
                  <bond atomRefs2="a18 a21" order="S"/>
                  <bond atomRefs2="a18 a19" order="S"/>
                  <bond atomRefs2="a21 a24" order="S"/>
                  <bond atomRefs2="a21 a23" order="S"/>
                  <bond atomRefs2="a21 a22" order="S"/>
                  <bond atomRefs2="a24 a26" order="S"/>
                  <bond atomRefs2="a24 a25" order="S"/>
                  <bond atomRefs2="a24 a27" order="S"/>
                  <bond atomRefs2="a27 a30" order="S"/>
                  <bond atomRefs2="a27 a29" order="S"/>
                  <bond atomRefs2="a27 a28" order="S"/>
                  <bond atomRefs2="a32 a33" order="S"/>
                  <bond atomRefs2="a34 a36" order="S"/>
                  <bond atomRefs2="a34 a37" order="S"/>
                  <bond atomRefs2="a34 a38" order="S"/>
                  <bond atomRefs2="a34 a35" order="S"/>
                  <bond atomRefs2="a38 a40" order="S"/>
                  <bond atomRefs2="a38 a41" order="S"/>
                  <bond atomRefs2="a38 a39" order="S"/>
                  <bond atomRefs2="a41 a42" order="S"/>
                  <bond atomRefs2="a41 a43" order="S"/>
                  <bond atomRefs2="a41 a44" order="S"/>
                  <bond atomRefs2="a44 a45" order="S"/>
                  <bond atomRefs2="a44 a46" order="S"/>
               </bondArray>
               <formula concise="C15H29O2">
                  <atomArray count="15 29 2" elementType="C H O"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">212.15929999999994</scalar>
               </property>
            <formula convention="iupac:inchi" inline="InChI=1/C11H21O.C4H8O/c1-3-5-7-8-10-11(12)9-6-4-2;1-2-3-4-5/h10H,3-9H2,1-2H3;4H,2-3H2,1H3">
<scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,32,14,31;34,38,41,44,45/CRV:10.3,11.3,12.1;4.3,5.1/rA:46nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHO1C3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s14s15;s32;;s34;s34;s34;s34;s38;s38;s38;s41;s41;s41;s44;s44;/rC:-.8882,.9798,3.8187;-1.2089,1.3183,2.815;.1821,1.2314,3.9335;-1.4558,1.5674,4.5611;-1.1243,-.5206,3.9899;-.7972,-.8284,4.9987;-.4898,-1.0739,3.2698;-2.5828,-.9453,3.7857;-2.6528,-2.0457,3.8816;-2.8718,-.7043,2.742;-3.6059,-.3141,4.7426;-4.6142,-.6032,4.3979;-3.5459,.7891,4.7128;-3.4889,-.8104,6.191;-2.3045,-.6472,8.4097;-3.1976,-1.205,8.7488;-2.1507,.1893,9.1277;-1.082,-1.5782,8.51;-.9006,-1.8526,9.5715;-.1873,-1.0162,8.1762;-1.2285,-2.8558,7.6838;-1.4068,-2.5779,6.6296;-2.1489,-3.3778,7.9996;-.0383,-3.816,7.7646;-.2977,-4.7494,7.2299;.136,-4.1064,8.8198;1.2583,-3.2583,7.1758;1.6216,-2.3851,7.7451;2.0631,-4.0161,7.1764;1.1017,-2.9279,6.1326;-4.2306,-1.7565,6.5462;-2.5893,-.1255,7.0321;-1.8376,.5253,6.5736;-7.4425,.8588,7.719;-7.3572,.0518,8.4696;-8.2262,.5603,6.999;-7.7958,1.7678,8.2433;-6.1059,1.0953,7.0208;-5.8014,.1722,6.5025;-6.2048,1.8842,6.2552;-4.9957,1.4921,7.9863;-4.7499,.6591,8.6672;-5.3443,2.334,8.6273;-3.7244,1.9897,7.3112;-3.7279,2.5801,6.2375;-2.8737,2.1222,8.0257;</scalar>
</formula>
</molecule>
            <module dictRef="energy.info" id="energy.info1">
               <scalar cmlx:templateRef="symmetry-group" dataType="xsd:string" dictRef="cc:pointgroup">--</scalar>
               <scalar cmlx:templateRef="energy" dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-738.724162996131</scalar>
               <scalar cmlx:templateRef="spinsqr" dataType="xsd:double" dictRef="cc:s2">0.000000000000</scalar>
               <array cmlx:templateRef="gradient-vector" dataType="xsd:double" dictRef="cc:grad" size="138">0.000004261604 -0.000000467587 -0.000001927496 0.000002971656 -0.000002927338 0.000001142130 -0.000007686010 -0.000000628720 -0.000002924036 0.000001414415 -0.000003369471 -0.000000336139 -0.000001910783 -0.000004708579 -0.000002873984 -0.000002318810 -0.000000094186 -0.000001973174 -0.000002906665 0.000003416533 0.000001108949 0.000000689106 -0.000002329222 -0.000000322836 0.000000319550 0.000004665772 -0.000000927094 0.000000166732 -0.000001092516 0.000002707999 0.000005594047 -0.000004082934 0.000001089318 -0.000002326314 0.000001402307 0.000000048723 -0.000000011906 0.000001425509 0.000000584182 -0.000000360390 -0.000005233968 -0.000007899651 0.000002034250 -0.000003606172 0.000001020753 0.000000193872 0.000000022601 -0.000000664198 0.000000398879 0.000000119781 -0.000001520969 -0.000001290347 0.000000351887 -0.000001909536 -0.000000021411 -0.000000672856 -0.000000045463 -0.000000599234 -0.000000604662 -0.000000193126 -0.000003054437 0.000003684525 -0.000004146258 -0.000001172601 0.000001106493 0.000001023268 0.000003777640 -0.000003989089 -0.000000179427 0.000000010353 -0.000002772450 0.000002678784 -0.000001213647 -0.000004685642 0.000003530106 0.000001991249 0.000000059599 -0.000003123801 0.000017647360 -0.000004251648 0.000022403574 0.000005964576 0.000002937555 0.000002540555 -0.000004895745 0.000001304476 0.000005998235 -0.000014476069 -0.000001248795 -0.000022631955 -0.000007807249 -0.000002755719 0.000000566538 0.000014623244 0.000030378686 -0.000007711745 -0.000016018182 -0.000015551093 0.000009212547 0.000004145177 0.000007793234 0.000015839172 -0.000000714815 0.000017258203 -0.000014584806 0.000004784056 0.000002305737 0.000004498950 0.000008776839 -0.000019569258 -0.000012345776 -0.000006921860 0.000004905771 -0.000007529949 -0.000005151168 0.000015641610 0.000007113858 0.000001791102 -0.000016786016 0.000013540544 0.000001271332 -0.000009119106 0.000006773248 -0.000005075469 0.000013176358 -0.000005059917 0.000002327683 -0.000003308675 -0.000000649065 0.000003823834 -0.000005924836 -0.000000770528 -0.000002326641 0.000004716560 -0.000000320593 -0.000000718803 0.000003107341 -0.000000849914</array>
               <array cmlx:templateRef="hess" dataType="xsd:double" dictRef="cc:hessianmatrix" size="9591">0.581812989 -0.014610774 0.495712825 -0.000734911 0.015071102 0.573333288 -0.071833107 0.022215873 -0.068767003 0.069695877 0.021719746 -0.069223059 0.067653363 -0.023379451 0.076259487 -0.068479998 0.068587914 -0.264206066 0.075851071 -0.077184907 -0.296481108 -0.054833442 -0.026924833 -0.006449810 -0.001234815 -0.053050382 -0.059154365 -0.005738349 0.009526654 0.001290399 -0.027047785 -0.006096704 -0.052342252 -0.028165067 -0.007192030 -0.122425446 0.074003177 0.094883181 0.006072704 -0.006751827 0.072479247 -0.122613168 -0.095488982 -0.006468308 0.005354009 0.093931360 -0.096677012 -0.174699031 0.015217832 -0.014610986 -0.084752735 -0.014888047 0.003070788 0.001003531 0.009722852 -0.015948849 -0.207907624 0.015961330 -0.001078015 -0.010019516 0.001870939 0.013386039 -0.085219374 0.004869348 0.032224293 0.001182996 -0.002132990 0.005221639 0.000601265 -0.001225667 0.009619463 -0.010370268 0.031318019 -0.001207993 -0.006858494 -0.000558726 0.000691910 -0.001127729 0.000513211 0.000022172 0.002915889 -0.003860900 -0.004208627 -0.000145235 0.000491330 0.018711967 -0.018093067 -0.023108969 0.000349009 0.001175840 -0.003099772 0.003781386 0.003326019 -0.000326160 -0.000435038 -0.004967739 -0.007513954 -0.000572542 0.000733692 0.001384868 -0.034856139 -0.011015023 -0.004270264 -0.000363220 0.001688646 0.004036923 0.001105031 0.000439098 0.001441973 0.000837109 -0.006289884 -0.000118098 -0.001394871 0.000030482 0.000262586 -0.002604536 0.001185939 -0.000381292 0.000127594 0.000241153 -0.000984561 0.000224215 0.000439065 -0.000058260 -0.000424413 0.001160407 0.001387798 -0.000377777 0.000176948 -0.000755368 -0.000062283 0.000882925 -0.001485086 0.000041334 0.000024514 0.000510394 0.000062890 0.000474759 -0.000330816 -0.000909935 0.000354766 0.000207004 -0.000376870 0.000021651 -0.000148385 -0.000425093 0.001348350 0.000807973 0.000096755 0.000007462 -0.000063618 0.000243196 0.000459785 -0.000163663 -0.000160882 0.000331273 0.000456571 -0.000088975 0.000001550 -0.000065490 -0.000126549 -0.000239188 -0.000274939 0.000010495 0.000037457 -0.000119213 -0.000367460 0.000008708 -0.000023936 0.000049879 -0.001265780 -0.000416708 0.000336867 0.000077511 -0.000008014 -0.000831840 -0.000306912 -0.000251486 0.000135668 -0.000058852 0.000281211 0.000219052 0.000285699 0.000036944 0.000060229 -0.000784982 0.000046463 -0.000258882 0.000171244 0.000171662 -0.000634740 -0.000190303 0.000097851 0.000084846 -0.000083759 -0.001043665 0.000178290 -0.000898169 0.000298390 0.000022549 0.000229990 -0.000148650 0.000069878 -0.000098371 0.000082009 0.000098437 -0.000123182 0.000106773 -0.000060555 -0.000007362 0.000039669 0.000000076 0.000024870 -0.000011291 -0.000029939 0.000004633 0.000025311 -0.000010638 0.000010343 -0.000003298 0.000053584 -0.000024471 -0.000003494 -0.000016140 0.000016654 -0.000088514 0.000055615 -0.000043346 0.000035378 -0.000017553 -0.000000836 0.000006550 0.000009483 -0.000000160 -0.000008466 -0.000018575 0.000003803 -0.000022211 0.000003460 0.000019673 0.000009002 -0.000020771 0.000024790 -0.000005615 0.000016634 0.000027740 -0.000053120 -0.000045240 -0.000034471 0.000020879 0.000009512 0.000005927 -0.000000731 -0.000013320 -0.000020996 0.000039323 0.000011811 0.000066495 0.000005728 -0.000017190 -0.000004080 0.000015322 0.000014857 0.000007888 -0.000002934 -0.000004824 -0.000010130 -0.000036470 0.000006218 0.000018108 -0.000028111 -0.000008581 -0.000027443 -0.000004472 0.000029091 0.000003206 0.000014779 0.000030885 0.000015663 -0.000011198 0.000008145 0.000019882 0.000012384 0.000007639 -0.000016201 0.000019580 -0.000007201 0.000034529 -0.000002338 -0.000014303 0.000050067 0.000023430 0.000128605 0.000000374 -0.000062743 -0.000000473 -0.000017624 -0.000018984 -0.000002275 0.000019449 0.000106466 0.000065818 0.000207693 -0.000008489 -0.000151876 -0.000102577 -0.000023845 -0.000117737 0.000000869 0.000064791 -0.000074634 -0.000013399 -0.000125927 0.000006635 0.000058499 -0.000023528 -0.000014362 -0.000006351 -0.000002859 0.000029975 0.000000892 -0.000000075 -0.000006854 0.000002729 0.000001991 0.000020254 0.000009528 0.000049034 0.000002418 -0.000023232 -0.000070698 -0.000014913 -0.000103403 0.000006610 0.000057440 0.000008464 -0.000004985 0.000017953 -0.000008746 -0.000000932 -0.000029036 -0.000009851 -0.000052942 -0.000000778 0.000030369 -0.000019300 -0.000016822 -0.000034179 0.000004184 0.000027347 -0.000013244 0.000003725 0.000005795 0.000005293 -0.000003552 -0.000002832 -0.000003157 0.000010989 0.000005186 0.000000478 0.000013425 0.000001641 0.000005320 0.000000490 -0.000007982 -0.000006616 -0.000001167 -0.000022232 0.000004136 0.000008851 0.000016301 0.000008639 0.000026432 0.000000926 -0.000019940 -0.000023596 -0.000009964 -0.000021980 -0.000004214 0.000026105 -0.000019443 -0.000006804 -0.000023783 0.000002685 0.000006355 -0.000014134 0.000007934 0.000014387 -0.000002808 -0.000000596 0.000132074 0.000047650 0.000090913 -0.000000701 -0.000095020 -0.000000375 0.000001964 0.000010046 0.000005242 -0.000002303 -0.000004538 -0.000003253 -0.000006820 -0.000000237 0.000004151 -0.000054188 -0.000001384 0.000011394 0.000017378 0.000008279 -0.000017658 -0.000005619 -0.000022955 -0.000001685 0.000016626 0.000020042 0.000012629 0.000031243 0.000008653 -0.000023391 -0.000032675 -0.000018130 -0.000044403 -0.000002984 0.000032988 0.000070888 0.000017919 0.000057698 -0.000005975 -0.000036893 -0.000001984 -0.000019034 -0.000043626 -0.000013873 0.000022434 -0.000016905 -0.000024743 -0.000073524 -0.000010806 0.000047154 0.000486683 -0.000135261 -0.000080054 -0.000058430 0.000030326 0.000510005 -0.000076793 -0.000200792 -0.000022810 0.000100759 0.000431943 -0.000012097 0.000433966 -0.000141781 -0.000057916 0.000036237 0.000539943 0.000144706 0.000114509 -0.000428317 0.000143620 -0.000595424 -0.000757977 0.000011341 0.000261953 0.000403926 -0.000192394 0.000017095 -0.000074891 0.000149501 0.000093329 -0.000154874 0.000396247 -0.000104301 0.000077159 -0.000081956 0.000487868 0.000689158 0.000004024 -0.000143814 0.000504008 -0.000202541 -0.001120688 -0.000096050 -0.000024022 0.000004526 -0.000000594 0.000010410 -0.000004590 0.000000900 0.000010857 -0.000009030 0.000005625 -0.000001336 0.000000212 0.000015569 -0.000008008 -0.000006360 -0.000002733 0.000000694 -0.000001785 -0.000001416 -0.000002913 0.000001289 0.000000620 -0.000000846 -0.000000589 -0.000004019 0.000002069 0.000000226 -0.000002311 0.000003438 0.000004818 -0.000002528 -0.000000134 0.000018186 -0.000009883 -0.000015057 -0.000000976 -0.000002684 0.000001809 -0.000000614 -0.000005726 0.000000307 -0.000000791 0.000002527 -0.000001235 -0.000004862 0.000001565 -0.000001116 -0.000003539 -0.000000456 -0.000009238 0.000003286 0.000000131 0.000000991 0.000001738 0.000008039 -0.000003185 0.000000173 0.000002680 0.000001269 0.000011486 -0.000003629 -0.000000063 -0.000010168 -0.000008692 0.000010120 0.000000876 0.000007083 -0.000018250 0.000013683 -0.000019633 0.000001191 0.000001899 -0.000032942 0.000016443 0.000018101 0.000007419 -0.000000585 0.000003196 0.000003149 0.000010166 -0.000003734 0.000002790 0.000020506 0.000002919 0.000002193 -0.000005948 -0.000000680 -0.000026548 0.000004639 -0.000007448 0.000005768 0.000000295 -0.000008650 0.000020491 0.000034778 -0.000002570 -0.000001918 -0.000013745 -0.000001366 -0.000000494 0.000007570 0.000002582 -0.000001308 -0.000001544 -0.000001188 0.000001087 -0.000000605 0.000016686 -0.000013146 0.000002139 0.000000843 0.000008137 0.000084710 -0.000172291 -0.000226637 -0.000003491 0.000045327 -0.000033579 -0.000003687 0.000038686 -0.000004096 0.000030842 0.000022757 -0.000027812 -0.000048154 -0.000003680 0.000003352 0.000014272 -0.000023251 -0.000035926 0.000000495 0.000002857 -0.000010160 0.000012866 0.000031161 -0.000000630 -0.000003394 0.000013084 0.000024478 0.000032095 -0.000000750 -0.000021760 -0.000003607 -0.000000006 0.000003933 -0.000003967 0.000003222 0.000004621 -0.000013310 -0.000008300 -0.000003726 0.000005736 -0.000067954 -0.000020960 -0.000321845 0.000055249 -0.000001485 -0.000368624 0.000617532 0.001156013 -0.000030417 -0.000286351 0.000510925 -0.000747434 -0.001240448 -0.000011669 0.000128233 0.000241004 -0.000060650 -0.000168477 -0.000055940 0.000079746 0.000249316 -0.000113993 -0.000456437 0.000009563 0.000079347 -0.000276425 0.000643520 0.001376377 -0.000073289 -0.000160793 -0.000032177 0.000038977 0.000102133 -0.000005199 -0.000007289 -0.000003542 0.000008316 -0.000007625 0.000012203 0.000019696 0.000006474 0.000044487 0.000072430 -0.000010682 0.000040777 0.281369894 0.000433865 0.316565576 -0.000312100 0.061037448 0.064323769 -0.000837287 0.029692140 0.005853553 0.048415698 -0.008091006 -0.013115360 0.015655270 0.020786436 0.128190402 0.007352885 -0.004155779 0.004084687 0.006685657 -0.077361906 -0.016745170 -0.003649135 0.004098485 0.004296439 -0.102227747 -0.000726823 -0.002596704 -0.034015873 0.004315509 0.003679354 0.000311043 0.001552002 -0.005676361 0.000488767 -0.002145268 -0.002811545 -0.000198249 -0.004333774 -0.000757524 -0.005117122 -0.000094255 0.000279958 0.000319392 0.000489599 0.000085072 0.000900570 -0.000353321 0.001202042 -0.000195526 0.000442116 0.001360066 0.000367016 0.000307783 0.000206352 0.000230458 0.000060186 0.000721967 0.000271685 -0.000460678 0.000634056 0.000486489 -0.000471130 0.001182894 -0.000183274 -0.001628718 0.000853431 -0.000343579 -0.000652267 0.000027070 -0.000035487 -0.000301959 0.001212668 0.001512990 -0.000067905 0.000239162 -0.000496294 -0.001467454 -0.006941617 0.000318944 -0.000108863 0.000455172 0.000439638 0.001470326 0.000285751 -0.000756823 0.000194184 -0.000501184 -0.001949029 0.000077165 0.000005898 -0.000060575 -0.000124987 -0.000724395 0.000007839 0.000212710 0.000260152 -0.000025122 -0.000287281 0.000380309 0.000172838 0.000698446 0.000145958 0.000214504 0.000400853 -0.000046220 0.000374869 0.000201127 0.000114232 0.000153031 -0.000035803 0.000149738 0.000108473 -0.000136903 0.000336354 0.000024409 0.000205231 0.000229744 0.000540934 0.000087821 -0.000671727 0.000056040 0.000183720 -0.000431761 -0.000157595 -0.000754015 0.000144649 0.000003661 -0.000239245 0.000073929 0.000190946 0.000100072 -0.000049962 -0.000090099 0.000009736 0.000112546 0.000061262 -0.000141024 0.000207215 0.000141862 0.000154089 -0.000032438 0.000003863 0.000051949 0.000000554 -0.000058827 -0.000061747 0.000229950 -0.000049576 -0.000116139 -0.002754655 0.000000984 -0.000286769 0.000352590 0.000249502 -0.001155488 -0.000232132 -0.000085011 0.000069388 -0.000061433 0.000341207 -0.000306762 -0.000199678 -0.000257140 -0.000001225 -0.000143803 -0.000312480 0.000007896 -0.000072612 0.000016042 -0.000141026 -0.000371554 -0.000716702 -0.000332642 0.000288223 0.000434275 0.000206654 -0.000032520 0.000043116 0.000013664 -0.000132522 0.000095528 0.000006862 0.000031843 -0.000010534 -0.000046312 0.000023913 -0.000095732 -0.000036276 0.000015264 0.000116486 0.000006626 0.000004736 -0.000001405 -0.000010008 0.000008423 0.000047155 -0.000019890 -0.000004346 0.000002557 -0.000013093 -0.000079734 0.000005768 -0.000018009 0.000000335 0.000056276 -0.000017772 0.000014733 0.000006676 -0.000000600 0.000002873 -0.000019944 0.000031210 0.000004750 -0.000006797 -0.000017811 -0.000000911 0.000076560 0.000016662 -0.000027054 -0.000064746 -0.000041298 -0.000084415 -0.000035533 0.000067085 0.000069764 -0.000035988 -0.000052722 -0.000040764 0.000035558 0.000060387 0.000042698 0.000049138 0.000025663 -0.000030230 -0.000064438 0.000007283 0.000040937 0.000016413 -0.000020105 -0.000033172 0.000015154 -0.000014248 0.000004336 -0.000002747 0.000008745 -0.000033481 0.000036914 0.000010021 0.000003236 -0.000011670 0.000036091 0.000048817 0.000021608 -0.000039497 -0.000048475 0.000010679 0.000021151 0.000020527 -0.000016529 -0.000013266 0.000017393 -0.000010780 0.000001568 0.000001268 0.000003492 0.000025340 0.000012451 0.000003616 -0.000020230 -0.000026943 -0.000016267 0.000016235 0.000018473 0.000003718 0.000003545 0.000049163 -0.000050974 -0.000032188 -0.000001774 0.000001818 -0.000024377 -0.000023224 -0.000029170 0.000018385 0.000020135 -0.000028459 0.000015825 -0.000001204 0.000006211 0.000008713 -0.000026454 0.000009535 -0.000010572 0.000004036 -0.000007512 0.000005948 0.000007603 0.000009609 -0.000003275 -0.000001972 0.000015602 0.000015379 0.000004899 -0.000014233 -0.000018990 -0.000021054 -0.000002512 -0.000007221 0.000004661 0.000009474 0.000001919 -0.000033748 -0.000033901 0.000004333 0.000003067 -0.000019660 0.000005031 -0.000002676 0.000004480 0.000002640 -0.000005633 0.000013347 0.000002373 -0.000004632 -0.000008125 0.000001122 0.000012696 0.000008473 -0.000005194 -0.000003369 0.000014726 0.000008247 0.000012217 -0.000008852 -0.000002964 0.000009918 -0.000007595 -0.000002326 -0.000001007 0.000001080 -0.000005280 0.000022693 0.000021380 -0.000002116 -0.000003479 0.000011081 -0.000005189 0.000002589 -0.000001503 0.000001893 -0.000021336 0.000007461 -0.000003814 0.000004355 0.000000269 -0.000005499 0.000010960 0.000016137 0.000006938 0.000007661 -0.000001697 -0.000011408 -0.000001417 0.000001469 0.000008719 0.000040661 -0.000017213 0.000020528 -0.000001779 0.000002156 0.000013603 0.000004388 0.000005462 -0.000010298 -0.000006363 -0.000003649 0.000006975 0.000004104 0.000000656 -0.000001366 0.000011066 0.000033716 0.000024897 -0.000021203 -0.000009277 -0.000016115 0.000017000 0.000007116 0.000003128 -0.000002731 0.000025129 -0.000002950 0.000005890 -0.000014980 -0.000006478 -0.000015012 0.000000382 -0.000007568 0.000007069 0.000003306 0.000012423 -0.000028207 -0.000024548 -0.000002643 -0.000004236 -0.000021286 -0.000015797 -0.000023108 0.000019167 0.000005596 -0.000031117 -0.000012021 -0.000024635 0.000018842 0.000006175 0.000266474 0.000016491 0.000123419 -0.000018546 0.000014304 0.000216374 -0.000089621 0.000174511 0.000009617 0.000124394 0.000127655 0.000369641 0.000102186 -0.000135667 -0.000250718 -0.000124449 0.000142463 -0.000002781 -0.000108860 -0.000083499 -0.000283719 0.000127365 0.000167763 0.000081514 0.000274209 0.000207513 0.000368607 0.000204974 -0.000166207 -0.000094404 0.000143072 -0.000113272 0.000048435 0.000050988 0.000250006 0.000154468 -0.000064009 -0.000018565 -0.000053911 -0.000168613 0.000117741 -0.000073729 0.000010241 0.000105994 0.000073662 0.000001458 0.000013499 0.000001659 -0.000001983 -0.000011278 -0.000003756 0.000006217 0.000006037 -0.000002498 0.000003124 0.000015255 -0.000001184 0.000000119 -0.000001688 0.000006358 -0.000005516 -0.000001907 0.000000459 0.000000874 0.000003339 -0.000002425 -0.000007004 -0.000001309 0.000000663 0.000004723 0.000004370 0.000006485 -0.000000788 -0.000000174 -0.000007854 0.000019066 -0.000006006 0.000001768 0.000000079 0.000011383 0.000007957 -0.000003945 -0.000001712 0.000000489 0.000002299 0.000004215 -0.000005403 -0.000000446 -0.000000002 0.000004531 0.000004021 -0.000012620 -0.000002966 0.000001986 0.000006864 -0.000005997 0.000012958 0.000003203 -0.000000819 -0.000007946 -0.000008265 0.000014357 0.000004097 -0.000001597 -0.000009030 -0.000012158 0.000009690 0.000001383 -0.000000977 -0.000016559 0.000020520 -0.000014912 -0.000014844 0.000006845 -0.000010178 -0.000034528 -0.000001216 -0.000000874 -0.000000247 -0.000001015 -0.000021473 0.000019546 0.000004271 -0.000003061 -0.000004812 0.000017919 0.000012239 0.000002946 -0.000003448 -0.000005221 -0.000008340 -0.000012089 -0.000007342 0.000003809 0.000007426 0.000002069 0.000011442 -0.000001680 -0.000003605 -0.000052072 -0.000021338 -0.000010856 -0.000000907 0.000000574 0.000008360 0.000004923 -0.000002216 -0.000001131 -0.000000981 0.000006524 0.000013925 0.000007681 -0.000001655 -0.000008990 -0.000026786 -0.000012564 -0.000018927 0.000047667 0.000028165 0.000195992 -0.000003612 0.000044772 -0.000000256 -0.000011726 -0.000113482 0.000003286 -0.000006492 0.000005610 0.000007303 0.000043907 0.000005027 -0.000014161 0.000004541 0.000006473 0.000035594 0.000013484 0.000001480 -0.000003858 -0.000002415 -0.000024229 0.000044423 -0.000032343 -0.000013837 -0.000002631 -0.000015340 -0.000015961 0.000021438 0.000005288 -0.000000231 -0.000011496 -0.000018937 0.000021398 0.000008787 0.000000795 0.000001268 -0.000289131 0.000007147 0.000083255 0.000057391 0.000491422 0.000409036 -0.000025544 -0.000318129 -0.000174811 -0.001056908 -0.000053157 -0.000386248 0.000217499 0.000263117 0.001191756 0.000229663 -0.000078902 0.000064123 0.000050183 -0.000216518 -0.000304269 0.000124244 0.000127636 0.000015860 0.000222107 0.000294008 0.000400892 -0.000314572 -0.000295941 -0.001406742 0.000038093 0.000036672 -0.000013289 -0.000020179 -0.000105007 -0.000035078 0.000026334 0.000023043 -0.000002193 0.000025152 0.000020687 0.000112436 0.000003340 -0.000040640 -0.000195554 0.133392761 0.102163501 0.182316475 0.017461240 -0.003835091 0.510126646 -0.016065237 0.002530907 -0.035714610 0.511687717 -0.022592727 0.004546644 -0.005859154 0.005039443 0.604915570 0.000377684 -0.000509007 -0.070756696 0.021817025 -0.069134638 0.001216032 -0.000188029 0.021935342 -0.068765274 0.064309111 -0.000025332 0.000489014 -0.071910793 0.067101905 -0.270160056 -0.001339054 0.000113007 -0.128396303 0.070971750 0.092429527 -0.006470888 0.001666110 0.070881653 -0.109192924 -0.080489255 0.001007392 0.000975102 0.094073203 -0.081646084 -0.160312576 0.000842639 0.000326982 -0.190296829 -0.030121745 -0.015997292 0.000774706 -0.000515504 -0.031057237 -0.091926136 -0.004511523 -0.000398912 -0.000134524 -0.020927934 -0.006876684 -0.087211175 0.000041650 -0.000144807 -0.002605962 -0.033139608 0.003954319 0.000239056 0.000018881 0.001113344 -0.007859677 0.000919526 0.000182045 0.000003363 -0.000599454 -0.006508493 -0.000336354 -0.000075524 0.000056960 -0.011217174 0.007193537 -0.031694448 -0.000044368 -0.000022992 -0.003117327 0.001593165 -0.009288275 0.000045001 -0.000008291 -0.000872284 0.001815527 -0.005370590 -0.000348981 0.000546925 -0.023181633 0.012775146 0.019564244 -0.000428799 -0.000375602 -0.003291255 0.006086695 0.007923508 0.000031725 -0.000136399 -0.000170126 0.003982736 0.005661231 0.000064032 -0.000042242 -0.000760140 0.003021554 0.003759708 0.000414723 0.000182001 0.001189741 -0.001381815 -0.002209157 0.000068028 -0.000030797 0.002262032 -0.002425494 -0.002317987 -0.001335592 0.000264093 0.000830594 0.000506470 -0.000676650 0.000401702 0.000584083 -0.000549673 -0.000280979 -0.000036405 0.000247511 0.000357233 -0.000536263 0.000557542 0.000658118 -0.000117760 0.000415964 0.001762104 -0.000326841 0.001569735 -0.000203178 0.000440727 0.000897231 -0.000304391 -0.000018264 0.000073235 0.000701905 0.001287051 0.001099084 0.001241997 0.000394490 -0.000182780 -0.000302014 -0.000009299 -0.000125874 0.000139924 -0.000084023 0.000101349 -0.000233456 -0.000148339 0.000029567 -0.000038663 0.000043303 0.000077255 0.000069847 -0.000010273 -0.000011666 -0.000000004 0.000043831 -0.000011540 0.000078317 -0.000039336 -0.000011275 0.000002664 -0.000025441 -0.000141279 0.000058724 0.000051533 0.000032666 0.000077194 -0.000039981 0.000012409 0.000007012 -0.000020589 -0.000009515 -0.000030939 0.000014534 0.000003405 -0.000008068 0.000056874 -0.000028728 -0.000008868 0.000010818 -0.000053545 -0.000048143 0.000013415 0.000006873 0.000003439 -0.000104606 0.000269883 -0.000046753 0.000016721 0.000045547 -0.000038619 -0.000102730 0.000006916 -0.000010409 -0.000203491 0.000060737 -0.000230112 -0.000013028 0.000002637 -0.000023381 0.000046752 -0.000139437 0.000038138 -0.000010372 0.000024194 0.000036730 0.000027467 -0.000019545 0.000010296 0.000002307 -0.000004041 0.000112143 0.000006267 -0.000014185 -0.000015563 0.000051379 -0.000202196 -0.000009518 -0.000001071 -0.000021885 0.000050822 -0.000075472 0.000017402 -0.000007157 -0.000017706 0.000035951 -0.000111788 -0.000017944 0.000001819 -0.000090899 -0.000118892 -0.000222405 0.000006610 0.000000343 -0.000062987 0.000051461 -0.000060073 -0.000060573 0.000002926 -0.000061084 -0.000292913 -0.000118134 0.000025819 0.000003369 0.000171042 0.000009051 0.000361806 -0.000017710 0.000009584 0.000176571 -0.000216036 0.000470359 -0.000006386 0.000002570 -0.000029819 0.000243231 -0.000183301 0.000001458 -0.000001411 -0.000010042 0.000021843 -0.000024389 -0.000004409 -0.000002622 -0.000028802 -0.000003633 -0.000153583 0.000018933 -0.000000070 0.000067682 0.000028566 0.000243282 0.000024046 -0.000007317 -0.000015458 -0.000026533 -0.000032072 -0.000001492 0.000003476 0.000018173 -0.000017223 0.000171698 0.000007191 -0.000001936 0.000010939 0.000031895 0.000058516 -0.000008570 0.000003282 0.000012419 -0.000004623 -0.000021565 0.000025066 -0.000008436 -0.000000896 0.000019766 -0.000050130 0.000002967 -0.000003518 -0.000004698 -0.000001317 -0.000024396 -0.000011935 0.000003527 0.000014904 0.000020853 0.000057800 -0.000004288 -0.000000963 -0.000009457 -0.000002792 -0.000088829 0.000010358 0.000002666 0.000011735 -0.000004007 0.000079840 -0.000013591 0.000005202 0.000004942 0.000008932 0.000096223 0.000021348 -0.000004348 0.000022526 0.000020050 -0.000088176 -0.000059149 0.000001647 -0.000009888 0.000006837 -0.000349416 0.000013747 -0.000006301 0.000004366 0.000017826 -0.000050558 -0.000000992 0.000001560 -0.000005145 -0.000002132 0.000031156 0.000018199 -0.000002272 0.000041164 0.000012626 -0.000067067 -0.000009233 0.000005387 0.000001919 0.000005033 0.000080196 0.000003184 -0.000005552 0.000008566 0.000011253 -0.000135598 0.000014118 -0.000000206 -0.000007508 0.000002150 0.000152917 -0.000007720 -0.000003081 -0.000054922 -0.000020786 -0.000177355 -0.000008554 0.000004661 -0.000034585 -0.000057428 0.000215462 0.000009906 0.000003300 -0.000037558 0.000001995 0.000326898 0.000242360 -0.000287042 -0.000497383 -0.000007759 -0.000584972 0.000388676 -0.000249030 -0.000849677 0.000486643 0.000326907 -0.000132815 -0.000263739 -0.000404911 -0.000209422 -0.000636654 -0.000518503 0.000329113 -0.001413371 0.000810066 0.000627612 -0.000538522 0.000407850 0.000559047 -0.000583822 -0.000028981 -0.000031819 -0.000637986 0.000386422 -0.000739505 -0.000482231 0.000205947 -0.000158729 -0.000412726 0.000177780 0.000539835 0.000024085 0.000533602 -0.000379292 0.000258337 -0.000405917 0.000789417 -0.000447548 0.000650322 -0.000768034 -0.001228104 -0.000002448 -0.000007401 -0.000003814 -0.000015036 -0.000021747 -0.000010128 -0.000006715 0.000009833 -0.000035460 -0.000040131 0.000002506 -0.000016131 -0.000002050 -0.000010604 -0.000016251 -0.000003504 0.000004030 0.000001378 0.000001088 0.000009232 0.000001919 0.000002959 0.000001265 0.000005179 0.000010590 -0.000000463 -0.000004504 0.000001633 -0.000005757 -0.000011171 0.000007245 -0.000014546 -0.000006132 -0.000001488 -0.000003863 0.000003812 -0.000004726 -0.000000942 0.000003318 0.000003921 0.000003375 -0.000001089 -0.000001873 0.000005448 0.000004408 0.000008644 0.000001589 -0.000002747 0.000020629 0.000024787 -0.000007073 0.000001479 -0.000003685 -0.000008779 -0.000009413 -0.000009288 0.000001259 -0.000001453 -0.000019025 -0.000020853 0.000010606 -0.000006269 0.000008921 -0.000009915 0.000006322 0.000024451 0.000002675 -0.000021597 0.000070827 0.000090477 -0.000000400 0.000044535 0.000014382 -0.000006605 -0.000009811 -0.000029280 0.000008805 0.000038264 -0.000025717 -0.000029265 -0.000000673 -0.000022164 -0.000009866 -0.000041415 -0.000063370 0.000002070 0.000018622 -0.000005656 0.000043006 0.000078284 0.000002448 -0.000000918 -0.000000126 0.000003818 -0.000020970 0.000001839 0.000021225 0.000003836 0.000020124 0.000033600 0.000010171 0.000002749 -0.000001057 0.000011275 0.000003784 0.000015054 -0.000029294 -0.000006434 -0.000012320 0.000018091 -0.000120773 -0.000040073 0.000026527 -0.000114423 0.000046497 0.000070080 0.000010295 0.000023513 -0.000015030 0.000009868 -0.000028192 -0.000014848 -0.000004909 -0.000009577 0.000001218 -0.000001220 -0.000008247 -0.000007161 -0.000009044 0.000017166 0.000030645 -0.000000633 0.000000242 0.000002811 -0.000011420 0.000054993 -0.000018933 -0.000019372 0.000049137 -0.000035668 -0.000020107 0.000010171 0.000004500 -0.000027306 -0.000009215 -0.000025885 0.000003979 0.000008266 -0.000037969 -0.000004029 -0.000504833 0.000219414 -0.000160539 0.000000476 0.000203330 0.000903027 0.000043171 -0.000076440 0.000860141 -0.000603756 -0.000462899 -0.000268709 -0.000090759 -0.000371185 0.000595794 0.000036323 -0.000308571 -0.000097684 -0.000244528 0.000144143 -0.000855515 0.000106817 -0.000034781 -0.000436626 0.000246564 0.000596225 -0.000357676 -0.000012824 0.000570981 -0.000751395 0.000092581 0.000000745 0.000030860 -0.000019373 -0.000067358 -0.000033768 0.000012280 -0.000014249 -0.000048696 0.000017877 -0.000011844 -0.000024417 -0.000002585 -0.000060001 -0.000034880 0.077012527 -0.020189636 0.077255787 0.077796856 -0.071362657 0.289635929 0.005770333 -0.005807065 -0.005654520 0.141499778 -0.005970653 0.004615269 0.005081142 -0.074361571 0.121631947 0.016965703 -0.014950122 -0.016167623 -0.102442525 0.089556260 -0.009788250 -0.003235782 -0.002109500 -0.019231088 -0.006252217 0.008476726 0.002300644 0.000870266 0.016307764 0.003917072 -0.030954783 -0.009219644 -0.003265272 0.023166033 0.006797898 0.001131393 0.000309389 -0.000255995 0.001022998 0.000162407 -0.000118851 0.000279083 -0.000363662 -0.000461621 0.000681173 0.000361025 -0.000461782 0.000313671 0.000270155 0.000499284 -0.006409567 -0.002326076 -0.000596760 0.000843706 0.000516885 -0.001976375 0.000275882 -0.000707905 0.000627673 0.000044107 -0.001310606 -0.000237958 0.001083728 -0.000506632 0.000012795 0.001128827 0.000513553 0.000297226 -0.004849543 -0.001412720 0.000318240 -0.000038562 -0.000374243 -0.003571165 0.000035945 -0.000040022 0.000554939 0.000061782 -0.003023015 -0.000241638 0.000299112 0.000026033 -0.000089241 -0.001485260 -0.000335994 -0.000157283 -0.000085662 0.000017798 0.000817322 0.000266193 0.000118275 -0.000108191 0.000006838 0.001201019 0.000087489 -0.000104360 -0.000020944 -0.000009926 0.000434408 -0.000287396 -0.000081125 0.000034113 -0.000035578 -0.000023594 0.000089652 0.000047160 0.000031552 0.000001886 -0.000312576 0.000065441 -0.001355814 0.000551894 0.000203421 -0.000423452 -0.000108517 -0.000017755 0.000948765 0.000157256 0.000050296 -0.000027858 -0.000511821 0.000517067 0.000237462 -0.001695379 -0.000435616 0.000136051 -0.000346961 0.000150951 0.000062104 0.000064964 0.000002411 0.000032486 -0.000051007 0.000075489 0.000033349 0.000373765 -0.000040128 -0.000200705 -0.000069333 -0.000000563 0.000000932 -0.000018383 -0.000014723 -0.000011333 -0.000003114 0.000068242 -0.000061896 -0.000008452 -0.000013315 0.000015184 -0.000060597 0.000097827 -0.000025708 -0.000034786 -0.000022240 -0.000034810 0.000049620 0.000021083 0.000025981 -0.000002572 -0.000056654 -0.000010094 -0.000005425 0.000007384 0.000004179 -0.000083827 0.000022999 0.000028862 0.000067876 0.000009060 0.000113846 0.000126426 0.000047436 -0.000044848 0.000008043 0.000094748 0.000185950 0.000075256 -0.000007109 -0.000005011 0.000035209 -0.000094751 0.000049991 0.000042133 -0.000017109 -0.000076725 -0.000038951 -0.000013144 0.000033365 -0.000008995 -0.000002388 -0.000098105 -0.000050541 -0.000034702 0.000004511 -0.000076669 -0.000029317 0.000016419 0.000024728 -0.000007210 -0.000054895 -0.000080250 -0.000045824 0.000020409 -0.000001297 -0.000068899 -0.000034870 -0.000014288 0.000015014 -0.000008548 0.000025093 -0.000045618 0.000000378 -0.000005550 0.000002210 0.000047362 0.000187249 0.000084021 0.000015767 0.000008425 -0.000051424 -0.000147256 0.000125205 -0.000007793 -0.000021675 0.000253556 0.000577077 -0.000066538 0.000008834 0.000018620 0.000075072 -0.000221076 -0.000116178 -0.000046620 0.000003696 -0.000199298 -0.000104522 0.000174644 0.000013038 0.000034235 0.000000253 0.000091317 0.000006656 0.000030073 -0.000040463 -0.000004373 -0.000023617 0.000031551 -0.000000518 -0.000003466 0.000022797 0.000034947 -0.000002353 0.000018659 -0.000000334 -0.000048902 -0.000146297 -0.000044844 -0.000026859 0.000002102 0.000114710 0.000003084 -0.000072011 -0.000017667 0.000018756 -0.000010764 -0.000041836 -0.000046640 0.000012375 0.000004345 -0.000082029 -0.000090678 -0.000018084 0.000019966 0.000005783 -0.000030413 0.000006038 0.000028768 0.000003728 -0.000004164 0.000014546 -0.000035089 -0.000037475 -0.000031505 0.000000663 0.000016327 0.000013681 0.000012001 -0.000002299 0.000003040 -0.000095809 -0.000028760 0.000031970 0.000012921 -0.000008259 0.000020110 0.000033258 0.000039039 -0.000004076 -0.000001971 -0.000001192 -0.000037902 -0.000067928 -0.000010438 0.000001089 -0.000015084 -0.000011227 0.000022809 0.000011936 -0.000020562 0.000042271 -0.000018723 -0.000025940 -0.000036760 -0.000002137 -0.000124990 0.000130439 0.000373463 0.000027015 0.000000031 -0.000004055 -0.000037839 -0.000025097 -0.000011026 0.000002103 -0.000004475 -0.000004531 -0.000010095 0.000000907 -0.000001229 -0.000034822 -0.000066471 -0.000032343 -0.000020700 -0.000005993 -0.000035513 -0.000017931 -0.000020073 0.000016884 -0.000008596 -0.000026581 0.000004115 0.000047584 -0.000006913 0.000007379 0.000051148 -0.000049698 -0.000101865 -0.000000555 -0.000004821 -0.000026134 0.000121205 0.000053912 0.000006549 0.000013767 0.000106481 -0.000007993 -0.000068184 0.000025883 0.000005140 0.000008991 0.000019011 -0.000228071 0.000029179 -0.000031881 0.000421962 -0.000395250 -0.000118424 0.000198679 0.000114097 0.000219360 -0.000787872 -0.000134905 -0.000258772 0.000062408 0.000259561 -0.000006714 -0.000004344 0.000585890 0.000045202 0.000970143 -0.000057612 0.000383729 0.000246727 -0.000267527 -0.001096766 0.000275173 -0.000619678 0.000072099 0.000254806 0.000177608 -0.000369464 -0.001081603 0.000380073 0.000246011 -0.000395839 0.000438408 0.001298756 0.000059882 0.000050727 0.000992042 -0.001040615 -0.000747022 0.000024053 -0.000105539 0.000781455 -0.000782590 -0.001319744 -0.000031531 0.000132015 0.000001085 0.000001632 0.000007385 0.000021277 -0.000000112 0.000000312 0.000005587 0.000001994 0.000027684 0.000008951 0.000024036 -0.000011033 -0.000005048 0.000006042 0.000008007 -0.000006278 0.000003025 -0.000001386 -0.000002872 0.000000256 0.000000043 -0.000001333 -0.000004287 -0.000010044 0.000001315 -0.000002712 0.000001363 0.000005214 0.000009661 -0.000002996 0.000034396 -0.000012634 -0.000003122 -0.000006544 0.000009249 0.000009463 -0.000005060 -0.000001420 -0.000005931 0.000001166 0.000008064 -0.000003785 -0.000002232 -0.000008693 0.000002075 0.000001856 -0.000005262 -0.000003972 -0.000022764 -0.000001983 -0.000004681 0.000005595 0.000005550 0.000015412 -0.000001554 -0.000005570 0.000007341 0.000006127 0.000023379 0.000000429 -0.000033163 0.000016930 0.000009427 0.000005138 -0.000000763 -0.000005394 -0.000014559 -0.000010331 -0.000059839 -0.000015383 -0.000039678 0.000016208 -0.000003208 0.000000911 -0.000007921 -0.000030020 0.000026855 0.000004844 0.000027476 0.000002010 0.000025880 -0.000011054 0.000007036 0.000030789 0.000008666 -0.000031643 0.000003928 -0.000006761 -0.000036752 -0.000009770 -0.000000432 -0.000002348 0.000005941 0.000011266 -0.000008968 -0.000027066 0.000007991 -0.000005678 -0.000019811 -0.000003737 0.000002627 -0.000003220 0.000000371 -0.000005010 -0.000002316 0.000009333 -0.000003220 -0.000006063 -0.000016042 0.000021582 -0.000177964 0.000073336 0.000017860 0.000015894 0.000075581 -0.000123081 0.000023424 0.000031111 0.000005545 -0.000007018 0.000004371 -0.000000944 0.000000791 0.000005408 0.000011091 -0.000000122 -0.000001396 -0.000002613 -0.000007138 0.000013500 0.000018636 -0.000010487 -0.000004846 -0.000000229 -0.000004845 0.000143574 -0.000061278 -0.000013421 -0.000021326 -0.000010695 -0.000026731 0.000020988 0.000009054 0.000025893 0.000000981 -0.000041545 0.000028092 0.000008001 0.000028719 0.000006681 -0.000464584 0.000154112 0.000135566 0.000089067 0.000023718 0.001408499 -0.000582454 -0.000121068 -0.000187833 -0.000493289 -0.000366364 0.000195614 -0.000115566 -0.000089002 0.000379411 0.000100057 -0.000015620 -0.000079276 0.000006395 0.000223414 -0.000585098 0.000299562 0.000051125 0.000173426 0.000244663 0.000767161 -0.000356500 0.000069637 0.000056931 -0.000506474 0.000056580 -0.000012395 -0.000008955 0.000008346 -0.000017831 -0.000121630 0.000020914 0.000032201 0.000024691 0.000024030 -0.000124996 0.000008983 0.000045160 0.000058808 0.000015696 0.166918092 -0.005550495 0.478267289 0.002859954 0.002879220 0.573741605 0.003250049 0.023320740 -0.033559703 0.544314946 0.000624586 -0.049048412 -0.015074794 -0.000580097 0.057039726 0.000446176 -0.016907869 -0.300679717 0.025199825 0.016462412 0.000041860 -0.000167609 0.027399959 -0.052365243 -0.002852906 0.000300440 -0.063155019 0.013837247 -0.061138746 0.000009599 0.000325633 0.014087713 -0.063880397 0.053847244 0.008771499 0.000898135 -0.062265886 0.053103324 -0.264884676 -0.000237417 -0.000548448 -0.127739132 0.031255537 0.051991527 0.000654793 -0.000158725 0.031821305 -0.102475415 -0.033981954 0.022705891 0.000460057 0.039482960 -0.028044517 -0.124722362 -0.000417694 -0.000048057 -0.020465092 -0.006560597 -0.007051046 0.000378797 -0.000063562 0.015738253 0.003393933 0.003952285 0.000096217 0.000032272 0.021822852 0.006176065 0.004562618 -0.000719803 -0.000052615 0.001318857 0.024372858 -0.000933990 -0.002669604 0.000013089 0.000069615 -0.010881094 0.000546710 0.001242916 -0.000041728 -0.001465036 -0.021607119 0.000629447 0.003168044 -0.000763938 0.004984571 -0.009861174 0.022524996 0.001565158 -0.000577980 -0.006310440 0.007414612 -0.012737911 0.001428594 0.000053834 0.007728243 -0.001297964 -0.022442472 -0.001193564 0.000234603 -0.000829252 0.000194590 -0.001195906 0.000056935 -0.000028113 0.000068736 -0.000002615 0.000783578 0.000043317 0.000144550 0.000355506 -0.000289510 0.000469986 0.000040377 0.000010731 0.000059433 -0.000104785 0.000079455 0.000005843 0.000051816 0.000033757 -0.000096669 -0.000002182 0.000000664 -0.000073656 0.000138588 -0.000044538 0.000062715 0.000015518 -0.000045593 -0.000035357 0.000102869 0.000050219 -0.000022573 -0.000016297 -0.000025571 0.000051197 -0.000055760 -0.000001989 -0.000057074 -0.000069289 0.000086948 0.000302190 0.000033767 -0.000051886 0.000077027 -0.000032797 -0.000131551 -0.000017637 -0.000043963 0.000109590 0.000182099 0.000045135 -0.000061864 0.000064789 -0.000337897 0.000048229 -0.000367964 0.000027648 -0.000007308 -0.000098554 0.000053472 -0.000034103 0.000008148 0.000050556 0.000134564 -0.000179564 0.000098733 0.000030131 -0.000052387 -0.000039909 0.000011889 -0.000038251 0.000018969 0.000030662 -0.000038088 -0.000047831 0.000105176 0.000018360 -0.000005467 -0.000051087 -0.000051174 0.000039695 0.000010875 0.000034682 -0.000001164 -0.000039564 0.000010514 0.000000226 0.000009482 -0.000154989 -0.000028395 0.000054921 0.000005953 -0.000004860 0.000011085 -0.000162044 -0.000115412 0.000063274 0.000024394 -0.000275225 0.000271763 -0.000052306 -0.000131410 0.000036494 0.000125311 0.000220700 -0.000069583 -0.000007596 -0.000167376 0.000051021 0.000186814 0.000042418 -0.000038078 -0.000009695 0.000070130 0.000132362 0.000086332 -0.000006570 -0.000009722 0.000020946 -0.000057303 0.000014720 -0.000003692 0.000017356 -0.000060769 0.000051687 0.000008120 -0.000014772 0.000005700 0.000115907 -0.000010471 -0.000005277 0.000035480 0.000102173 0.000029964 0.000096232 -0.000018550 -0.000019570 -0.000023360 0.000015931 0.000050872 -0.000030499 -0.000003579 -0.000009805 0.000041594 -0.000028959 0.000046039 0.000019486 -0.000020688 -0.000019819 0.000018613 0.000010842 0.000003845 0.000052856 0.000017150 -0.000117927 0.000004978 0.000025332 0.000001785 0.000004785 -0.000000338 -0.000000689 -0.000010717 -0.000066734 -0.000009326 -0.000074806 0.000022572 0.000020191 -0.000001803 -0.000023185 0.000005111 -0.000001372 -0.000009394 0.000033103 0.000032102 -0.000033711 0.000000848 0.000021982 -0.000053568 -0.000006006 0.000014790 -0.000021602 -0.000001183 0.000070525 0.000019977 -0.000030070 0.000016977 0.000014053 -0.000187181 -0.000115814 -0.000080428 0.000063687 -0.000035537 0.000038794 0.000007388 -0.000047045 0.000018817 0.000010542 -0.000009046 -0.000000005 -0.000015925 -0.000004165 0.000003694 0.000060004 -0.000000035 -0.000041929 0.000034190 0.000029138 -0.000024016 -0.000003998 -0.000001698 -0.000001531 0.000008069 0.000003324 -0.000015365 -0.000027313 0.000031367 -0.000004174 0.000038033 0.000040616 0.000029080 -0.000038575 0.000006705 0.000014814 -0.000017695 0.000022998 0.000025878 -0.000024485 -0.000027676 0.000020987 0.000102599 -0.000058536 -0.000025036 0.000032825 0.000064796 0.000035506 -0.000075273 0.000008546 0.000399465 0.001192725 0.000735613 -0.002151356 -0.000529686 0.000572123 0.002051126 -0.004649132 0.000822189 -0.001257955 -0.000098816 -0.001545136 0.002972008 0.000931740 -0.000586702 0.000615159 -0.001771676 0.000843376 -0.000980750 -0.000215092 -0.000716920 -0.000006226 0.000371910 0.000797087 -0.000319376 -0.000277312 -0.002354608 0.001112321 -0.000326816 0.000079857 0.000124564 -0.000172286 0.000116381 -0.000210006 -0.000043075 0.000491657 -0.000596536 -0.000362751 -0.000394437 0.000038395 -0.000026989 -0.000189928 -0.000006244 -0.000364084 0.000009580 -0.000004586 0.000004442 0.000010696 0.000050824 0.000014704 -0.000006328 0.000030780 0.000063156 0.000079911 0.000009552 0.000013096 0.000019500 -0.000016316 0.000045100 0.000014014 -0.000003186 -0.000007251 0.000015993 -0.000011084 -0.000008075 0.000005124 0.000002639 -0.000005699 -0.000023085 -0.000005659 -0.000006050 0.000000764 -0.000002857 0.000015284 0.000013658 0.000020537 0.000038565 0.000001347 -0.000001726 -0.000008797 0.000006806 0.000004967 -0.000007354 -0.000012817 0.000001173 0.000007908 0.000004143 -0.000010293 -0.000016475 -0.000004997 0.000009127 -0.000005697 -0.000031504 -0.000057397 -0.000010893 -0.000009001 -0.000007307 0.000016210 0.000029601 0.000001434 -0.000010904 0.000000553 0.000026754 0.000052160 0.000008788 -0.000021710 0.000024091 0.000039594 -0.000032974 -0.000007133 0.000007856 -0.000118498 -0.000108125 -0.000158820 -0.000021359 -0.000024105 0.000012654 0.000021505 0.000086801 0.000007043 -0.000022786 -0.000063442 0.000159772 -0.000007596 -0.000005696 0.000011596 0.000096906 -0.000069996 0.000177208 0.000069024 -0.000005185 -0.000093414 -0.000059211 -0.000188048 -0.000038830 -0.000005179 -0.000012487 -0.000066574 0.000050840 0.000027785 -0.000006133 -0.000049849 0.000047567 -0.000078591 -0.000036000 0.000002239 -0.000013204 0.000005074 -0.000021835 -0.000008727 0.000015740 -0.000044803 0.000018961 -0.000071351 -0.000009275 -0.000086319 -0.000014123 0.000047485 -0.000086361 -0.000012836 -0.000055245 -0.000008201 0.000022550 -0.000089956 -0.000012213 0.000004418 0.000013148 0.000047289 -0.000025633 -0.000004057 0.000008024 0.000001701 0.000004689 -0.000015946 -0.000000694 0.000007183 0.000011688 -0.000041724 0.000044580 0.000015685 0.000083938 0.000121400 -0.000028571 0.000034007 -0.000008193 -0.000024080 -0.000011760 0.000079246 0.000036360 0.000000584 -0.000030433 -0.000010228 0.000030362 0.000058150 0.000012389 -0.000210578 -0.000588763 0.000266699 -0.000258364 -0.000078041 0.000719281 0.000722134 -0.001542978 0.000950328 0.000330145 -0.000074842 -0.000014169 0.000698493 -0.000655854 -0.000325183 0.000036398 0.000054613 -0.000144264 0.000092188 0.000081518 -0.000340833 -0.000328909 0.000520828 0.000138860 0.000017845 0.000287242 0.000101985 -0.001342581 0.000963537 0.000498899 0.000007584 0.000045757 -0.000094288 0.000092194 0.000039058 -0.000057438 -0.000078457 0.000216047 -0.000046181 -0.000048760 -0.000071845 -0.000130647 0.000118205 0.000056195 0.000021990 0.324862912 -0.024827999 0.052441590 -0.000239536 0.002332471 0.075706205 -0.005137631 0.029203256 -0.016118549 0.061932625 0.000440165 -0.001625990 0.065526317 -0.056764141 0.288136454 0.000120455 -0.000265092 0.003148485 -0.002795575 -0.003962305 -0.014316263 -0.022286787 -0.005502454 0.003491494 0.005175540 -0.001050256 0.000793403 0.023745283 -0.016408190 -0.021013982 0.000354326 -0.000355279 0.000837636 -0.000461863 0.000509924 0.000474323 0.000607477 -0.000592571 0.000541134 0.000444821 0.000126494 0.000551484 0.000217609 0.000737636 0.000944409 0.002438403 0.003314722 0.000576115 -0.000723786 -0.000389284 0.000285900 -0.001816992 -0.000018381 0.000475211 -0.000371352 -0.001531772 -0.002111043 -0.000794912 0.000267503 0.000496049 -0.001105320 -0.001612035 -0.002960452 0.002068730 0.004362279 -0.001705197 -0.003137578 0.003623643 -0.001981810 -0.003735944 0.002164292 0.000687735 -0.000304503 0.000626077 0.002195401 0.000076325 0.000110718 0.000389350 -0.000104561 -0.000385608 -0.000108640 -0.000049149 0.000000576 -0.000018118 0.000124450 0.000011577 -0.000107873 -0.000158967 0.000035915 0.000330477 0.000012843 -0.000026647 -0.000028575 0.000018360 0.000054224 0.000028277 -0.000000601 -0.000027314 0.000013283 0.000054395 -0.000020023 -0.000064633 -0.000065262 0.000012305 0.000033350 -0.000020319 0.000018459 0.000029948 -0.000014175 -0.000046398 0.000029737 0.000040931 0.000010091 0.000005277 -0.000069443 -0.000042595 0.000012619 0.000045818 -0.000000673 -0.000077299 0.000012159 0.000001055 -0.000102288 0.000004560 0.000031267 -0.000106858 -0.000044186 -0.000041835 -0.000031665 0.000048461 0.000053115 0.000050048 0.000189544 0.000004356 -0.000181585 -0.000007354 0.000018678 0.000075276 0.000001265 -0.000075040 0.000072115 0.000012788 -0.000061145 0.000049926 0.000085597 0.000022712 0.000047750 0.000009081 0.000020875 -0.000091390 0.000015777 0.000007138 0.000052152 0.000015124 0.000009742 0.000021539 0.000018106 0.000042380 0.000013140 -0.000017723 0.000014419 0.000003748 0.000013968 0.000002799 0.000021681 -0.000022807 0.000018325 0.000058702 -0.000018730 -0.000003974 0.000086963 0.000091165 -0.000014224 0.000068052 -0.000028979 -0.000189262 -0.000180842 0.000121661 -0.000148505 0.000043635 -0.000093614 -0.000153492 -0.000083111 -0.000076650 0.000028366 -0.000068027 -0.000078705 -0.000057812 -0.000027640 -0.000045236 -0.000090704 0.000020354 0.000004849 -0.000053654 -0.000023542 0.000018672 0.000000285 -0.000000721 0.000016570 0.000013223 -0.000012077 0.000004849 0.000042652 -0.000009950 -0.000011587 0.000005955 -0.000013017 -0.000065002 0.000007748 0.000006836 -0.000036656 -0.000018468 -0.000023428 -0.000027870 0.000027409 0.000003650 0.000028363 -0.000026852 0.000008830 -0.000032453 0.000024676 0.000051448 -0.000016966 0.000021401 -0.000019045 -0.000010387 -0.000002602 0.000013883 -0.000005468 -0.000009410 0.000057213 -0.000001348 -0.000004792 0.000020873 0.000032804 -0.000005390 -0.000010260 0.000001398 -0.000006147 0.000020478 0.000035607 0.000033602 0.000007249 0.000025699 -0.000024795 -0.000013972 -0.000017936 0.000018891 -0.000008958 0.000014518 0.000032241 0.000017528 -0.000025558 0.000021798 -0.000021805 -0.000008348 0.000007976 -0.000000797 -0.000004195 -0.000013672 0.000009501 -0.000018340 -0.000006098 0.000000841 0.000017209 -0.000019619 -0.000002254 0.000104689 -0.000004319 0.000019752 0.000021890 -0.000000100 0.000004429 0.000008349 0.000018479 0.000010825 0.000004998 -0.000002900 0.000004080 -0.000004780 0.000030928 0.000000415 0.000009814 0.000010409 0.000004407 0.000008879 0.000022586 -0.000004958 0.000012508 -0.000035316 0.000002040 -0.000009208 0.000026200 -0.000002142 0.000028343 0.000000248 0.000003537 -0.000039947 0.000000831 -0.000008119 -0.000028653 -0.000015754 0.000021763 -0.000017456 0.000020506 -0.000032257 0.000006579 -0.000038452 -0.000010336 -0.000020527 -0.000001018 0.000008855 -0.000065260 -0.000000904 -0.000016957 0.000795286 0.000169646 0.000083076 0.000204432 -0.000107154 0.002010070 0.001418415 -0.000892925 0.001364083 0.001032518 -0.000627510 0.000587823 0.000488855 -0.000634053 -0.000873707 -0.000190799 -0.000070838 0.000441858 -0.000400629 -0.000235453 0.000426014 0.000740310 -0.000164201 0.000072936 -0.000631502 -0.000136852 0.000314857 0.001089802 -0.000300516 -0.001208684 0.000103885 0.000174863 0.000089487 -0.000049064 -0.000112350 0.000048484 0.000005313 0.000249820 0.000001689 0.000014675 0.000042579 0.000034560 0.000052104 0.000031856 0.000018969 -0.000022340 -0.000006859 0.000005649 0.000004136 -0.000016632 -0.000014440 -0.000010023 0.000010060 -0.000003791 -0.000026014 -0.000008645 -0.000016565 -0.000005273 0.000003955 0.000015402 0.000007245 0.000010240 0.000002610 -0.000001260 -0.000007900 0.000010131 0.000004346 -0.000001544 -0.000000785 0.000002796 -0.000019807 -0.000009421 -0.000000398 0.000001702 0.000000680 0.000018483 -0.000006666 -0.000014875 -0.000003072 0.000047686 0.000000859 -0.000002157 -0.000004585 0.000000484 0.000016737 0.000009935 -0.000000800 -0.000003236 -0.000001524 0.000013778 0.000016516 0.000006470 -0.000006795 -0.000000374 0.000019477 -0.000005157 0.000000783 0.000004202 -0.000000104 -0.000014708 -0.000013621 -0.000005801 0.000006121 -0.000000694 -0.000022307 0.000001848 0.000015065 0.000003371 -0.000005932 -0.000025441 0.000036132 0.000029051 -0.000012410 0.000014090 0.000054391 -0.000006473 -0.000010255 -0.000007356 0.000002177 -0.000026169 -0.000035880 0.000031611 0.000056646 -0.000019031 -0.000097761 -0.000062954 -0.000069257 -0.000036443 0.000015359 0.000045557 0.000049623 0.000064761 0.000009048 0.000013471 -0.000007814 -0.000032370 -0.000028000 -0.000001926 0.000005837 -0.000000509 0.000035637 0.000038746 0.000020550 -0.000005787 -0.000043536 0.000004264 0.000006437 0.000002110 -0.000001907 0.000004302 0.000037910 0.000007971 0.000012003 -0.000009708 -0.000000941 0.000038718 0.000069233 0.000025906 -0.000021603 -0.000113388 0.000000736 0.000058740 0.000019298 0.000005598 -0.000062871 0.000009973 0.000009285 0.000005152 -0.000002072 -0.000009769 0.000007928 0.000001713 -0.000003621 -0.000002675 0.000007256 -0.000014232 -0.000029531 -0.000016362 0.000003395 0.000038596 0.000009232 -0.000041554 -0.000038381 0.000008720 0.000127075 -0.000011988 0.000011216 0.000013860 -0.000001252 -0.000042203 -0.000014415 0.000001112 0.000009755 -0.000002624 -0.000046956 0.000035531 0.000296136 0.000207305 -0.000065482 -0.000589113 -0.000471438 -0.000928057 -0.000475752 0.000257258 0.001360201 0.000548421 0.000467146 0.000067185 -0.000119262 -0.000283236 0.000056705 -0.000050055 -0.000044830 -0.000016551 0.000151158 0.000092912 0.000230105 0.000205524 -0.000069103 -0.000655157 -0.000729028 -0.000818369 -0.000206718 0.000218337 0.000707118 -0.000051763 -0.000069970 -0.000025857 0.000010203 0.000082062 0.000052402 0.000107045 0.000057038 -0.000027376 -0.000126499 -0.000019877 0.000043882 0.000059972 -0.000002807 -0.000119475 0.543845886 0.056056663 0.580720460 0.038471874 0.008204543 0.459929585 -0.263809922 -0.063097453 -0.076532978 0.286491705 -0.067541163 -0.069332942 -0.023160751 0.068939226 0.067573385 -0.076372963 -0.021478881 -0.069645158 0.078313303 0.025784294 -0.052105315 -0.018431505 -0.002729991 0.000727170 -0.028262591 -0.016523566 -0.310285592 0.008372998 0.000270907 -0.004177469 -0.004461743 0.008539339 -0.048839426 0.000169422 -0.009735248 -0.091342238 0.006898514 -0.019656775 -0.006448691 0.009477772 0.004271348 -0.088622252 0.014320676 -0.004637587 0.002051328 -0.029613035 0.018711494 -0.163507488 0.000179135 0.003652381 0.001775670 -0.004063837 -0.002280877 0.000142883 0.000092455 -0.005407710 0.000795377 -0.001089365 -0.000513609 0.000415642 -0.004478562 -0.000538191 0.000672524 -0.000017703 0.000224290 -0.000192256 -0.000020352 0.000344895 0.000012647 0.000022715 -0.000200159 -0.000075851 0.000192021 0.000059201 0.000065511 -0.000121531 -0.000343855 0.000790240 -0.000121879 -0.000024069 -0.000205775 -0.000164612 -0.000197211 -0.000008494 0.000050300 0.000617704 -0.000085844 0.000085740 0.000044235 -0.000039083 -0.001872152 0.000070111 0.000037822 -0.000238290 0.000124803 0.000193828 0.000109649 0.000112104 0.000027213 -0.000000320 -0.000642872 0.000213329 0.000133866 -0.000039179 -0.000003373 0.001251319 -0.001119721 -0.000446070 0.000042992 -0.000034741 0.000207966 -0.000292400 -0.000126973 -0.000020579 -0.000022758 -0.000202198 0.000292972 0.000165063 0.000030516 0.000022259 0.000199458 -0.000079868 -0.000016421 -0.000035907 -0.000023637 -0.000134845 0.000070790 -0.000029466 0.000021605 -0.000001599 0.000060910 -0.000025501 -0.000013019 0.000004174 -0.000007188 0.000029648 -0.000001288 -0.000021381 0.000026800 0.000010281 0.000023669 -0.000086918 0.000079794 -0.000017509 0.000012537 -0.000031468 -0.000159559 0.000147987 -0.000033404 0.000010077 0.000114625 0.000086777 -0.000246366 0.000051685 -0.000025819 -0.000133236 -0.000031034 0.000005203 -0.000014956 0.000003288 -0.000016043 -0.000043917 0.000100402 -0.000062901 0.000012472 0.000049042 -0.000011347 0.000033248 -0.000006327 -0.000015849 -0.000054714 0.000011918 -0.000004992 0.000012220 -0.000002117 0.000129941 0.000070955 -0.000179083 0.000032227 -0.000010922 -0.000153705 -0.000074386 0.000171893 -0.000052086 0.000017892 0.000012717 0.000027708 -0.000021846 0.000011946 0.000005916 0.000071224 0.000019125 -0.000060914 -0.000004404 -0.000005458 0.000077108 -0.000065430 0.000059536 -0.000009140 0.000006302 -0.000006216 -0.000009882 -0.000004291 -0.000006974 -0.000000365 0.000002276 0.000032117 0.000020506 0.000023267 0.000001806 -0.000020899 0.000014105 0.000007219 0.000013141 0.000003049 0.000045455 -0.000008181 0.000002424 -0.000003984 -0.000006816 -0.000022307 0.000009995 -0.000014970 0.000008920 0.000000615 0.000000059 -0.000001535 0.000001564 -0.000016717 -0.000004864 0.000019399 0.000010667 -0.000020199 0.000001463 -0.000004120 -0.000033459 -0.000000416 0.000033242 -0.000004411 0.000004438 0.000031171 0.000028008 -0.000042207 0.000035661 -0.000009260 -0.000000952 0.000012331 0.000006725 0.000012802 0.000002672 0.000008990 0.000006109 -0.000004210 0.000001071 -0.000002484 0.000006201 0.000003981 -0.000001919 0.000004371 0.000001393 0.000030497 -0.000001835 -0.000030272 -0.000010304 -0.000007417 -0.000005292 0.000010890 0.000005903 0.000017158 0.000003828 -0.000010048 -0.000010014 0.000013606 -0.000010384 0.000003040 -0.000012451 -0.000003028 -0.000003539 0.000008512 0.000001943 -0.000010051 -0.000024266 -0.000005676 -0.000013595 -0.000000612 -0.000001871 -0.000014654 0.000024549 -0.000021107 0.000000514 0.006884996 -0.015664070 0.010665557 0.003003550 0.000441104 -0.019666208 -0.015892567 0.028010366 0.000904671 0.000350678 0.025484599 0.042585888 -0.016978250 0.002391534 -0.000316314 0.005895258 -0.003102122 -0.007590515 0.000755132 -0.000979545 0.006857296 0.010439990 0.006193717 0.001010797 -0.000110348 -0.017944707 -0.010007239 -0.022456291 -0.001477737 0.001053065 -0.000366739 0.000017963 0.000113873 0.000070804 0.000329754 0.001584434 -0.000631100 -0.000879968 0.000355990 -0.000059698 0.000164439 -0.000667698 -0.000430780 0.000312475 -0.000026071 0.000014757 0.000002848 -0.000073878 0.000046974 0.000061502 -0.000032840 -0.000191479 -0.000009671 0.000069599 0.000057177 0.000026699 -0.000030822 0.000011938 0.000044713 0.000068353 -0.000005087 0.000033245 -0.000017938 -0.000014748 -0.000030970 0.000002526 0.000000257 0.000003708 -0.000015989 -0.000022757 0.000017124 -0.000045390 0.000030123 0.000014373 0.000045436 -0.000105018 -0.000078368 -0.000007550 0.000051132 0.000036983 0.000000067 0.000000439 0.000025024 0.000003568 0.000007805 -0.000010583 0.000005642 0.000014430 -0.000005344 -0.000014490 0.000014375 0.000068503 0.000004917 -0.000047909 -0.000047934 -0.000011619 0.000002864 -0.000058856 0.000022564 0.000015847 -0.000020087 -0.000054792 -0.000041582 0.000039017 0.000042061 -0.000282219 0.000118561 -0.000072144 -0.000067804 -0.000039962 -0.000215784 0.000415018 0.000473869 -0.000127499 -0.000097289 -0.000160149 -0.000212255 -0.000068053 0.000090749 0.000015595 -0.000399053 0.000007938 0.000676021 -0.000133148 0.000087988 0.000288527 -0.000393270 0.000038512 0.000274299 0.000349316 0.001012636 0.000270919 -0.000212729 0.000079615 -0.000387465 0.000163076 0.000063396 -0.000005764 0.000015809 0.000019719 -0.000020133 0.000117736 0.000046602 -0.000122264 -0.000183406 -0.000030962 0.000059982 0.000044064 -0.000056697 -0.000014914 0.000079881 -0.000074099 0.000105672 -0.000025745 -0.000116301 0.000207926 -0.000083031 -0.000364583 -0.000062020 0.000104275 0.000051570 0.000167904 -0.000276253 -0.000101330 -0.000005226 -0.000036615 -0.000183141 0.000041266 0.000010867 0.000051980 -0.000064331 0.000005231 0.000028203 0.000002775 0.000039984 -0.000019297 -0.000010193 0.000107444 0.000035539 0.000061256 -0.000214284 -0.000162380 0.000125899 0.000120187 0.000062973 -0.000036852 -0.000032731 -0.000030457 0.000029591 0.000036453 0.000027277 -0.000024471 -0.000134217 0.000027548 0.000053142 0.001007147 0.000542461 -0.001003755 -0.000551909 -0.000198441 -0.000669814 0.000458522 0.001093395 0.000703720 -0.000513835 -0.000549811 -0.000640270 -0.001255950 -0.000017900 0.000713833 0.000091549 -0.000170902 0.000139199 0.000341241 0.000535114 0.000467179 -0.001054861 -0.000554343 -0.000439436 -0.000202286 0.000983404 -0.000007562 0.000674971 0.000199902 -0.000923546 0.000004576 0.000011033 -0.000029181 0.000096351 0.000037789 0.000019894 0.000044647 0.000061653 -0.000043195 0.000017942 0.000303593 0.000063013 0.000213692 -0.000055050 -0.000018562 0.081509395 0.001695442 0.055453096 0.000588957 0.019604991 0.333849022 -0.000259707 -0.002025138 -0.007630640 0.053972807 -0.032065302 -0.001149249 -0.002538159 0.005468979 0.544451893 -0.010196288 0.002644044 -0.007968600 0.031519712 0.297712150 -0.013081135 0.001213630 -0.000414165 0.007559622 0.057030644 -0.000239425 -0.000127951 0.000105949 0.000028388 0.001568494 -0.001381909 -0.000014452 0.000035674 0.000037927 -0.000641097 -0.000892250 0.000361400 -0.000335211 0.000426324 -0.017662262 0.000010904 0.000036577 0.000025586 0.000091569 -0.000243703 0.000025583 -0.000006360 0.000032874 0.000007368 -0.001410901 -0.000076237 0.000053042 -0.000108408 0.000248584 0.004029501 -0.000136563 0.000030836 0.000006084 0.000003589 -0.000369743 0.000111782 -0.000013858 0.000063206 -0.000006346 0.000764937 -0.000611442 0.000021250 0.000129475 -0.000024660 0.004493944 0.000120976 -0.000002433 -0.000024635 0.000006251 0.000020530 -0.000070866 0.000052154 -0.000002397 -0.000035162 -0.001371056 0.000043665 -0.000025773 0.000072724 0.000034598 0.002861626 -0.000049933 -0.000006834 0.000031743 0.000015164 0.001267139 0.000059046 -0.000011585 -0.000034179 -0.000015342 -0.001049056 -0.000016237 0.000000497 0.000049116 0.000005970 0.000754192 -0.000028741 -0.000012062 0.000021177 -0.000011149 -0.000569836 -0.000013680 -0.000004735 0.000012403 0.000004717 0.000156102 0.000015911 -0.000010047 -0.000011738 -0.000004203 -0.000261735 -0.000075205 -0.000021491 -0.000001320 0.000006117 0.000202466 -0.000033768 -0.000013453 0.000010743 0.000015432 0.001464533 0.000011281 0.000008605 0.000004655 -0.000011108 -0.000273041 0.000022543 0.000026407 -0.000026096 0.000029115 -0.000139219 -0.000023623 0.000008028 0.000019079 -0.000002777 0.002371044 -0.000008361 0.000014816 0.000021839 -0.000004281 -0.000866668 0.000004939 -0.000006670 0.000000587 0.000009642 0.000136271 0.000023206 0.000002469 0.000010912 -0.000032348 -0.001548919 -0.000019701 -0.000006020 -0.000014750 0.000038892 0.001986799 0.000039267 0.000010125 -0.000016728 -0.000013614 -0.000608480 0.000012833 0.000007374 0.000011257 -0.000016364 -0.000694698 -0.000000696 -0.000006696 0.000002963 0.000006449 -0.000126959 -0.000016905 -0.000001192 0.000005610 0.000000751 0.000256904 0.000028584 -0.000009546 -0.000006295 0.000006809 -0.000444728 0.000010164 0.000001052 -0.000007509 -0.000002399 -0.000141472 -0.000013966 -0.000006113 0.000015056 0.000004651 -0.000078292 -0.000001751 -0.000000329 -0.000004595 -0.000002161 0.000076903 -0.000000634 0.000001019 0.000006121 0.000003228 -0.000097678 -0.000007042 0.000000977 0.000005260 -0.000003104 -0.000067416 0.000008172 -0.000001853 -0.000009311 0.000009044 0.000178267 -0.000030266 -0.000003285 0.000007499 -0.000009137 -0.000053281 0.000013198 -0.000004970 -0.000003938 0.000001284 -0.000198191 0.000000747 -0.000000581 0.000003614 0.000000463 -0.000083904 0.000003352 -0.000008088 0.000003925 0.000004250 -0.000069608 -0.000010085 0.000000615 0.000013096 -0.000001700 -0.000066822 0.000006236 -0.000003943 -0.000006031 -0.000002575 -0.000109378 0.000008851 0.000002719 -0.000004351 0.000002633 0.000033270 0.000002783 0.000006406 -0.000008120 -0.000003357 0.000008139 -0.000000285 0.000007555 0.000000522 -0.000004975 0.000078597 0.000010358 0.000005936 -0.000003725 0.000004185 0.000037345 0.002543992 0.001297381 0.001029212 0.000943272 -0.251482397 -0.001592937 0.000030105 -0.000518468 0.001075770 -0.219512315 0.004247670 0.001250238 0.002626303 -0.008433596 0.071151674 0.001314404 0.000215169 -0.000301558 0.000760051 -0.189144620 0.003455982 0.000543842 -0.000121334 -0.003954072 -0.070354703 -0.004718360 -0.000668868 -0.000670787 -0.002398348 -0.091712748 0.000069332 -0.000274755 0.000331665 -0.000730610 -0.009087127 0.000330835 -0.000190801 0.000083805 0.000203542 -0.008034232 0.000290566 -0.000471436 0.000177101 -0.000173354 -0.012539737 0.000055310 -0.000067731 -0.000018492 0.000004206 -0.000834297 0.000169688 -0.000026214 -0.000026889 0.000051743 -0.000823229 0.000084258 -0.000090743 -0.000023374 0.000028840 -0.000803995 -0.000019080 0.000037525 0.000016037 -0.000029249 -0.000182912 -0.000031225 0.000023285 0.000009753 -0.000008832 0.000129260 0.000005657 -0.000049626 -0.000024856 0.000030276 0.000486035 0.000043790 0.000018282 -0.000009435 -0.000025595 -0.000582246 -0.000013348 -0.000007620 -0.000004497 -0.000006889 -0.000023479 -0.000007221 0.000014619 0.000003640 -0.000004096 -0.000033362 -0.000085470 0.000050773 0.000011636 -0.000041482 0.000598649 0.000030335 -0.000009784 -0.000004112 0.000000772 -0.000458798 0.000068503 -0.000028567 -0.000016615 0.000026778 -0.000400122 -0.000022714 0.000105175 -0.000056069 -0.000013947 0.000006538 -0.000458613 -0.000006999 0.000119014 -0.000048591 0.002583671 -0.000102625 0.000084546 0.000035051 0.000013392 0.003726069 0.000320594 -0.000027305 0.000002212 0.000037329 -0.004488851 -0.000103590 -0.000323324 -0.000081511 0.000182687 0.003825427 -0.000774647 -0.000027484 0.000075312 -0.000038948 -0.001698542 -0.000018215 -0.000200982 0.000004142 0.000088694 0.000836600 -0.000028308 0.000206616 0.000099860 -0.000041893 -0.000738349 0.000006695 0.000077356 0.000038524 0.000004741 -0.000340238 -0.000085021 0.000071436 0.000089250 0.000043367 -0.001278100 -0.000013603 -0.000014751 -0.000339301 -0.000399454 0.005464966 -0.000128676 0.000071601 0.000024866 -0.000266926 0.004281862 0.000012375 -0.000023069 0.000041874 -0.000028786 -0.000101219 -0.000016579 -0.000015820 -0.000057564 -0.000101456 0.000922909 0.000042620 -0.000052905 -0.000039564 0.000064466 0.000887769 0.000164194 -0.000035264 0.000106092 0.000164154 -0.003686765 0.000032267 -0.000012151 0.000022556 -0.000039527 -0.000270602 0.000045246 -0.000036899 -0.000067718 -0.000004258 0.000080598 -0.000583053 0.000307115 -0.000538544 -0.001515294 0.017635514 0.000768135 -0.000736420 0.001558255 0.003876636 -0.031238435 -0.000029754 0.000566450 -0.002474109 -0.005886417 0.008535073 0.000259222 -0.000870936 -0.000206021 -0.000060786 -0.004247398 -0.000353306 0.000373847 -0.002317819 -0.001229402 0.014044669 0.000320213 -0.000670599 0.000325796 0.003855832 -0.017233075 0.000119247 -0.000123778 0.000033185 0.000408789 -0.003206220 -0.000020520 0.000138651 -0.000087915 -0.000597237 0.004134319 -0.000046961 -0.000207386 0.000398100 0.000046896 0.004057664 0.579013422 -0.073774571 0.561134441 0.013713204 -0.018099935 0.523173483 0.010387845 -0.014862526 0.068608661 0.530085714 -0.002889314 -0.024826675 -0.007735680 0.021041181 0.524103137 -0.001537172 -0.001168396 -0.213292116 -0.104147231 0.064784045 -0.001413732 -0.000816140 -0.107697204 -0.116046992 0.039510769 0.004868907 -0.000834169 0.062690697 0.037818108 -0.069994519 -0.001087975 -0.000813514 -0.053723170 -0.030171394 -0.020076749 -0.001035551 0.001973927 -0.027406060 -0.184834634 -0.110323438 0.003077271 -0.005200508 -0.019457523 -0.116048038 -0.138432851 0.001492227 0.000555592 -0.151481489 0.049992190 0.001256703 -0.001815137 -0.001342117 0.050498022 -0.114349735 -0.002636373 0.005675328 -0.001022863 -0.004074978 0.003735749 -0.076438098 0.001328221 -0.000182313 -0.003478266 0.006947504 -0.026371087 -0.002396873 -0.000121299 0.001647149 -0.005349104 0.019119233 0.000767937 0.000543920 0.001541394 -0.001464404 -0.000800070 -0.001182515 -0.000288344 -0.023666136 -0.013065700 0.008380513 0.000090775 0.000098000 0.018119946 0.009190746 -0.005779972 -0.000429216 0.000037788 -0.001256850 -0.000767731 0.000421330 0.001998419 -0.000046077 0.003454082 0.023295809 0.016119608 0.000764099 -0.000395958 0.001886361 -0.020983674 -0.010154132 0.001605086 0.000668617 0.004280298 -0.000765100 0.002447194 0.003300563 -0.000376471 -0.000025368 0.000163629 0.000836432 0.000023835 0.000676383 0.000130733 0.000554943 -0.000127595 -0.000287723 0.000594696 -0.000680591 0.000756100 -0.000405641 -0.000181276 0.000137364 0.001202530 0.001021080 -0.000139056 -0.001817454 0.000104512 -0.001715242 0.000941468 0.000564095 0.002099280 -0.000123750 -0.000338400 0.000331222 0.000888168 -0.000559397 -0.000021864 -0.000303319 -0.001756268 -0.000980033 -0.001042710 0.000216574 -0.002152703 -0.003583011 -0.002916417 -0.000305984 0.000229486 -0.001778579 -0.002685508 -0.003071585 0.000255525 0.000045745 0.000640825 0.001007484 0.000903771 -0.000429714 -0.000178285 -0.000825615 -0.000681608 -0.001097540 -0.000151385 -0.000053973 -0.000374865 0.000043317 0.000176674 -0.000196636 0.000177040 -0.000110144 -0.000170921 -0.000045642 0.000143942 -0.000119145 0.000115249 0.000115827 -0.000072869 -0.000236274 -0.000010028 -0.000017715 0.000042762 0.000259963 -0.000132271 0.000098094 -0.000326169 -0.000744226 0.000001678 0.000367172 -0.000158421 -0.000125253 -0.000000354 -0.000236960 -0.000137786 0.000204817 -0.000031927 -0.000125796 0.000336162 -0.000243488 -0.000075557 0.000194739 0.000492580 -0.000105312 -0.000118644 0.000016085 0.000199064 0.000255171 0.000054894 -0.000088446 -0.000058682 0.000193761 0.000172383 -0.000138531 -0.000175674 0.000114346 0.000122238 0.000110063 0.000067840 -0.000136760 -0.000043626 0.000156006 0.000326765 -0.000074682 0.000060704 -0.000057859 0.000048284 0.000107058 -0.000090746 0.000058423 -0.000008504 0.000015814 0.000070072 -0.000013549 0.000083448 0.000063579 -0.000017400 -0.000005847 0.000045591 0.000070696 -0.000065024 -0.000076957 -0.000006918 -0.000045705 -0.221405328 0.080546733 -0.002258534 0.001500769 0.008622134 -0.354914693 0.119182160 -0.000477839 -0.002653206 0.007435439 0.105246207 -0.147681923 0.002957904 -0.001502882 -0.004853022 -0.097635555 -0.115564281 -0.085089011 -0.006576357 -0.020189822 -0.107775082 -0.051632785 -0.007193182 -0.093811710 0.047726782 -0.042790808 -0.201889542 -0.031216790 0.056580444 -0.202720223 -0.003212500 0.017060089 0.004204302 0.006944174 -0.004360552 -0.014730391 0.008464423 -0.006158075 -0.005736094 0.001779289 -0.013643978 0.010765622 0.020573572 0.014946843 -0.008998771 -0.000624903 -0.000112085 0.000025516 -0.000055048 -0.000034249 -0.000463254 -0.000245791 0.000097528 0.000059628 -0.000109527 -0.000637491 -0.000488435 -0.000004301 -0.000137353 0.000042757 -0.000306644 0.000094376 -0.000027528 -0.000025580 0.000024952 0.000147542 0.000059807 -0.000024943 -0.000022336 0.000064145 0.000615073 -0.000023045 0.000036016 0.000053025 -0.000022510 -0.000561367 -0.000398175 0.000028319 -0.000044250 0.000028252 -0.000004688 -0.000094034 -0.000009984 -0.000029191 0.000030849 -0.000027036 -0.000046786 0.000014374 0.000008897 -0.000000101 0.000453051 0.000119913 -0.000000257 0.000013327 0.000059372 -0.000349749 0.000013967 -0.000029273 -0.000025090 -0.000037386 -0.000236571 -0.000055660 0.000014127 0.000018522 -0.000050523 0.001930746 0.000675676 0.000036847 0.000021454 -0.000044273 -0.000611307 0.000372957 0.000091229 -0.000124488 0.000386590 0.002398644 0.000373965 -0.000158525 0.000206862 -0.000116061 -0.001207856 0.000196204 0.000042244 0.000042301 -0.000379082 0.003370247 -0.001112327 -0.000057549 0.000042896 0.000145276 -0.002632880 0.001455185 -0.000058177 -0.000110893 -0.000136999 0.000783333 -0.000221153 0.000036150 0.000035003 -0.000132316 -0.000959739 0.000654365 -0.000004128 -0.000007118 -0.000035439 -0.000416246 0.000065504 -0.000016969 0.000019854 -0.000130158 0.000234161 0.000223210 -0.000262878 -0.000076489 0.000176310 0.002866924 0.001841747 0.000124935 0.000139064 -0.000565814 0.002459600 0.001136780 -0.000315638 0.000084476 -0.001246807 0.000321324 -0.000038433 -0.000968434 0.000535508 0.000984450 0.000740567 -0.000307749 0.001127868 0.000446743 -0.000440637 0.000492940 -0.000601472 0.000206755 0.000181566 0.000654863 -0.002845768 -0.001753706 0.000236320 -0.000349835 0.000791961 -0.000079171 0.000178713 -0.000362714 0.000011601 -0.000506251 0.000264279 0.000456731 0.000174280 0.000032766 -0.000090441 0.012552298 0.008700093 -0.001165534 0.001997466 -0.002345950 -0.029055819 -0.024983326 0.000446115 -0.003270158 0.006970533 0.000124762 0.006787087 -0.003139366 0.004717789 0.000399733 -0.003340425 -0.001756864 -0.000559827 0.000589088 -0.000024483 0.009591295 0.009094734 0.001783229 -0.000794407 -0.003052265 -0.009501382 -0.015626030 -0.000340114 -0.001550105 0.002189731 -0.000963243 -0.000911505 0.000485927 0.000081698 0.001103157 0.002304607 0.002612088 -0.000868723 -0.001240578 -0.002926919 0.002524560 0.001546427 0.000038034 0.000822512 -0.000247942 0.234086772 0.110839065 0.125669169 -0.069291917 -0.047171133 0.074789269 -0.000930542 -0.017166622 -0.016997272 0.056568432 -0.000320940 -0.010644125 -0.009285420 0.024357267 0.201650977 -0.000133573 0.008083580 0.006789211 0.027536693 0.123638755 -0.023148349 0.018386144 -0.001104811 0.002026601 -0.003683467 -0.012421172 0.009560212 -0.000084442 0.023987862 -0.017346042 0.008467100 -0.006653546 0.000137152 0.017180375 -0.012698491 0.000715983 -0.000838585 -0.000132942 0.001059433 -0.000390798 -0.000152900 0.000651501 -0.000497026 -0.000576882 0.000033818 -0.000571569 -0.000074109 0.000148785 -0.000174153 0.000598536 -0.003673918 0.004244786 0.000051313 0.001019200 0.000273880 0.003577150 -0.001933418 0.000304321 -0.000613888 0.000932142 -0.000683097 -0.000211834 0.000811913 0.000334923 -0.000038907 0.000959632 0.001043439 0.000406688 -0.004670248 0.004679948 -0.001496727 0.001783068 0.000311480 0.001900460 -0.001251182 -0.000373491 -0.000245599 0.000057087 -0.001241035 0.001349972 0.000064847 -0.000036874 0.000042095 -0.000081183 -0.000031490 -0.000009956 -0.000063292 0.000017426 -0.000198632 0.000215668 -0.000076082 -0.000084134 -0.000023116 0.000040544 -0.000034637 0.000369143 -0.000292658 0.000301262 0.000137289 0.000166146 0.001000041 -0.000458692 -0.000474527 0.000199020 0.000455143 0.000397436 0.000239522 -0.000048301 -0.000206149 0.000301768 0.000173762 0.000024848 -0.000119527 0.000597946 -0.000459960 -0.000009746 0.000176287 -0.000095530 0.001257989 -0.000699018 -0.000225626 0.000188998 -0.000023846 0.000842743 -0.001138218 0.000029279 -0.000052647 0.000019879 -0.000415325 0.000368593 0.000030171 0.000009128 -0.000018565 0.000431529 -0.000394358 0.000010940 0.000001047 -0.000022741 0.000034154 -0.000045364 -0.000031100 -0.000014329 -0.000037956 0.000011146 0.000015307 -0.000023230 0.000028966 0.000038927 -0.000030088 -0.000002595 -0.000027496 -0.000014235 -0.000033538 -0.000044585 0.000103857 -0.000051979 0.000132161 -0.000040932 0.000164953 -0.000017154 -0.000171595 -0.000034524 0.000043234 0.000030391 -0.000193144 -0.000082100 0.000027128 -0.000023124 -0.000043687 0.000067432 0.000171268 -0.000151691 -0.000023021 -0.000026180 -0.000011447 0.000084800 -0.000072741 -0.000007455 -0.000062456 0.000068754 0.000074881 -0.000038800 0.000000433 -0.000024741 0.000013952 0.000077974 -0.000022880 -0.000027627 -0.000045055 0.000133744 0.000115420 -0.000102532 -0.000013395 -0.000014257 -0.000001552 0.000019862 -0.000052511 0.000013071 0.000003307 -0.000032222 0.000017642 -0.000008716 0.000003153 -0.000005816 -0.000012722 -0.000005374 0.000010897 0.000005509 -0.000011092 0.000021551 -0.000011650 -0.000002404 0.000006154 0.000028252 -0.000019555 -0.000624328 0.000584034 -0.002193197 0.000021443 -0.000603155 0.000855162 0.000458259 -0.002892555 0.000736024 0.000443099 -0.001250454 -0.001893528 0.003562238 -0.001735990 -0.000820209 0.005943885 -0.008029917 0.023824479 -0.001460955 0.001684140 0.002189477 -0.007261364 0.016511439 -0.002913094 0.011989778 0.000737522 0.006553399 -0.010923547 -0.003667620 0.005853542 -0.000135673 0.000230012 -0.001181135 0.000229320 -0.000273589 0.000741981 0.000276664 0.001280900 0.000395930 0.000375293 -0.001141375 0.002207646 -0.005397472 -0.000073484 -0.000717804 -0.000004095 0.000026753 -0.000025749 0.000022923 0.000003466 -0.000026051 -0.000057267 -0.000012553 0.000024414 0.000023276 0.000004721 0.000020054 -0.000006407 0.000038584 0.000001027 0.000016926 0.000021856 -0.000002806 -0.000005917 -0.000005312 0.000017603 0.000033851 0.000009915 -0.000016682 -0.000025240 -0.000000762 -0.000010503 0.000014671 -0.000011987 -0.000013594 -0.000003887 -0.000021065 0.000004247 0.000020709 0.000012570 0.000002662 0.000010161 0.000002551 0.000001103 -0.000001538 -0.000004409 -0.000023054 0.000001591 0.000002365 0.000013744 0.000013938 0.000005946 0.000017996 -0.000018714 -0.000028263 -0.000008231 0.000007569 -0.000021739 0.000013712 0.000024282 -0.000006210 -0.000005022 -0.000011381 0.000005567 0.000009690 0.000006407 0.000130042 0.000000591 0.000013063 -0.000118990 0.000114875 0.000232794 -0.000010704 -0.000162833 -0.000173002 -0.000053900 -0.000106027 0.000038574 0.000028365 0.000086678 -0.000047084 -0.000043186 -0.000023860 0.000071831 0.000097018 -0.000021882 -0.000005434 0.000024392 -0.000018930 -0.000017099 -0.000014673 0.000038182 -0.000071557 0.000029295 0.000051027 -0.000047303 -0.000137511 0.000033073 0.000067024 0.000045352 -0.000022103 0.000002450 -0.000025397 0.000025616 -0.000006488 -0.000039717 -0.000097892 0.000001723 0.000068761 0.000061358 -0.000011321 0.000248324 -0.000033396 0.000039852 0.000050052 0.000098451 -0.000377923 0.000077916 0.000299564 -0.000169054 -0.000253324 0.000508835 -0.000114608 -0.000042599 0.000051880 -0.000156593 0.000749644 -0.000013245 -0.000288336 -0.000261031 0.000480060 -0.000770938 0.000211726 -0.000298906 -0.000121411 0.000167560 -0.000289194 0.000323199 0.000061583 -0.000250218 0.000116408 0.000035979 -0.000022708 -0.000089942 -0.000110026 -0.000069627 0.000202490 -0.000110598 -0.000053902 0.000217775 0.000012991 -0.000153675 0.000060806 0.000082071 -0.000028855 -0.000444680 -0.001603858 0.000028435 0.000276452 0.000975278 0.000722380 0.000348618 -0.000085852 -0.001157104 -0.000194838 0.000249824 -0.000117029 -0.000322000 -0.001119053 0.001605363 0.000130241 0.000606764 -0.000100918 -0.000137870 0.000269369 -0.000327980 -0.000223348 -0.000079258 0.000485645 0.000050275 0.000031237 0.000243763 0.000252521 0.000168667 -0.000513392 0.000041162 0.000310947 0.000056077 0.000118002 -0.000745694 -0.000084414 0.000014709 -0.000099042 0.000456825 0.000601247 -0.000061480 0.000136058 -0.000065902 0.000124779 0.000070178 0.155964757 -0.000485248 0.526789035 0.000539093 0.042095200 0.499099473 -0.000169963 -0.012298983 -0.031250765 0.560864140 0.000336943 -0.055227307 0.006286948 -0.032523012 0.055365141 0.000151867 0.006830439 -0.063813492 0.058960833 -0.011429272 0.000695347 -0.032944076 0.058074298 -0.269841934 0.038619509 0.000231229 -0.207625303 -0.104160632 0.061901987 0.005028289 -0.000155036 -0.103810848 -0.113050322 0.040109305 -0.005415083 -0.000131037 0.063484979 0.041185174 -0.075724858 0.024409526 0.000228442 -0.085726545 -0.016439901 -0.010078844 -0.001043179 0.000337167 -0.016663203 -0.163948753 -0.057864085 0.001619263 0.001150575 -0.011491335 -0.053246015 -0.121519049 -0.003754323 -0.000152100 -0.000714690 0.000131276 -0.004444669 0.000548826 0.000332844 -0.003639161 0.007578116 -0.028364658 -0.000271017 0.000114492 -0.001561956 0.003474861 -0.018127954 -0.000929221 -0.000074020 -0.002931113 -0.001923710 0.001175817 0.000009182 -0.000035648 -0.022870195 -0.015790340 0.008976085 0.000477015 -0.000075415 -0.016004106 -0.010724109 0.005607611 -0.000419269 -0.000165123 0.004607242 0.001718411 0.002791968 0.000417030 -0.000051801 0.023659804 -0.020436016 0.001894734 -0.000066451 0.000012148 0.016814378 -0.011565384 0.000948575 0.000944544 0.000033501 -0.004446024 0.002314877 -0.001721041 -0.000045631 -0.000003415 0.004926533 -0.000931417 0.002037459 -0.000011660 -0.000015454 0.000471189 -0.000304111 0.000477699 0.000016066 0.000020550 0.000799550 -0.001490761 -0.000706591 0.000180097 -0.000016283 -0.000570434 0.001029331 0.001873576 0.000051891 0.000012013 0.000466073 -0.000685743 0.000867643 0.000010549 -0.000032893 0.001271775 0.000526566 -0.000398105 -0.000079912 -0.000037670 0.001437429 0.001140744 0.000204584 -0.000050852 -0.000028805 0.000192338 0.000732435 -0.000154042 -0.000093994 0.000007170 -0.000862234 -0.000117134 0.000430025 0.000052191 0.000019795 0.000235770 -0.000618458 -0.000236887 -0.000068989 0.000018259 -0.000210711 -0.000789302 0.000351784 0.000010668 0.000006717 -0.000115296 -0.000774276 -0.000334797 -0.000005892 0.000004923 -0.000406659 -0.000421795 0.000231161 0.000061608 0.000005622 -0.000015192 0.000024236 0.000275611 -0.000019189 -0.000007027 -0.000028977 0.000135351 -0.000065163 0.000013287 0.000003409 -0.000001969 0.000013348 -0.000024436 -0.000090187 0.000006070 0.000338569 -0.000105977 -0.000065983 -0.000100380 -0.000396922 0.000811105 0.000732166 -0.002010847 -0.000887170 -0.001173100 -0.000492558 0.000073156 -0.002185414 -0.000624423 0.001407590 0.000446501 -0.000912990 0.002337738 0.000567793 -0.010727298 -0.005765930 0.011081140 -0.027331331 -0.004108047 -0.018641760 0.004558189 -0.007386736 0.017154889 0.002649667 -0.022144809 -0.009785204 0.009627386 -0.007401224 0.000613694 0.000310609 0.001298164 -0.000055252 -0.000013718 -0.000055375 0.000637142 -0.001147576 0.000440413 -0.000175054 0.000352338 0.000900255 0.001191060 -0.000494229 0.000539304 -0.000247781 0.000033231 0.000004901 0.000007092 0.000003935 0.000007605 0.000054359 -0.000015010 -0.000029856 0.000045715 0.000021028 0.000052415 0.000040068 0.000017081 0.000037686 -0.000018569 -0.000008076 0.000000900 0.000019930 -0.000020702 -0.000001120 -0.000024037 0.000005596 0.000010674 -0.000013863 -0.000013427 -0.000000984 -0.000013405 -0.000013667 -0.000001907 0.000008224 0.000024484 0.000025512 -0.000002251 0.000028692 -0.000015377 -0.000005176 0.000010561 0.000008328 -0.000000184 -0.000007576 -0.000003958 0.000003717 -0.000006256 0.000005343 -0.000002130 -0.000030401 0.000002421 -0.000002034 -0.000015836 -0.000012078 0.000016292 -0.000003123 0.000010660 -0.000005864 0.000009058 0.000017939 -0.000012777 -0.000005774 0.000005492 0.000012487 0.000094094 0.000016893 -0.000007021 -0.000012136 0.000018986 -0.000150988 0.000019009 0.000022557 -0.000174767 -0.000026082 -0.000046638 -0.000038066 -0.000007123 0.000000072 0.000013676 0.000139498 -0.000018558 -0.000028653 0.000114108 0.000050340 -0.000016580 0.000024232 0.000012396 -0.000030084 -0.000023379 0.000017583 0.000005809 0.000030029 0.000018959 0.000017197 0.000058016 -0.000001800 -0.000038344 0.000081654 0.000012318 -0.000009413 -0.000013307 -0.000005597 0.000003130 0.000007248 0.000069291 0.000008426 -0.000016321 0.000070425 0.000008888 0.000195388 0.000220850 0.000026795 0.000122971 0.000011260 0.000789768 -0.000098769 -0.000066159 0.000397244 0.000115836 0.000625638 0.000014137 0.000068493 -0.000039107 0.000036622 -0.000238521 -0.000176078 0.000077052 -0.000282751 -0.000000027 -0.000192221 -0.000140741 -0.000220899 -0.000158542 -0.000045688 -0.000068745 -0.000002918 -0.000194346 0.000132225 -0.000002913 -0.000408859 0.000091294 0.000022384 -0.000110873 -0.000091477 0.000095238 -0.000042190 0.000129302 -0.000078050 0.000018210 0.000183703 -0.000005923 -0.000098121 0.000153352 0.000056743 -0.000192943 -0.000464657 -0.000587710 0.000081633 0.000302175 -0.004777310 -0.000023261 0.000974999 -0.001837185 -0.000997207 -0.001640126 -0.000374205 0.000613305 -0.001569757 -0.000193608 0.000437714 0.000293842 0.000372165 -0.000140527 -0.000127499 0.001562589 -0.000372365 -0.000638667 0.001156437 0.000588577 -0.000367719 0.000528890 0.000251733 -0.000142807 -0.000399035 0.000391133 0.000226971 -0.000126367 0.000291579 0.000008819 0.001664007 0.000277394 0.000474843 0.000295606 0.000057719 0.000733270 0.000137530 -0.000176331 0.000302820 0.000114060 0.070143704 -0.061269270 0.294821476 0.003467709 -0.001563410 0.231114401 -0.003898940 0.001845610 0.109169704 0.125874675 0.014602573 -0.008368623 -0.069536065 -0.040556867 0.075960931 -0.003202925 -0.002440314 -0.002843881 -0.022924577 -0.016251886 0.005501523 0.005147733 -0.001655298 -0.014926602 -0.010176976 -0.028773238 -0.018463523 0.000948616 0.009365628 0.006214647 -0.000212614 -0.000706877 0.000188506 0.000493889 -0.000345762 -0.004724248 -0.003718607 -0.000311506 0.001087106 0.000696843 -0.003424373 -0.001126409 -0.000173983 -0.000107741 0.000903000 0.000063687 -0.000349562 0.000739798 0.000012173 -0.000696093 0.001089526 -0.000221098 -0.000626466 -0.004451259 -0.003938730 0.000755824 0.000750489 -0.000529603 -0.003748363 -0.001237198 -0.000742316 -0.000477027 -0.000252645 -0.000912814 0.000256160 0.001631700 0.001266663 0.000132136 0.000476473 0.000667154 -0.000884529 0.000244627 -0.000423346 0.000597968 0.000410773 -0.000283044 0.000030832 0.000183573 0.000192751 -0.000141222 0.000218828 -0.000080956 -0.000189087 0.000314845 0.000201134 0.000297406 0.000535730 -0.000048241 -0.000096231 0.000000350 0.000239210 0.000814081 0.000026636 0.000083850 0.000111955 -0.000172757 -0.000931188 0.000017853 -0.000052477 -0.000058365 0.000710799 0.000529792 -0.000016764 -0.000038315 0.000014162 0.000006779 0.000235286 -0.001312590 0.000302996 0.000782007 0.000021247 -0.000267410 0.000551602 -0.000668806 -0.000078754 0.000063513 0.000068474 0.000053080 -0.000524486 0.000350478 0.000010435 0.000004576 -0.001390295 0.002102951 0.000473293 -0.000010280 0.000068412 0.002111079 -0.000674787 -0.000687221 0.000112403 -0.000247103 0.001085449 -0.000232957 -0.000146832 0.000061689 0.000098317 0.000266651 0.000174453 -0.000084101 0.000047816 -0.000067090 0.000360524 0.000468377 -0.000095594 0.000012924 -0.000026856 0.000089268 0.000141513 -0.000131628 -0.000131019 -0.000178320 0.000047218 0.000014838 -0.000035929 -0.000065270 0.000055215 -0.000144536 -0.000011558 0.000029684 0.000020578 0.000225691 -0.000030657 -0.000004153 -0.000165597 0.000875259 -0.000820697 0.000567402 -0.000161745 0.000181953 0.001279636 -0.000359336 0.000932536 0.000263300 0.000356328 -0.000370972 0.000242983 -0.000772437 0.000251212 -0.000057721 0.005093461 -0.002365024 0.002129518 -0.000245918 -0.000943483 -0.000942433 0.001369111 -0.000597573 0.001280832 -0.000923806 0.000013603 0.000299876 0.001670594 -0.001256398 0.000521661 -0.000293094 0.000196079 -0.000053132 -0.000359325 0.000196247 0.000191519 -0.000261292 0.000662693 -0.000196393 0.000140980 -0.000185581 0.000051974 -0.000824356 -0.000051894 0.000292450 -0.000009075 0.000014080 0.000009521 -0.000001114 -0.000003014 -0.000014324 0.000019381 -0.000022784 0.000005978 0.000002215 0.000017968 -0.000028845 0.000007622 -0.000001431 -0.000000237 -0.000002202 0.000001612 0.000018962 -0.000004638 -0.000003216 0.000011163 -0.000017660 0.000011810 -0.000004021 -0.000001271 -0.000006393 0.000010287 -0.000009520 -0.000000761 -0.000001238 0.000020910 -0.000025851 -0.000013197 0.000000873 0.000006812 0.000007984 -0.000011428 0.000000645 -0.000003232 0.000001090 0.000005372 -0.000005832 -0.000009794 0.000001653 0.000004366 0.000013830 -0.000017659 -0.000001868 -0.000002440 0.000002978 -0.000013337 0.000019837 0.000011776 0.000002613 -0.000003552 -0.000013669 0.000019767 0.000002520 0.000003311 -0.000003781 -0.000027786 0.000033091 0.000029728 -0.000012706 -0.000011093 0.000024061 -0.000023198 0.000068260 -0.000021039 -0.000004474 -0.000019348 0.000017720 -0.000034081 0.000009694 0.000000083 -0.000059527 0.000061310 -0.000014373 0.000013520 -0.000010041 0.000027441 -0.000030463 -0.000006040 -0.000008172 0.000003806 -0.000022078 0.000022104 0.000025848 -0.000001868 -0.000002362 -0.000008724 0.000009780 -0.000039496 0.000015359 0.000000993 -0.000010144 0.000011336 0.000008558 0.000003649 -0.000001637 -0.000004330 0.000004914 -0.000030058 0.000009315 0.000004090 -0.000006268 -0.000023918 0.000095009 -0.000004141 -0.000033586 -0.000125762 0.000157098 -0.000135358 0.000047226 -0.000019721 -0.000064752 0.000099633 0.000101985 -0.000056115 -0.000020229 -0.000004081 0.000011614 0.000140575 -0.000031055 -0.000016295 0.000043117 -0.000038901 -0.000058001 0.000005633 0.000024609 0.000020387 -0.000030602 -0.000097455 0.000045584 -0.000009528 0.000115693 -0.000140346 0.000015188 -0.000019720 0.000027092 -0.000038165 0.000046901 0.000040222 -0.000029681 -0.000000199 -0.000059365 0.000065849 -0.000024652 0.000036965 -0.000021758 -0.000250894 0.000425555 -0.000167654 0.000172336 -0.000005878 0.001076062 -0.001320261 -0.000102085 -0.000262668 0.000287350 0.000115673 -0.000025535 0.000175211 -0.000004145 0.000023327 0.000107920 -0.000128534 0.000128599 -0.000062577 -0.000005286 -0.000579198 0.000631073 0.000099762 0.000160417 -0.000135377 0.000437862 -0.000509493 -0.000219219 -0.000139651 0.000109486 -0.000015769 -0.000019185 -0.000000732 -0.000030715 -0.000015506 -0.000063436 0.000106027 0.000017323 0.000003278 -0.000033628 -0.000101528 0.000155186 0.000058113 0.000007969 -0.000053782 0.555634079 0.033286106 0.511698212 -0.010815498 -0.038471631 0.577674764 -0.054047544 0.009117439 -0.036995723 0.058273013 0.009090336 -0.064399632 0.064638974 -0.014742029 0.072806114 -0.036868755 0.063615520 -0.289100531 0.042776689 -0.067276276 -0.228637619 -0.104144414 0.065455559 0.004324737 0.002612940 -0.104043687 -0.107386698 0.037880975 -0.006291443 -0.003630288 0.065528283 0.037493574 -0.072815313 0.025206022 0.013607522 -0.155829831 0.057558340 -0.008690928 -0.005697591 0.003773441 0.059318624 -0.132006565 0.005535273 0.007161982 -0.006327925 -0.005663180 0.006497273 -0.084032556 -0.024943206 0.019911128 0.005274667 0.023496062 0.014738249 0.000756386 -0.000620932 -0.005337954 -0.017746609 -0.011358764 -0.000449613 0.000150705 0.000184193 0.003456690 0.001076811 0.000446968 0.000109434 -0.004572475 0.007386002 -0.026232138 -0.003615778 0.003537604 0.003530088 -0.005856139 0.021081647 0.003524039 -0.002046307 -0.000647286 0.000331510 -0.001994980 -0.000609706 -0.000044487 -0.027180940 -0.007784295 0.010701717 0.001239247 -0.001119672 0.017044230 0.012030647 -0.008940353 -0.000024203 0.000567004 0.000129750 -0.001685386 0.000363402 -0.001603635 -0.000151593 0.000942451 -0.000429654 -0.000715086 -0.000063015 0.000057923 0.000554302 -0.000070718 0.000262948 0.000021587 -0.000001621 -0.000525406 -0.000603503 0.000046139 0.000040113 -0.000069837 -0.003612612 -0.004780075 0.003189690 0.000463720 -0.000282500 -0.001701311 -0.001002321 0.001062986 -0.000105045 -0.000077740 0.001270805 0.001779950 -0.000776799 0.000294701 -0.000133208 0.001975696 -0.000492604 0.001315748 -0.000416539 0.000269286 0.000878828 0.000529846 -0.001029509 -0.000223228 0.000361846 -0.001183320 0.000018352 0.000656535 0.000751256 -0.000445780 -0.000210138 -0.000202215 -0.000006266 -0.000367925 -0.000381025 -0.000607996 -0.001672650 -0.000432846 -0.001607082 -0.001212604 0.000547825 0.001356629 -0.000888362 0.000102958 0.000075669 0.000132282 0.000109452 -0.000302925 -0.000443217 -0.000270609 -0.000662972 -0.000745551 0.000322719 -0.000088230 -0.000167602 0.000292936 -0.000936342 -0.000069859 -0.000321889 0.000005128 -0.000105980 -0.000005532 0.000109784 -0.000100602 0.000096364 0.000301754 0.000004628 0.000055831 -0.000097189 -0.000255162 -0.000079948 -0.000086891 -0.000069087 -0.000019335 -0.000020973 -0.000000894 -0.000000149 -0.000001071 -0.000007324 0.000000927 0.000011450 0.000005725 -0.000015515 -0.000012423 0.000001793 -0.000035943 -0.000002050 -0.000004713 0.000011373 -0.000013826 0.000003201 -0.000001443 0.000008385 -0.000000672 -0.000000729 -0.000001258 -0.000000394 0.000006329 0.000006181 -0.000004381 0.000019839 0.000006901 -0.000007459 -0.000003818 0.000007673 -0.000029023 -0.000000651 -0.000012094 0.000009014 -0.000016025 -0.000004708 0.000000573 -0.000001149 0.000005090 -0.000004088 -0.000006162 -0.000001885 -0.000003218 0.000002735 -0.000003902 -0.000004129 -0.000001417 0.000002265 0.000007281 -0.000001981 -0.000004883 -0.000003925 0.000006122 -0.000007121 0.000002746 0.000008696 0.000001901 -0.000001127 -0.000009845 0.000004276 0.000021770 0.000004162 0.000017935 0.000001741 0.000024574 0.000058733 0.000001886 0.000025154 0.000016234 -0.000003869 0.000022228 -0.000008353 -0.000002722 0.000010586 0.000023317 0.000023840 0.000005271 -0.000002095 -0.000017738 0.000005701 -0.000000868 0.000006592 -0.000012957 0.000008768 -0.000005215 0.000001821 -0.000004510 0.000015547 -0.000017197 -0.000004519 -0.000023137 -0.000001425 -0.000019967 -0.000000321 0.000011054 0.000004490 -0.000003876 0.000012205 -0.000010931 0.000002438 -0.000023717 -0.000000146 -0.000016043 -0.000005552 0.000001679 -0.000027828 0.000017134 0.000048012 0.000004499 -0.000013902 -0.000125457 0.000011603 -0.000107782 -0.000056389 0.000124282 -0.000016915 -0.000019209 -0.000031933 -0.000024399 0.000077707 0.000120063 0.000005317 0.000061761 0.000003226 -0.000009999 0.000057334 -0.000037319 -0.000022373 0.000010008 -0.000005548 -0.000027319 0.000016102 -0.000028910 -0.000003950 0.000001902 0.000001719 0.000002833 0.000024941 0.000045186 -0.000089040 0.000017176 -0.000009848 0.000006744 -0.000009605 0.000014077 -0.000009724 0.000022274 -0.000000162 -0.000023860 0.000033195 0.000190046 -0.000193934 -0.000049665 -0.000253825 0.000241772 0.000055778 -0.000088637 0.000138132 0.000539145 -0.000816175 0.000283516 -0.000149109 0.000125766 -0.000114702 0.000059321 -0.000102629 0.000041693 -0.000022653 0.000030089 -0.000055763 0.000128623 0.000054224 0.000070057 -0.000241245 0.000339613 -0.000317991 0.000031595 -0.000222508 0.000264881 -0.000332497 -0.000169877 0.000075970 -0.000043692 0.000024714 -0.000020285 -0.000174479 -0.000015204 -0.000127529 -0.000078935 0.000096766 -0.000092949 0.000030010 -0.000110254 -0.000088030 0.000095818 0.311286185 -0.001740212 0.247026201 0.001530925 0.110462345 0.119620454 -0.007531529 -0.071020710 -0.035697440 0.073151736 0.000546353 -0.019582606 0.019852258 -0.003673472 0.484682533 0.000013967 -0.012045989 0.009824752 -0.001123723 0.017861867 -0.000319524 0.008414431 -0.008141763 -0.000301534 0.024176110 -0.000295955 0.000869690 -0.000218741 0.000521172 -0.061100509 0.000460999 0.000150817 0.001142883 -0.000168946 -0.051173179 0.000513227 0.000426868 -0.000357667 -0.000032245 -0.030656407 0.000486366 0.000485954 -0.000753761 0.000020855 -0.054290674 -0.000009993 -0.000285546 0.000619515 -0.000587420 0.008832677 0.001376433 -0.000568580 0.000106788 0.000397916 -0.037296086 0.000386612 -0.002344038 0.003124194 0.000180044 -0.171388396 -0.000468666 0.004639979 -0.002716619 0.000027046 -0.040985054 0.001080695 -0.001151968 0.000749940 0.000457168 0.042987341 0.000077638 0.000219940 0.000229499 0.000161918 -0.007629319 0.000045483 -0.000066952 0.000043108 0.000024677 -0.003612931 0.000008635 -0.000150269 0.000120643 0.000011146 0.004262230 0.000012314 -0.001374059 0.001209557 0.000211150 -0.018678506 -0.000084942 -0.000537037 0.000347002 -0.000002256 -0.011935606 0.000261951 0.000515177 -0.000398111 0.000354506 0.009143597 -0.000811667 0.000274731 -0.000123880 -0.000340553 0.004406593 -0.000113557 0.000094258 -0.000129030 -0.000129792 0.001976500 0.000136967 -0.000041862 -0.000091398 0.000363925 -0.001880065 0.000007371 -0.000788183 0.000550571 -0.000641439 0.000070445 0.000952773 0.000254717 0.001838404 -0.002335406 0.000498199 -0.000141809 -0.000476734 -0.000766152 0.000492737 -0.000257960 -0.000608087 -0.000070631 0.000846151 -0.000770024 0.000402042 0.001052138 -0.000007077 0.000145971 -0.000121017 -0.000068110 0.000568292 -0.000046510 0.000444970 -0.000455539 -0.000055635 0.000080943 -0.000028437 0.000008768 -0.000019884 -0.000012961 -0.000102502 0.000009714 0.000193030 -0.000098480 -0.000018412 0.000011817 -0.000005908 -0.000109357 -0.000109354 0.000031889 0.000003763 -0.000001390 0.000007773 -0.000007524 -0.000001378 0.000015708 -0.000006077 -0.000002761 -0.000010219 0.000001725 -0.000011998 0.000005427 0.000009496 0.000000667 0.000011874 -0.000002400 -0.000000245 0.000006195 -0.000000442 -0.000003180 -0.000009576 0.000003043 0.000000592 0.000005362 0.000000520 0.000006707 -0.000004163 -0.000008263 0.000004291 -0.000002847 -0.000009813 0.000004926 -0.000000973 -0.000002372 0.000013938 -0.000005644 0.000000565 -0.000000438 0.000003370 0.000004133 -0.000001638 0.000001209 -0.000003310 -0.000001122 0.000004517 -0.000008980 0.000003057 -0.000005161 0.000006889 0.000002867 0.000005794 -0.000000039 0.000009304 -0.000008745 -0.000005642 0.000009058 -0.000002144 0.000003785 -0.000007185 -0.000005979 -0.000000152 -0.000003632 -0.000005606 0.000015919 -0.000015824 -0.000013827 0.000002753 -0.000008081 0.000020884 -0.000012522 0.000019021 -0.000005758 -0.000017838 0.000017821 -0.000013600 0.000032082 -0.000012424 0.000009942 -0.000018278 -0.000008231 -0.000005619 0.000000239 -0.000012820 0.000015333 0.000005672 0.000008363 -0.000002851 0.000018560 -0.000016546 -0.000004747 0.000010155 0.000001622 -0.000007049 0.000002074 0.000004466 0.000006058 -0.000001337 0.000010314 -0.000010204 -0.000004696 0.000008261 -0.000000313 -0.000000493 -0.000006586 0.000008452 -0.000034568 0.000001585 0.000021606 0.000003331 0.000007830 0.000123353 0.000008458 -0.000024846 0.000004498 -0.000009103 0.000072535 -0.000000928 0.000029837 0.000008532 -0.000023362 -0.000027459 -0.000004911 -0.000000102 0.000011746 -0.000024930 0.000000839 0.000003109 -0.000004982 0.000012546 -0.000008157 -0.000006455 0.000003498 -0.000015686 0.000010247 0.000013436 -0.000087252 0.000004113 -0.000003890 0.000001507 0.000033493 0.000025359 -0.000006910 0.000017018 -0.000010453 -0.000015962 0.000024275 0.000000126 -0.000002329 -0.000005592 -0.000012181 0.000302755 -0.000028269 0.000028286 -0.000098687 -0.000145044 -0.000783877 0.000011881 -0.000079871 0.000064611 0.000332875 0.000071872 -0.000002444 0.000028362 -0.000033729 -0.000141939 -0.000053729 0.000012443 0.000018230 0.000012743 0.000038721 0.000307585 -0.000009020 0.000055441 -0.000052869 -0.000195000 -0.000283663 0.000006324 -0.000045008 0.000034501 0.000247630 -0.000028139 0.000022656 0.000000202 0.000013653 0.000042144 0.000150240 -0.000005930 0.000041886 -0.000048194 0.000005525 0.000112572 0.000007357 0.000033487 -0.000014423 -0.000011950 0.549743689 0.017263021 0.584008141 -0.050921333 -0.030248297 0.072096053 -0.227615351 -0.104122413 0.054665026 0.245981194 -0.105788855 -0.113766656 0.030240027 0.114204893 0.116124031 0.009184361 -0.038742227 -0.001696310 0.002382186 -0.006769805 -0.065736199 0.057888915 -0.003734839 0.008150928 -0.025465445 0.059400450 -0.278331285 -0.002034098 0.004050430 -0.013388503 -0.043318353 0.041310567 -0.009116383 -0.002591573 0.004512659 -0.103486673 0.019335123 -0.024685294 -0.009798106 0.012596447 0.018992628 -0.102734674 -0.014545371 -0.006091811 0.007130548 -0.022582636 -0.016252620 -0.004765888 -0.002179304 0.002726951 -0.009238719 -0.005965813 -0.002309520 0.000145906 0.001575847 0.012525237 0.008239599 0.003116731 0.001420436 -0.000086687 0.021050769 -0.002224259 0.000642930 -0.000124717 -0.000800356 0.010362571 -0.000413925 0.000400924 0.001033841 -0.000251633 -0.010417457 -0.000365962 -0.000728285 0.000181878 0.000448068 -0.007794850 0.028582571 0.001026635 0.000254641 -0.000610308 -0.003701323 0.012373199 0.000532884 -0.000156026 0.000100956 0.003220758 -0.011930572 0.000197793 0.000178008 0.000753435 -0.000005591 0.000177859 -0.000126567 0.000277715 0.000128258 0.001108737 0.000361129 -0.000254284 0.000398451 0.000102967 -0.000563446 0.000170535 0.000001168 0.000079913 0.000002894 -0.000210987 -0.000755480 -0.000061465 0.000210978 0.000239766 0.000686343 0.001000312 -0.000123154 0.000101871 -0.000107330 -0.000039157 0.000355282 -0.000018203 0.000104196 0.000042506 0.000050330 0.000062547 -0.000000633 -0.000000293 -0.000011109 -0.000077963 -0.000094559 0.000024670 -0.000013146 0.000005814 0.000017866 0.000054684 -0.000034684 0.000044739 0.000020499 0.000006042 -0.000000214 0.000001003 -0.000002752 -0.000002305 0.000002397 0.000008496 -0.000001188 0.000000912 -0.000001764 0.000004464 0.000004095 -0.000005789 0.000011415 0.000006129 0.000002829 -0.000005057 0.000002458 -0.000005491 -0.000002274 -0.000002824 -0.000001379 0.000000592 -0.000000422 0.000001012 -0.000002422 0.000003041 0.000002142 -0.000005199 -0.000003760 -0.000004068 0.000001869 -0.000007912 0.000019282 0.000009566 -0.000001640 0.000000175 -0.000001265 0.000003093 0.000001957 -0.000003506 0.000000350 -0.000002830 0.000007608 0.000004301 -0.000005601 -0.000001313 -0.000001138 0.000003029 0.000002817 0.000007104 -0.000004940 0.000001513 -0.000003260 -0.000002543 0.000004343 -0.000000054 0.000002324 -0.000005301 -0.000004196 -0.000001733 -0.000007854 0.000008552 -0.000016588 -0.000008545 -0.000018940 -0.000017079 0.000009387 -0.000013607 -0.000002223 -0.000003826 0.000009878 0.000003418 -0.000009430 -0.000004441 0.000011993 0.000011207 0.000004877 -0.000013265 -0.000009632 -0.000007466 0.000007800 -0.000005148 0.000011838 0.000004914 0.000010503 -0.000003386 0.000003950 -0.000009317 -0.000003616 0.000005114 0.000011389 -0.000004245 0.000005917 0.000001121 0.000006410 -0.000000232 0.000002639 -0.000006931 -0.000002730 0.000005971 0.000009648 -0.000005168 0.000008317 0.000002748 -0.000004094 -0.000010875 0.000000598 0.000005497 0.000003286 0.000055924 0.000086130 -0.000007285 0.000006824 -0.000008916 0.000033760 0.000048238 0.000007577 -0.000018147 -0.000014689 -0.000020877 -0.000056782 0.000020420 -0.000028961 -0.000007476 -0.000021297 0.000007581 0.000001824 0.000000290 0.000002919 -0.000005996 0.000001658 -0.000007189 0.000014610 0.000004900 -0.000033031 -0.000036760 -0.000011196 0.000025749 0.000019079 0.000010848 0.000003240 0.000005695 -0.000012161 -0.000007082 0.000013421 0.000001333 0.000005657 -0.000011521 -0.000009283 0.000102662 0.000094103 0.000050055 -0.000132090 -0.000080834 -0.000327661 -0.000346592 -0.000123394 0.000261106 0.000187719 -0.000029578 -0.000022559 0.000067384 -0.000127552 -0.000032672 -0.000014937 0.000021112 -0.000017788 0.000055224 0.000031167 0.000112231 0.000084661 0.000088161 -0.000164692 -0.000106153 -0.000052026 -0.000047763 -0.000120660 0.000226210 0.000105657 0.000023841 -0.000007166 -0.000018530 0.000039108 0.000013062 0.000075923 0.000145124 -0.000021988 0.000027034 -0.000001378 0.000068934 0.000071888 -0.000002436 0.000008903 -0.000011910 0.062321235 -0.011461096 0.067673013 0.039868263 -0.067283865 0.299882317 0.003573165 0.001878828 -0.002273787 0.518522603 -0.007738600 -0.003722568 0.002711494 -0.027795422 0.570881353 0.029351829 0.012715804 -0.011184585 0.031642416 0.013088142 0.001251438 0.000600322 0.000100284 -0.075588739 -0.066129619 0.000242658 0.000119136 0.000294716 -0.067385221 -0.215386116 -0.000710063 0.000249593 0.000928831 -0.046286117 -0.111306546 0.000933424 -0.000037590 0.000419936 -0.182992480 0.130938028 0.000685690 0.000355739 -0.000434723 0.132387932 -0.176113273 -0.000327342 -0.000554789 0.000092161 -0.001828006 0.001111036 -0.005006357 -0.002493711 0.002715116 -0.054395392 0.012950322 -0.002452066 -0.000243521 0.000828901 0.012420894 -0.072405655 0.002600959 0.001430817 0.000425330 -0.038760272 0.072118995 -0.000015173 -0.000054680 -0.000056089 -0.000048331 0.000042565 0.000286179 -0.000175237 0.000212920 0.000142532 -0.000407316 -0.000054005 0.000028180 -0.000030142 -0.000158555 0.000243722 -0.000274555 0.000120272 0.000070351 0.000062754 -0.000007508 0.000383484 -0.000328693 0.000037339 0.000031393 -0.000156417 0.000171180 -0.000137124 0.000169738 -0.000036203 -0.000086303 0.000038642 -0.000020262 0.000010370 0.000010306 -0.000035459 -0.000027667 0.000043720 -0.000036205 -0.000015781 -0.000006816 -0.000004909 -0.000012322 -0.000005147 -0.000006342 0.000042853 0.000002669 -0.000001457 0.000003886 0.000001610 -0.000003197 0.000005003 -0.000003585 0.000004461 -0.000000973 0.000000661 -0.000008146 0.000003053 -0.000008498 -0.000001981 0.000001199 0.000001106 0.000000829 0.000001503 0.000002312 -0.000002657 -0.000003746 0.000003099 -0.000004994 -0.000000118 0.000000485 0.000003262 -0.000001938 0.000003951 -0.000000578 0.000001250 -0.000008705 0.000002585 -0.000007386 -0.000004616 0.000005518 -0.000003404 0.000001430 -0.000003000 -0.000001216 0.000001630 -0.000002684 0.000000313 -0.000002728 -0.000001961 0.000002395 -0.000004307 0.000002589 -0.000005216 -0.000001569 0.000002767 0.000004605 -0.000002256 0.000006586 0.000002985 -0.000004510 0.000005651 -0.000002486 0.000006523 0.000002013 -0.000002971 0.000006710 -0.000000948 0.000005644 0.000003482 -0.000004815 -0.000003129 0.000004671 -0.000003492 0.000000819 -0.000002054 0.000009156 -0.000006509 0.000005060 0.000000975 0.000001113 0.000012628 -0.000007134 0.000010835 0.000004692 -0.000007955 -0.000004511 -0.000000784 -0.000003638 -0.000005276 0.000007819 0.000004104 0.000000467 0.000001863 0.000005327 -0.000007993 0.000001848 -0.000003939 0.000001264 -0.000001976 0.000002314 0.000003990 -0.000000411 0.000000737 0.000003487 -0.000005315 0.000000264 -0.000002256 -0.000000474 -0.000001602 0.000001811 -0.000011080 0.000008836 -0.000013259 0.000002898 -0.000007042 0.000043433 -0.000034002 0.000012521 0.000000170 -0.000015806 0.000033294 -0.000023197 0.000018845 0.000007144 -0.000024435 0.000001206 0.000005130 0.000009252 0.000005830 -0.000006952 -0.000002112 0.000003009 -0.000006056 -0.000006338 0.000004897 -0.000007055 0.000002921 -0.000008540 -0.000007319 0.000009494 -0.000039956 0.000024989 -0.000025848 -0.000009380 0.000022742 0.000013244 -0.000007568 0.000014613 0.000005904 -0.000009506 0.000013740 -0.000007085 0.000010840 0.000004418 -0.000009211 0.000157765 -0.000083975 0.000109293 0.000045447 -0.000072415 -0.000383572 0.000207862 -0.000181696 -0.000103553 0.000252693 0.000065122 -0.000000885 0.000020032 0.000049322 -0.000049524 -0.000032204 0.000017814 -0.000041340 -0.000009966 0.000006556 0.000176013 -0.000078881 0.000088067 0.000058499 -0.000126002 -0.000176102 0.000055205 -0.000056663 -0.000078491 0.000136973 -0.000020331 0.000004929 -0.000012610 -0.000008314 0.000004566 0.000045969 -0.000039899 0.000015858 0.000002005 -0.000018215 0.000045572 -0.000036037 0.000022249 0.000002187 -0.000034218 0.562117003 -0.045136454 0.080849384 -0.111018811 0.074098929 0.230686077 -0.123612383 0.046325485 0.120530676 0.127321877 -0.001529366 0.008745253 -0.007809175 0.001030009 0.198609627 0.000817448 0.017799310 -0.014961808 0.002302417 -0.141741575 -0.049545064 0.013592180 -0.010939934 0.000383364 -0.000525871 -0.040154659 -0.002175545 0.003812887 -0.008227999 -0.002846522 0.072369937 -0.003819990 0.009654095 -0.024474580 0.001740908 -0.284480348 -0.001760501 0.005963214 -0.013076434 0.000542695 -0.000046079 0.000137357 0.000017835 0.000048251 -0.000086573 0.000194331 0.000220248 0.000133002 0.000104160 0.000236195 -0.000195410 0.000016215 -0.000031655 0.000009983 -0.000153908 0.000055545 0.000131059 -0.000003827 -0.000012506 -0.000120997 -0.000114858 -0.000023702 0.000085181 0.000015783 0.000187509 -0.000054695 0.000069738 0.000039036 0.000054846 0.000107623 0.000007541 0.000002746 0.000006298 0.000004131 0.000024105 0.000088017 0.000026136 -0.000016459 0.000031516 -0.000003446 -0.000003028 0.000012835 -0.000005084 -0.000015327 -0.000030079 -0.000001279 -0.000001739 0.000001216 -0.000000041 0.000004680 -0.000003682 0.000000252 -0.000000420 -0.000000155 -0.000001279 -0.000001644 0.000006133 -0.000000390 0.000002272 -0.000005037 0.000003093 -0.000002632 0.000000107 -0.000000464 0.000003926 0.000002444 0.000000323 -0.000000900 0.000000543 -0.000001154 -0.000003135 -0.000002600 -0.000001165 -0.000001195 -0.000000084 -0.000003962 0.000009517 -0.000000273 0.000002924 -0.000011885 -0.000000789 0.000001896 -0.000001028 0.000000421 -0.000004011 -0.000000912 0.000003828 0.000000002 0.000000877 -0.000005502 0.000001480 0.000002212 -0.000001426 0.000000307 -0.000004795 0.000000569 -0.000002756 0.000003046 -0.000000261 0.000008365 -0.000000857 -0.000003484 0.000001730 -0.000000433 0.000006872 0.000001983 -0.000008112 0.000000340 -0.000001217 0.000009195 0.000008996 -0.000004417 -0.000001438 -0.000000723 0.000001433 0.000000134 -0.000005528 0.000000681 -0.000003087 0.000005091 -0.000001230 -0.000008087 0.000002237 -0.000002009 0.000012699 -0.000009068 0.000005627 -0.000001435 0.000001687 -0.000009559 0.000009539 -0.000004591 0.000001274 -0.000001109 0.000008481 -0.000006318 0.000002180 0.000000662 -0.000000325 -0.000001738 0.000006955 -0.000003163 0.000000897 -0.000000713 0.000006660 -0.000003337 0.000003697 -0.000000144 0.000000126 -0.000004407 0.000004178 0.000003910 0.000000544 0.000005585 -0.000001201 -0.000014010 0.000000787 0.000006788 0.000001399 0.000013102 -0.000006609 -0.000009755 0.000005915 0.000000974 0.000026898 0.000013005 -0.000012115 -0.000000772 -0.000001135 0.000009640 0.000000472 0.000003486 -0.000000902 0.000002330 -0.000004292 -0.000007628 0.000008110 -0.000001112 0.000001315 -0.000012517 0.000003067 0.000015490 -0.000009016 0.000002562 -0.000032143 0.000000737 -0.000008163 0.000004138 -0.000001771 0.000015776 -0.000001656 -0.000007263 0.000004522 -0.000000548 0.000014348 0.000032177 -0.000066748 0.000026700 -0.000017998 0.000129525 -0.000053313 0.000139666 -0.000080631 -0.000006356 -0.000314123 0.000122988 -0.000054126 0.000004427 -0.000010531 0.000081002 0.000003159 0.000030593 -0.000005500 0.000017174 -0.000037073 0.000046286 -0.000085967 0.000040637 0.000006150 0.000172127 -0.000144074 0.000103712 -0.000028751 0.000003926 -0.000180036 -0.000022012 0.000015696 0.000000556 0.000005676 -0.000020073 -0.000015024 0.000007541 0.000008833 0.000003362 0.000015019 -0.000023282 0.000003519 0.000013274 0.000010224 0.000025384 0.185288932 -0.001739176 0.046037316 0.004402124 -0.021552068 0.057090216 -0.005530633 0.020945632 -0.010834626 0.071701707 -0.001259624 0.003012208 0.039441850 -0.080995722 0.304112043 0.000091183 0.000010963 0.000025513 -0.000062450 -0.000029706 0.000106031 -0.000083932 -0.000062015 -0.000074922 -0.000100403 -0.000000545 0.000069068 0.000007111 -0.000024538 0.000086366 0.000119521 -0.000001887 0.000067088 -0.000080972 -0.000005955 -0.000101891 0.000010177 -0.000106144 0.000071848 0.000080554 0.000014582 -0.000006288 -0.000056861 -0.000013770 0.000000612 -0.000009299 -0.000007938 -0.000008945 0.000000243 -0.000004386 0.000045362 -0.000030550 0.000022610 -0.000038511 -0.000076139 0.000009325 0.000010251 0.000008379 -0.000001229 0.000013479 -0.000003031 -0.000000141 -0.000001728 0.000001375 0.000001507 0.000000423 0.000001301 -0.000001446 -0.000000158 0.000003542 0.000005550 0.000000746 0.000002837 -0.000002215 -0.000003523 -0.000002380 -0.000001205 -0.000000832 0.000000979 -0.000000941 0.000001212 -0.000000408 0.000001199 -0.000000320 -0.000003362 -0.000001522 0.000000999 -0.000001054 0.000000942 0.000003477 0.000009239 0.000001530 0.000004062 -0.000004962 -0.000001579 0.000002938 0.000000435 0.000001567 -0.000001183 -0.000000719 0.000004013 0.000000514 0.000001704 -0.000002041 -0.000000508 0.000003567 0.000000183 0.000002178 -0.000001409 -0.000002423 -0.000005631 -0.000001259 -0.000002699 0.000001802 0.000001809 -0.000005303 -0.000000417 -0.000002957 0.000001938 0.000002479 -0.000008022 -0.000001304 -0.000003701 0.000003688 0.000001076 -0.000000983 -0.000002947 0.000001632 0.000000206 -0.000005274 -0.000006073 0.000000200 -0.000002634 0.000003598 0.000003407 -0.000009680 -0.000000865 -0.000005375 0.000005025 0.000004803 0.000005221 0.000003027 0.000001970 -0.000002793 0.000002400 -0.000004185 -0.000003460 -0.000001609 0.000002182 -0.000003438 0.000000545 0.000002207 -0.000000249 0.000000339 0.000003830 -0.000003149 -0.000002185 -0.000001527 0.000001840 -0.000002868 0.000003462 0.000001334 0.000000820 -0.000001220 0.000001807 0.000003791 -0.000003531 0.000002189 -0.000002835 -0.000009886 -0.000006649 0.000003556 -0.000012183 0.000006432 0.000010287 -0.000014964 -0.000001671 -0.000011286 0.000008994 0.000005191 -0.000008047 -0.000004745 -0.000002106 0.000001973 -0.000003652 0.000004768 0.000001140 0.000001883 -0.000001884 -0.000004159 0.000007631 0.000003653 0.000003203 -0.000003022 0.000002128 0.000022227 0.000002244 0.000014619 -0.000011819 -0.000010260 -0.000011423 -0.000002387 -0.000005948 0.000004637 0.000004482 -0.000010685 -0.000000951 -0.000006458 0.000004883 0.000004810 -0.000085713 -0.000015720 -0.000052608 0.000041389 0.000027022 0.000190661 0.000046343 0.000135804 -0.000092469 -0.000021680 -0.000043080 -0.000036706 -0.000020674 0.000015968 -0.000053096 0.000034500 -0.000001304 0.000013442 -0.000019702 -0.000025509 -0.000107201 -0.000029700 -0.000070516 0.000046133 0.000000025 0.000101859 0.000053950 0.000059700 -0.000044788 0.000052452 0.000014005 0.000006239 0.000005617 -0.000006391 0.000004911 -0.000004649 0.000001994 -0.000010627 0.000004360 0.000009092 -0.000009550 0.000001350 -0.000015200 0.000005203 0.000010791 0.271193900 0.291727845 0.409038321 -0.082496939 -0.137754298 0.140223369 -0.023710356 -0.043587959 -0.012349938 0.479154274 -0.061793342 -0.045105654 -0.007687251 0.268748806 0.364507897 -0.009778148 -0.013416420 0.026647876 0.094286539 -0.094060271 -0.000233931 -0.006813984 -0.004459415 -0.173174613 -0.135797894 -0.004350603 0.004648628 -0.002880304 -0.129515864 -0.125155708 -0.003447720 -0.001345142 -0.002077734 0.075109031 0.083570471 0.000838497 -0.000060084 -0.000181360 0.000060717 0.000339681 0.000775453 -0.000093626 0.000091823 0.000003824 0.000473630 0.000616451 0.000526562 -0.000194498 0.000015791 0.000750756 0.000321446 0.000136762 -0.000311849 0.000022181 0.000171669 -0.000248396 0.000014314 0.000005721 -0.000019946 -0.000012048 -0.000616852 -0.000444392 0.000357085 -0.000024239 -0.000444127 0.000491697 0.000483875 0.000044396 -0.000046272 0.000695791 -0.000060335 0.000021346 -0.000008227 -0.000050691 0.000102499 -0.000007433 0.000096962 0.000048442 -0.000033121 0.000090112 -0.000609430 -0.000067738 0.000107254 0.000002045 -0.000352158 0.000468359 0.000112009 -0.000141845 0.000045362 0.000190201 0.000419191 -0.000098093 0.000009557 0.000015391 0.000118575 -0.000968966 -0.000061310 0.000163202 0.000779333 -0.000962483 -0.000555899 0.000386288 -0.000350330 -0.000326704 -0.000628161 -0.003256395 -0.000065645 0.000761187 -0.000132310 -0.002023402 0.000736936 0.001652451 -0.000502476 0.000245931 0.001325041 -0.001576687 -0.002937473 0.001011309 -0.000364730 -0.001628659 0.002493055 0.000630011 -0.001593014 0.000168135 0.001082517 -0.000892757 -0.000232196 0.000400508 0.000057604 -0.000776620 0.001187226 0.000003347 -0.000574395 0.000076085 0.000203110 0.000536332 -0.000097167 -0.000077785 0.000049473 0.000048538 0.000148367 0.000173425 -0.000760208 -0.003351331 0.003037768 -0.002313186 -0.001946925 0.000960828 0.005608490 -0.007326997 -0.002114101 -0.001432817 0.000832614 0.003923912 -0.006838124 -0.000231113 -0.000095932 0.000120865 -0.000847348 0.000541661 -0.000519987 0.000024929 0.000810589 0.000824896 -0.000548747 -0.000675411 -0.000259866 0.000769605 0.000083575 -0.000246108 0.002191571 0.001580120 -0.000524788 -0.001676449 0.003602397 0.000450996 0.000091683 -0.000005339 0.000586469 0.000584865 0.000156886 -0.000601466 0.000014496 0.000341365 0.000011911 -0.013083108 -0.009843528 0.002855926 -0.005300310 -0.027757593 0.018250920 0.017270295 -0.001327520 -0.007899841 0.047408303 -0.003651917 -0.001876765 -0.001984403 -0.001861552 -0.010205686 0.004050270 0.002545843 -0.001014093 -0.000228471 0.006514220 -0.008281864 -0.007550305 0.000737050 0.003149558 -0.025104172 0.008863326 0.007402100 0.002136121 0.000308317 0.026273712 0.002504683 0.001137440 -0.000363206 0.000350006 0.006588231 -0.002469919 -0.001981618 0.000382831 0.000574788 -0.013965798 -0.002203463 -0.001909394 0.000689256 0.000423688 -0.008864917 0.562516494 0.069694751 0.181493136 0.077794693 0.137031273 0.146255159 -0.099287789 -0.081728638 -0.082278560 0.109433839 0.000323550 0.000045760 0.000000752 -0.000013226 0.514465981 0.000298798 0.000091652 -0.000073885 -0.000008198 -0.009364386 0.000533389 0.000100702 -0.000117403 -0.000081258 0.037711430 0.000043615 0.000036027 -0.000010711 -0.000023187 -0.050018721 -0.000047202 0.000004755 -0.000001551 -0.000020974 0.017588333 -0.000216032 -0.000052281 0.000034311 0.000025962 -0.016923078 0.000460005 0.000061724 -0.000088057 -0.000043133 -0.176085869 0.000081224 -0.000000144 -0.000011970 -0.000012781 -0.049199217 0.000053254 -0.000004995 -0.000010566 0.000004922 -0.123349233 -0.000264723 -0.000045077 0.000031956 0.000004184 -0.072248184 0.000145528 0.000013774 0.000008009 0.000003579 0.065808466 0.000121387 0.000015559 0.000004423 0.000009702 0.035501364 -0.000424452 0.000118336 0.000010253 -0.000082075 -0.181789358 -0.000183078 -0.000065534 0.000027321 -0.000056822 -0.017547669 -0.001423860 -0.000236065 0.000184509 0.000109883 0.054415678 0.000898135 0.000271099 -0.000158494 -0.000002665 -0.009882908 -0.000836346 -0.000129336 0.000057462 -0.000001314 -0.002549957 0.000357094 0.000165668 -0.000039196 -0.000010579 0.004415607 -0.000239316 -0.000143347 0.000071917 0.000090049 0.002100338 -0.000037012 0.000043233 0.000016981 0.000013640 0.000702610 0.000067284 -0.000011679 0.000000849 0.000037465 -0.001387637 0.001958036 0.000376318 0.000073070 -0.000295015 -0.028128137 -0.005793374 0.000349673 0.000070784 0.000082250 -0.006287017 -0.003316330 0.000074288 0.000368498 -0.000169124 0.010841367 0.000865034 0.000059777 0.000057588 -0.000111496 0.000940761 -0.000694983 -0.000010230 0.000000360 0.000007469 0.000393975 -0.000802357 -0.000183855 -0.000041078 0.000086686 0.000776665 0.003200485 -0.000159171 -0.000198741 0.000000163 0.001720121 -0.000144275 0.000178751 -0.000134865 -0.000083211 0.000843744 -0.000175706 0.000150525 -0.000070535 0.000006908 0.001336195 -0.011187554 -0.006412808 0.008562438 0.003567342 -0.001532376 0.022126371 0.001720249 -0.008021690 -0.001491462 0.000252959 -0.019225475 0.002551296 -0.001423373 -0.000552648 -0.004795154 -0.000238915 0.002007074 -0.000934186 -0.001746029 0.001207369 -0.002700762 -0.001039431 0.002943486 0.001453284 0.000171694 0.014830567 -0.000135676 -0.003101215 -0.000628655 0.000950872 0.003386254 0.000800461 0.000614406 0.000227248 -0.000961076 -0.006826572 -0.000342558 0.000329599 -0.000478167 -0.000472156 -0.003812509 -0.000079637 0.000023822 -0.000426271 0.000507726 0.570605726 0.005798350 0.558097315 0.018788293 -0.018074031 0.052699448 -0.191407287 0.129814972 -0.017789983 0.200486012 0.128978780 -0.168724568 0.014829566 -0.142732921 0.178957795 -0.048797939 -0.121932796 -0.001530083 -0.000502914 -0.000367025 -0.068484891 -0.047018738 0.017276851 0.008264434 0.015184540 -0.047331796 -0.164756448 -0.013252800 -0.007464092 -0.012540507 0.065122730 0.035216402 -0.001776139 0.001779495 0.001430028 -0.226785284 -0.099099002 0.005753907 -0.016574746 -0.012141429 -0.098926807 -0.105136371 -0.006698253 0.018040793 0.012317369 -0.016278414 0.056334678 0.003175130 0.000350770 -0.001546852 -0.085926920 0.010602762 -0.023342901 -0.002953445 0.011505019 0.009915576 -0.111712068 0.020721465 0.003032346 -0.011028777 0.024473065 0.014110859 0.001233413 -0.000223691 -0.000421452 0.007518712 0.004227778 0.000219149 0.000629844 0.000068895 -0.011727517 -0.007252651 -0.000386067 -0.000483177 -0.000101482 -0.022662373 0.021292553 -0.005225692 -0.000970018 0.003217483 -0.002129324 0.000804945 -0.000756110 0.001311542 -0.000050211 0.009696366 -0.009777919 0.002711417 0.000198202 -0.000344573 -0.009150612 -0.020687470 0.002155884 0.000717380 -0.000913146 -0.003270682 -0.004306148 -0.000516778 0.000224149 -0.000934864 0.003813058 0.012113516 0.000911315 -0.000054761 0.000691365 0.001076475 -0.000471606 -0.000396931 -0.000569178 0.000495590 0.000552901 -0.000382753 0.000439577 0.000015282 0.000216758 -0.000087499 0.000389983 -0.000457639 -0.000156618 0.000496909 -0.001217766 -0.000963533 -0.000016342 0.000036401 0.000172837 0.000440549 0.000116718 0.000055298 -0.000182186 -0.000005972 0.000659656 0.000781026 -0.000119232 0.000053996 0.000016737 -0.000941076 -0.002095732 0.000060391 -0.000135813 -0.000257156 -0.001070067 -0.000353461 -0.000399509 -0.000160745 0.000498393 -0.000572347 -0.006298870 0.000860000 0.000189267 -0.000512801 -0.000822893 0.001228313 -0.000611977 -0.000080125 0.000372149 0.000264137 0.000049116 0.000172759 0.000207756 -0.000271168 -0.000720938 0.001726871 -0.000709893 -0.000407529 0.000565281 -0.000464601 -0.001701837 0.000049076 -0.000047333 0.000101461 0.000007239 -0.000685837 0.000065259 -0.000005412 -0.000029940 0.000162896 0.000548240 -0.000056890 0.000002658 -0.000007056 0.190969504 0.055063161 0.066628628 0.131202030 0.051040836 0.172757409 0.008193304 -0.019434806 -0.008994495 0.077317491 0.002211088 -0.005430474 -0.001716812 -0.071472372 0.240125922 0.007947299 -0.016564780 -0.008738127 -0.043242947 0.109302209 -0.018349695 -0.002582341 0.012711301 -0.009114317 -0.002202760 -0.006993049 -0.002212066 0.004978301 0.025872725 0.005546967 -0.020756554 -0.003506006 0.012198457 0.013227429 0.002551694 0.000692724 0.000399248 -0.000694906 -0.004893784 -0.001267907 0.000506480 0.000333341 -0.000117359 -0.002201331 0.001322933 -0.000341753 0.000382624 0.000657431 0.002671437 0.000397038 0.001208105 -0.000044946 -0.000681371 0.001234756 0.000480581 -0.000344595 -0.000188883 -0.000048943 -0.000452025 0.000843306 0.000053692 -0.000318188 0.000792287 -0.000451437 -0.000151918 -0.005000936 -0.001071295 0.002158966 0.001773306 -0.000168902 -0.001034132 0.000363792 0.000247387 0.001782634 0.000782536 0.005555994 0.000929444 -0.001097409 0.001092132 0.000507623 0.000280284 -0.000303803 0.000247516 -0.000013815 -0.000035124 0.000145274 0.000079875 -0.000111532 -0.000057025 -0.000086723 0.000065649 -0.000211642 0.000070292 -0.000051294 -0.000065598 0.000269582 0.000158210 -0.000005091 -0.000208839 0.000579641 -0.000079202 0.000300561 0.000287665 -0.000916104 0.000132499 0.000126320 0.000425526 0.000004245 -0.000837072 0.000226102 0.000234597 -0.000056815 0.000857776 -0.000139898 0.000053103 -0.000406734 0.000408613 0.000135110 0.000007572 0.000050465 -0.002602044 -0.000539418 0.000658922 0.000297912 0.000239045 -0.000037735 0.000056445 -0.000290381 -0.000030935 0.000084698 -0.000006458 -0.000056575 -0.000109249 -0.000135385 0.000044574 0.000606225 0.000149336 0.000037577 -0.000160609 -0.000022920 -0.000813677 -0.000122729 0.000175300 0.000011577 0.000109283 -0.000225188 -0.000105197 0.000063743 0.000007876 0.000037588 0.000281522 0.000053673 -0.000109248 -0.000051389 0.000004253 0.109198206 0.004965160 0.494999029 -0.014139117 -0.029516512 0.612752432 -0.008106697 -0.011124898 -0.007665520 0.552904003 0.003011789 -0.068043241 0.063022137 0.035941491 0.080444994 0.001667119 0.062761764 -0.246068911 -0.107906787 -0.065535909 -0.000607163 0.034232309 -0.102963238 -0.108271373 -0.038215049 -0.000540112 -0.049195349 0.018925431 -0.016883690 -0.001017781 -0.000103243 0.020188003 -0.188863981 0.129226106 0.001213273 0.000026575 -0.017395210 0.128257772 -0.173164841 0.000769566 -0.001193292 -0.141841959 -0.023363699 -0.057020896 0.006149644 0.000496596 -0.024046092 -0.091533474 -0.018368408 -0.021515972 0.000313839 -0.064171694 -0.021103021 -0.141820930 -0.011911454 -0.000036474 -0.005523432 0.018196431 -0.014849134 0.000880190 0.000074556 -0.002947871 0.008687987 -0.006852371 0.000419579 0.000031542 -0.003460321 0.015488651 -0.013092393 0.000259377 0.000245550 0.006180505 -0.020194182 -0.013785637 -0.003728585 0.000232468 0.002581610 -0.007567660 -0.005205242 -0.001998520 0.000608686 0.006267375 -0.018204585 -0.012998707 -0.003617855 -0.000191175 -0.028893007 -0.007068473 0.005346514 0.002211248 -0.000077319 -0.010126417 -0.002477098 0.001748218 -0.001845458 0.000045507 -0.015381514 -0.008060754 0.019545034 -0.000777361 0.000072394 0.001191488 0.001600490 -0.000628606 -0.000302782 0.000205228 0.002985357 0.000501992 0.001027502 0.000678520 -0.000093652 -0.003379424 0.000530941 -0.002773876 -0.000074459 0.000065256 -0.002613359 -0.000770116 0.005538792 -0.000077449 0.000027140 -0.002139019 0.000576448 0.001489503 0.000359809 0.000018991 0.001700378 0.000968438 -0.001321857 0.000196074 0.256261640 0.116480398 0.117479761 0.005114448 -0.006871451 0.056751291 -0.015225500 0.019260615 -0.018084115 0.197129799 -0.010452640 0.012560774 0.019705295 -0.141624179 0.187432922 0.000823359 0.004210973 -0.003515418 0.000270653 -0.005275152 -0.006139239 -0.018129092 0.018591291 0.007229205 0.015645190 -0.003441467 -0.011312102 -0.016360309 -0.006977199 -0.015290678 -0.000025343 0.000722199 -0.003510243 -0.001802312 -0.002633903 0.000820162 -0.000191303 -0.002106260 0.000426808 -0.001808257 0.000501152 0.000142456 -0.003373760 -0.000949208 -0.002416780 -0.001160538 -0.003454696 0.000732264 0.000521695 0.000531681 0.001048356 -0.001616184 -0.000422028 0.000765271 -0.000029591 -0.000205811 -0.002236914 0.000259264 0.000104883 0.000220213 -0.000415739 0.001127499 -0.000338545 -0.000863054 0.001307187 0.001305590 -0.000505493 0.003429465 -0.000256537 0.001975835 -0.001547301 0.000151426 -0.003270377 0.001808712 -0.001959478 0.000222547 -0.000044109 0.000550040 -0.001366005 0.002013200 -0.000195168 -0.000206094 -0.001840533 -0.000555523 -0.001099011 0.001444384 -0.000314073 0.002733980 -0.001395756 0.001709899 0.000155663 -0.000035274 0.000412657 0.000255085 -0.000124913 -0.000243974 0.000274631 -0.000188039 0.000133019 0.000081827 -0.000100788 0.000128185 0.000586615 0.000022501 0.000045063 0.489988848 -0.019316329 0.562312245 0.024888974 -0.034936983 0.539825344 -0.061670442 0.044463348 -0.039749745 0.068190122 0.043038101 -0.204169286 0.125865193 -0.048330410 0.216472282 -0.037223650 0.123118834 -0.143472358 0.041157704 -0.134009115 -0.072377036 0.061739901 0.045365491 -0.002275782 0.003905489 0.056545900 -0.182708299 -0.099361765 0.007191027 -0.016474178 0.042720221 -0.102150365 -0.122935315 -0.006118728 0.013588421 -0.175501587 -0.035852483 0.023198759 0.011781839 0.005915117 -0.036425186 -0.078648100 0.021926283 -0.022093230 -0.006561617 0.022875009 0.006598224 -0.099448134 0.017800036 0.004219606 0.010238771 -0.019204269 0.033857760 -0.006289308 -0.002464646 -0.008057477 -0.003495335 0.022244486 -0.000748405 0.000523195 0.014033223 0.031723239 -0.024009473 0.003120835 0.000650149 -0.018311140 -0.008427080 -0.019034318 0.000032442 -0.000631613 -0.007588569 0.006229794 -0.004931910 0.001233703 0.000189349 0.009898931 0.004138638 0.009301028 -0.000912777 -0.000369045 0.156527765 0.003731664 0.078509462 -0.014848369 -0.062190499 0.198155006 0.012203653 -0.046445595 0.115106637 0.132874495 -0.006751067 -0.005599423 -0.003145536 0.004812351 0.505547495 0.011216465 0.018576708 0.005268454 -0.012420064 0.116116848 -0.011815118 0.017484900 0.007663568 -0.011456441 0.071647132 0.004439001 -0.000678791 -0.000077280 0.000471916 -0.103042511 0.001442071 -0.001198465 -0.000314505 0.002526110 -0.022275942 -0.000037773 -0.002986131 -0.001199709 0.001716601 0.005488498 0.000520624 0.000490950 0.001135467 0.000092312 -0.196242621 -0.000908312 -0.001357929 0.000104740 0.000971720 -0.035195557 0.000244890 -0.001506717 -0.000507960 0.000654559 -0.102860394 0.292712466 -0.247584476 0.832783757 -0.011183664 -0.013913015 0.083943259 -0.189409812 0.263357087 0.011123961 0.208625951 0.232055655 -0.572996728 0.003525017 -0.304530941 0.622445000 -0.035452340 -0.092094896 0.013076957 0.008524075 -0.014892994 -0.047307852 -0.017095803 0.015227558 0.009517689 0.023858090 -0.009768279 -0.122200769 -0.026761515 0.009387667 -0.036040745 0.203716699 0.028741265 0.043983604 0.116659315 0.002717086 0.149688239</array>
               <array cmlx:templateRef="normal-mode-eigvals" dataType="xsd:double" dictRef="cc:eigenval" size="132">-0.000111777 0.000013879 0.000036649 0.000043363 0.000081418 0.000103141 0.000148853 0.000221879 0.000263756 0.000442341 0.000547090 0.000621475 0.000825363 0.001320296 0.001421958 0.001625659 0.001791197 0.002054586 0.002584965 0.002798685 0.003024900 0.003565588 0.003905071 0.004604959 0.005153143 0.005933772 0.006395028 0.007379931 0.008745778 0.011291539 0.012969669 0.018114468 0.021378303 0.021430133 0.021564675 0.021877794 0.023397847 0.024008089 0.025373899 0.026903287 0.027559252 0.029134290 0.029487616 0.030302086 0.032941181 0.033879957 0.035788324 0.036358471 0.036945327 0.037501200 0.039583154 0.040703199 0.043987040 0.044203268 0.046012287 0.046462731 0.047318332 0.048114938 0.049131356 0.049239215 0.050211687 0.050377994 0.054278056 0.056337777 0.059066990 0.060067608 0.060176405 0.061400671 0.064782591 0.065288232 0.066530370 0.066882923 0.068308624 0.069308354 0.070182908 0.071252991 0.072540939 0.072681593 0.073907305 0.074496337 0.075017331 0.076761740 0.076971798 0.077126790 0.077372079 0.080408395 0.081078419 0.081599228 0.082163861 0.083101829 0.083433219 0.083495105 0.083701009 0.084034275 0.084360563 0.084567110 0.084869091 0.085038633 0.085729089 0.086873855 0.087810778 0.105698596 0.116437345 0.318813523 0.328591678 0.330924562 0.336132390 0.339015688 0.342140710 0.342723079 0.343263618 0.344967653 0.345526942 0.349026957 0.350496434 0.351884970 0.353446544 0.354860239 0.355285404 0.355468007 0.360121629 0.360615731 0.363182057 0.363482962 0.364607156 0.364667666 0.364685242 0.365436029 0.369012319 0.369651227 0.373317249 0.381897437</array>
            </module>
         </module>
      </module>
   </module>
</module>
