<?xml version="1.0" encoding="UTF-8"?>
<module xmlns="http://www.xml-cml.org/schema"
        xmlns:g="http://www.iochem-bd.org/dictionary/gaussian/"
        xmlns:xi="http://www.w3.org/2001/XInclude"
        xmlns:nonsi="http://www.xml-cml.org/unit/nonSi/"
        xmlns:compchem="http://www.xml-cml.org/dictionary/compchem/"
        xmlns:xsd="http://www.w3.org/2001/XMLSchema"
        xmlns:convention="http://www.xml-cml.org/convention/"
        xmlns:cmlx="http://www.xml-cml.org/schema/cmlx"
        xmlns:cml="http://www.xml-cml.org/schema"
        xmlns:cc="http://www.xml-cml.org/dictionary/compchem/"
        xmlns:si="http://www.xml-cml.org/unit/si/"
        xmlns:nonsi2="http://www.iochem-bd.org/unit/nonSi2/"
        convention="convention:compchem"
        id="gaussian.log">
   <module dictRef="cc:jobList" id="jobList1">
      <module cmlx:templateRef="job" dictRef="cc:job" id="job">
         <module dictRef="cc:environment" id="environment">
            <parameterList>
               <parameter dictRef="cc:program">
                  <scalar dataType="xsd:string">Gaussian 09</scalar>
               </parameter>
               <parameter dictRef="cc:hostname">
                  <scalar dataType="xsd:string">GINC-KIMIK2029</scalar>
               </parameter>
               <parameter dictRef="cc:jobname">
                  <scalar dataType="xsd:string">CBGUSER</scalar>
               </parameter>
               <parameter dictRef="cc:title">
                  <scalar dataType="xsd:string">000102618</scalar>
               </parameter>
               <parameter dictRef="cc:version">
                  <scalar dataType="xsd:string">EM64L-G09RevD.01</scalar>
               </parameter>
               <parameter dictRef="cc:run.date">
                  <scalar dataType="xsd:string">26-Jul-2017</scalar>
               </parameter>
               <parameter dictRef="cc:program">
                  <scalar dataType="xsd:string">Gaussian 09</scalar>
               </parameter>
               <parameter dictRef="cc:program.date">
                  <scalar dataType="xsd:string">24-Apr-2013</scalar>
               </parameter>
               <parameter dictRef="cc:version">
                  <scalar dataType="xsd:string">EM64L-G09RevD.01</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:diffuse">
                  <scalar dataType="xsd:string">(6D, 10F)</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">SDD</scalar>
               </parameter>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string">RPBEPBE</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">SDD</scalar>
               </parameter>
               <parameter dictRef="g:operation">
                  <scalar dataType="xsd:string">FOpt</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">#popt=(loose)</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">PBEPBE/SDD</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">pop=(full,Hirshfeld,</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">NPA)</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">GFInput</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">nosymm</scalar>
               </parameter>
            </parameterList>
            <molecule cmlx:templateRef="mol"
                      formalCharge="0"
                      id="zmat"
                      spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="1.5817"
                        y3="-0.7368"
                        z3="0.1788"/>
                  <atom elementType="C"
                        id="a2"
                        x3="0.5609"
                        y3="-0.0131"
                        z3="-0.4825"/>
                  <atom elementType="C"
                        id="a3"
                        x3="-0.7560"
                        y3="0.0025"
                        z3="0.2903"/>
                  <atom elementType="C" id="a4" x3="1.7428" y3="0.6833" z3="0.0683"/>
                  <atom elementType="C"
                        id="a5"
                        x3="-1.5312"
                        y3="1.2865"
                        z3="0.0043"/>
                  <atom elementType="C"
                        id="a6"
                        x3="-1.5982"
                        y3="-1.2224"
                        z3="-0.0593"/>
                  <atom elementType="H"
                        id="a7"
                        x3="0.4575"
                        y3="-0.1096"
                        z3="-1.5540"/>
                  <atom elementType="H"
                        id="a8"
                        x3="-0.5438"
                        y3="-0.0301"
                        z3="1.3672"/>
                  <atom elementType="H"
                        id="a9"
                        x3="2.4925"
                        y3="1.0471"
                        z3="-0.6223"/>
                  <atom elementType="H"
                        id="a10"
                        x3="1.6382"
                        y3="1.2704"
                        z3="0.9714"/>
                  <atom elementType="H"
                        id="a11"
                        x3="-1.7709"
                        y3="1.3758"
                        z3="-1.0611"/>
                  <atom elementType="H"
                        id="a12"
                        x3="-2.4686"
                        y3="1.3127"
                        z3="0.5694"/>
                  <atom elementType="H"
                        id="a13"
                        x3="-0.9427"
                        y3="2.1667"
                        z3="0.2844"/>
                  <atom elementType="H"
                        id="a14"
                        x3="-1.8500"
                        y3="-1.2405"
                        z3="-1.1254"/>
                  <atom elementType="H"
                        id="a15"
                        x3="-2.5318"
                        y3="-1.2324"
                        z3="0.5128"/>
                  <atom elementType="H"
                        id="a16"
                        x3="-1.0523"
                        y3="-2.1448"
                        z3="0.1662"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a4" order="S"/>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a2 a4" order="S"/>
                  <bond atomRefs2="a2 a7" order="S"/>
                  <bond atomRefs2="a3 a6" order="S"/>
                  <bond atomRefs2="a3 a5" order="S"/>
                  <bond atomRefs2="a3 a8" order="S"/>
                  <bond atomRefs2="a4 a9" order="S"/>
                  <bond atomRefs2="a4 a10" order="S"/>
                  <bond atomRefs2="a5 a11" order="S"/>
                  <bond atomRefs2="a5 a13" order="S"/>
                  <bond atomRefs2="a5 a12" order="S"/>
                  <bond atomRefs2="a6 a14" order="S"/>
                  <bond atomRefs2="a6 a16" order="S"/>
                  <bond atomRefs2="a6 a15" order="S"/>
               </bondArray>
               <formula concise="C 5 H 10 O 1"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">76.05290000000001</scalar>
               </property>
               <list cmlx:templateRef="charge">
                  <list>
                     <scalar dataType="xsd:integer" dictRef="g:charge">0</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:mult">1</scalar>
                  </list>
               </list>
               <formula convention="iupac:inchi"
                        inline="InChI=1S/C5H10O/c1-4(2)5-3-6-5/h4-5H,3H2,1-2H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:5,6,4,3,2,1/E:(1,2)/rA:16OCCCCCHHHHHHHHHH/rB:s1;s2;s1s2;s3;s3;s2;s3;s4;s4;s5;s5;s5;s6;s6;s6;/rC:;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="entering" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:string" dictRef="g:link0">g09</scalar>
                  <array dataType="xsd:string" dictRef="g:command" size="3">/mnt/data/applications/G09/g09/l1.exe "/scratch/Gau-28680.inp" -scrdir="/scratch/"</array>
               </module>
               <module cmlx:templateRef="l1" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l1.end">
                     <array dataType="xsd:string" dictRef="g:kk" size="1">chk=000102618.chk</array>
                     <array dataType="xsd:string" dictRef="g:kk" size="1">nprocshared=4</array>
                     <array dataType="xsd:string" dictRef="g:kk" size="1">mem=7GB</array>
                     <scalar cmlx:templateRef="title" dataType="xsd:string" dictRef="cc:title">#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm</scalar>
                     <list cmlx:templateRef="control">
                        <scalar dataType="xsd:string" dictRef="g:control">1/7=-1,14=-1,18=20,19=15,26=3,38=1/1,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">2/9=110,12=2,15=1,17=6,18=5,40=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">3/5=17,6=7,11=2,16=1,24=10,25=1,30=1,71=1,74=1009/1,2,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">4//1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">5/5=2,38=5/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">6/7=3,28=1,40=-1,79=1/1,7</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">7/30=1/1,2,3,16</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">1/7=-1,14=-1,18=20,19=15,26=3/3(2)</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">2/9=110,15=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">99//99</scalar>
                     </list>
                     <list cmlx:templateRef="control">
                        <scalar dataType="xsd:string" dictRef="g:control">2/9=110,15=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">3/5=17,6=7,11=2,16=1,25=1,30=1,71=1,74=1009/1,2,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">4/5=5,16=3,69=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">5/5=2,38=5/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">7/30=1/1,2,3,16</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">1/7=-1,14=-1,18=20,19=15,26=3/3(-5)</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">2/9=110,15=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">6/7=3,19=2,28=1,40=-1,79=1/1,7</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">99/9=1/99</scalar>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l101" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l101.title">
                     <scalar cmlx:templateRef="title" dataType="xsd:string" dictRef="cc:title">000102618</scalar>
                  </module>
                  <module cmlx:templateRef="l101.isotope2">
                     <array cmlx:templateRef="atom"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="16">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16</array>
                     <array cmlx:templateRef="iatwgt"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="16">16 12 12 12 12 12 1 1 1 1 1 1 1 1 1 1</array>
                     <array cmlx:templateRef="atmwgt"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="16">15.9949146 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250</array>
                     <array cmlx:templateRef="nucspn"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="16">0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1</array>
                     <array cmlx:templateRef="atzeff"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="16">0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000</array>
                  </module>
                  <list cmlx:templateRef="rest">
                     <scalar dataType="xsd:string" dictRef="x:l101">(Enter /mnt/data/applications/G09/g09/l101.exe)</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l103" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="berny">
                     <scalar dataType="xsd:string" dictRef="g:optimization">Initialization pass.</scalar>
                  </list>
                  <module cmlx:templateRef="l103.init">
                     <list cmlx:templateRef="length">
                        <array dataType="xsd:string" dictRef="g:symbol" size="16">R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="16">1 1 2 2 2 3 3 3 4 4 5 5 5 6 6 6</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="16">2 4 3 4 7 5 6 8 9 10 11 12 13 14 15 16</array>
                        <array dataType="xsd:double" dictRef="cc:distance" size="16">1.4153 1.4335 1.527 1.4783 1.0808 1.5269 1.5271 1.0981 1.0823 1.0822 1.0957 1.0949 1.0952 1.0956 1.095 1.0953</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="16">estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2</array>
                     </list>
                     <list cmlx:templateRef="angle">
                        <array dataType="xsd:string" dictRef="g:symbol" size="28">A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="28">1 1 3 3 4 2 2 2 5 5 6 1 1 2 2 9 3 3 3 11 11 12 3 3 3 14 14 15</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="28">2 2 2 2 2 3 3 3 3 3 3 4 4 4 4 4 5 5 5 5 5 5 6 6 6 6 6 6</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="28">3 7 4 7 7 5 6 8 6 8 8 9 10 9 10 10 11 12 13 12 13 13 14 15 16 15 16 16</array>
                        <array dataType="xsd:double" dictRef="cc:angle" size="28">113.0028 119.1159 119.7448 114.8439 119.2059 110.5879 110.584 109.2304 110.588 107.8647 107.8956 117.3899 117.5319 118.3224 119.2893 114.6503 111.207 110.9851 110.8006 108.217 107.5013 107.9879 111.2713 110.9739 110.7015 108.198 107.5162 108.0403</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="28">estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2</array>
                     </list>
                     <list cmlx:templateRef="dihed">
                        <array dataType="xsd:string" dictRef="g:symbol" size="31">D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="31">1 1 1 4 4 4 7 7 7 3 3 7 7 2 2 2 6 6 6 8 8 8 2 2 2 5 5 5 8 8 8</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="31">2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="31">3 3 3 3 3 3 3 3 3 4 4 4 4 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 6 6 6</array>
                        <array dataType="xsd:integer" dictRef="g:atom4" size="31">5 6 8 5 6 8 5 6 8 9 10 9 10 11 12 13 11 12 13 11 12 13 14 15 16 14 15 16 14 15 16</array>
                        <array dataType="xsd:double" dictRef="cc:dihed" size="31">150.0044 -87.1536 31.4432 83.2941 -153.8638 -35.267 -68.8196 54.0224 172.6192 -153.0855 -5.3541 -2.1798 145.5515 60.496 -178.9749 -59.0065 -62.3438 58.1853 178.1538 179.8847 -59.5862 60.3822 -61.0718 178.3874 58.426 61.7702 -58.7706 -178.732 179.5228 58.982 -60.9794</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="31">estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l103.trust">
                     <scalar dataType="xsd:double" dictRef="g:trustrad">3.00e-01</scalar>
                     <scalar dataType="xsd:double" dictRef="g:fncerr">1.00e-07</scalar>
                     <scalar dataType="xsd:double" dictRef="g:grderr">1.00e-06</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:nstep">85</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:allowedstep">100</scalar>
                  </module>
                  <module cmlx:templateRef="l103.catchall">
                     <list cmlx:templateRef="l103.discard">
                        <scalar dataType="xsd:string" dictRef="x:discard"/>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l301.basis" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="ernie">
                     <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                     <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                     <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                  </module>
                  <scalar dataType="xsd:string" dictRef="g:misc">IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX=  0.000000</scalar>
                  <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  1.000000  1.000000  1.000000  1.000000 ScalE2=  1.000000  1.000000</scalar>
                  <module cmlx:templateRef="natoms">
                     <scalar dataType="xsd:integer" dictRef="cc:natoms">16</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">16</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">16</scalar>
                     <scalar dataType="xsd:double" dictRef="g:sfac">1.00e+00</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:natfmm">60</scalar>
                     <scalar dataType="xsd:string" dictRef="g:big">F</scalar>
                  </module>
               </module>
               <module cmlx:templateRef="l302.basis" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="basis">
                     <array dataType="xsd:string" dictRef="g:basis" size="11">NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="8">NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0.</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="5">One-electron integrals computed using PRISM.</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="6">1 Symmetry operations used in ECPInt.</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="9">ECPInt: NShTT= 1596 NPrTT= 7906 LenC2= 1579 LenP2D= 6093.</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="6">LDataN: DoStor=T MaxTD1= 2 Len= 12</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="8">NBasis= 80 RedAO= T EigKep= 3.62D-03 NBF= 80</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="7">NBsUse= 80 1.00D-06 EigRej= -1.00D+00 NBFU= 80</array>
                  </list>
               </module>
               <module cmlx:templateRef="l103" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="berny">
                     <scalar dataType="xsd:string" dictRef="g:optimization">Using GEDIIS/GDIIS optimizer.</scalar>
                  </list>
                  <module cmlx:templateRef="l103.localminsaddle">
                     <scalar cmlx:templateRef="r" dataType="xsd:string" dictRef="cc:minmaxts">local minimum</scalar>
                     <array cmlx:templateRef="junk"
                            dataType="xsd:string"
                            dictRef="x:junk1"
                            size="9">Step number 5 out of a maximum of 85</array>
                     <array cmlx:templateRef="junk"
                            dataType="xsd:string"
                            dictRef="x:junk1"
                            size="7">All quantities printed in internal units (Hartrees-Bohrs-Radians)</array>
                     <array cmlx:templateRef="eigenvaluelist"
                            dataType="xsd:double"
                            dictRef=""
                            size="42">0.00329 0.00408 0.00409 0.02254 0.03221 0.03716 0.04442 0.04699 0.05033 0.05486 0.05565 0.05579 0.05601 0.12336 0.13884 0.15655 0.15985 0.16000 0.16000 0.16000 0.16020 0.16069 0.16186 0.16539 0.17008 0.19953 0.27931 0.29266 0.29989 0.30524 0.32767 0.33902 0.34158 0.34176 0.34214 0.34229 0.34262 0.34847 0.35695 0.35818 0.36074 0.39137</array>
                     <array cmlx:templateRef="junk"
                            dataType="xsd:string"
                            dictRef="x:junk1"
                            size="3">RFO step: Lambda=-7.03061001D-07.</array>
                     <list cmlx:templateRef="iterationList">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="3">1 2 3</array>
                        <array dataType="xsd:double" dictRef="g:rmscart" size="3">0.00125329 0.00000128 0.00000000</array>
                        <array dataType="xsd:double" dictRef="g:rmsint" size="3">0.00000127 0.00000060 0.00000060</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l103.deltas">
                     <list cmlx:templateRef="delta">
                        <array dataType="xsd:string" dictRef="cc:variable" size="75">R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31</array>
                        <array dataType="xsd:double" dictRef="g:lastval" size="75">2.86285 2.85917 2.87676 2.82920 2.08213 2.92616 2.92247 2.09541 2.07342 2.07547 2.09216 2.08844 2.08941 2.09240 2.08889 2.08668 2.03265 1.96458 2.13412 2.01025 2.05490 1.91628 1.92398 1.87557 1.95230 1.90186 1.89196 2.00500 1.99720 2.09696 2.07677 2.01891 1.93501 1.93073 1.94819 1.87738 1.88416 1.88590 1.93518 1.93618 1.93089 1.88068 1.88755 1.89159 2.84546 -1.27928 0.77927 1.62175 -2.50299 -0.44443 -1.08085 1.07759 3.13615 -2.66061 0.01774 0.03142 2.70977 1.06422 -3.13772 -1.03710 -1.07756 1.00368 3.10430 3.11407 -1.08787 1.01275 -1.09650 3.09763 0.99770 1.04090 -1.04816 3.13510 3.13825 1.04919 -1.05073</array>
                        <array dataType="xsd:double" dictRef="cc:deriv" size="75">0.00007 -0.00033 -0.00010 -0.00006 -0.00009 0.00010 -0.00005 -0.00005 0.00000 -0.00004 -0.00003 -0.00001 0.00001 -0.00003 -0.00003 0.00000 0.00002 0.00001 0.00002 0.00008 -0.00008 0.00005 -0.00002 0.00002 -0.00002 -0.00003 0.00001 -0.00003 0.00001 -0.00012 -0.00001 0.00007 0.00002 0.00000 -0.00003 0.00001 0.00000 0.00001 0.00001 -0.00003 -0.00002 0.00002 0.00000 0.00003 -0.00009 -0.00009 -0.00008 0.00007 0.00006 0.00007 0.00003 0.00002 0.00003 0.00000 -0.00012 0.00008 -0.00005 -0.00002 0.00000 -0.00001 -0.00001 0.00001 -0.00001 0.00001 0.00003 0.00002 0.00000 -0.00001 -0.00001 0.00004 0.00003 0.00002 -0.00001 -0.00002 -0.00003</array>
                        <array dataType="xsd:double" dictRef="cc:delta.linear" size="75">0.00033 -0.00026 -0.00046 0.00018 -0.00026 0.00006 -0.00005 -0.00014 -0.00024 -0.00017 -0.00009 -0.00013 -0.00003 -0.00016 -0.00012 -0.00012 -0.00066 -0.00040 0.00037 0.00033 -0.00008 -0.00011 0.00005 0.00051 0.00000 -0.00050 0.00008 -0.00006 -0.00033 -0.00038 0.00013 0.00031 0.00011 -0.00004 -0.00004 0.00013 -0.00003 -0.00013 0.00023 -0.00008 -0.00018 0.00008 -0.00019 0.00014 0.00139 0.00134 0.00176 0.00186 0.00181 0.00223 0.00036 0.00031 0.00073 -0.00094 -0.00071 0.00071 0.00094 0.00012 0.00033 0.00012 0.00015 0.00036 0.00014 0.00038 0.00059 0.00037 0.00027 0.00006 0.00006 0.00015 -0.00005 -0.00006 -0.00043 -0.00063 -0.00063</array>
                        <array dataType="xsd:double" dictRef="cc:delta.quad" size="75">0.00032 -0.00129 -0.00019 -0.00011 -0.00017 0.00042 -0.00016 -0.00009 0.00011 -0.00005 -0.00006 0.00003 0.00005 -0.00002 -0.00004 0.00007 -0.00023 0.00053 -0.00033 0.00074 -0.00058 0.00058 0.00002 0.00029 -0.00023 -0.00039 -0.00026 0.00041 0.00127 -0.00101 -0.00064 0.00029 0.00020 0.00003 -0.00029 0.00015 -0.00005 -0.00003 -0.00004 -0.00010 -0.00013 0.00017 -0.00004 0.00015 -0.00001 0.00010 -0.00003 0.00090 0.00101 0.00088 0.00144 0.00156 0.00143 0.00071 -0.00247 0.00046 -0.00272 0.00062 0.00096 0.00075 0.00035 0.00069 0.00048 0.00108 0.00142 0.00120 0.00000 -0.00012 -0.00016 0.00059 0.00047 0.00043 -0.00021 -0.00033 -0.00037</array>
                        <array dataType="xsd:double" dictRef="cc:delta.total" size="75">0.00065 -0.00155 -0.00065 0.00007 -0.00044 0.00047 -0.00021 -0.00023 -0.00012 -0.00022 -0.00014 -0.00011 0.00002 -0.00017 -0.00017 -0.00005 -0.00089 0.00013 0.00004 0.00107 -0.00067 0.00046 0.00006 0.00080 -0.00023 -0.00090 -0.00018 0.00035 0.00094 -0.00140 -0.00051 0.00060 0.00031 -0.00001 -0.00034 0.00028 -0.00008 -0.00016 0.00020 -0.00018 -0.00031 0.00025 -0.00023 0.00029 0.00138 0.00144 0.00173 0.00276 0.00282 0.00311 0.00180 0.00186 0.00215 -0.00023 -0.00318 0.00117 -0.00178 0.00075 0.00129 0.00086 0.00050 0.00105 0.00062 0.00146 0.00201 0.00158 0.00026 -0.00006 -0.00010 0.00074 0.00041 0.00038 -0.00064 -0.00096 -0.00100</array>
                        <array dataType="xsd:double" dictRef="cc:newval" size="75">2.86350 2.85761 2.87612 2.82927 2.08169 2.92663 2.92226 2.09518 2.07330 2.07525 2.09202 2.08833 2.08943 2.09223 2.08872 2.08663 2.03175 1.96471 2.13416 2.01132 2.05423 1.91674 1.92404 1.87637 1.95206 1.90097 1.89178 2.00534 1.99814 2.09557 2.07627 2.01951 1.93532 1.93072 1.94786 1.87766 1.88408 1.88574 1.93538 1.93600 1.93059 1.88093 1.88732 1.89188 2.84684 -1.27784 0.78100 1.62451 -2.50017 -0.44133 -1.07905 1.07946 3.13830 -2.66083 0.01457 0.03259 2.70799 1.06497 -3.13643 -1.03624 -1.07706 1.00473 3.10492 3.11553 -1.08586 1.01433 -1.09624 3.09757 0.99760 1.04163 -1.04774 3.13548 3.13761 1.04824 -1.05173</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l103.itemconverge">
                     <list cmlx:templateRef="row">
                        <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">0.000333 0.000060 0.004357 0.001253</array>
                        <array dataType="xsd:double" dictRef="g:threshold" size="4">0.002500 0.001667 0.010000 0.006667</array>
                        <array dataType="xsd:string" dictRef="g:converged" size="4">YES YES YES YES</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="preddelta">
                     <list cmlx:templateRef="predicted">
                        <scalar dataType="xsd:double" dictRef="g:predchange">-1.148688e-06</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="l103.optimizedparam">
                     <list cmlx:templateRef="completed">
                        <scalar dataType="xsd:string" dictRef="g:optimization">Optimization completed.</scalar>
                        <scalar dataType="xsd:string" dictRef="g:optimization">-- Stationary point found.</scalar>
                     </list>
                     <list cmlx:templateRef="length">
                        <array dataType="xsd:string" dictRef="g:symbol" size="16">R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="16">1 1 2 2 2 3 3 3 4 4 5 5 5 6 6 6</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="16">2 4 3 4 7 5 6 8 9 10 11 12 13 14 15 16</array>
                        <array dataType="xsd:double" dictRef="cc:distance" size="16">1.515 1.513 1.5223 1.4971 1.1018 1.5485 1.5465 1.1088 1.0972 1.0983 1.1071 1.1052 1.1057 1.1073 1.1054 1.1042</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="16">-DE/DX =    0.0001|-DE/DX =   -0.0003|-DE/DX =   -0.0001|-DE/DX =   -0.0001|-DE/DX =   -0.0001|-DE/DX =    0.0001|-DE/DX =   -0.0001|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0</array>
                     </list>
                     <list cmlx:templateRef="angle">
                        <array dataType="xsd:string" dictRef="g:symbol" size="28">A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="28">1 1 3 3 4 2 2 2 5 5 6 1 1 2 2 9 3 3 3 11 11 12 3 3 3 14 14 15</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="28">2 2 2 2 2 3 3 3 3 3 3 4 4 4 4 4 5 5 5 5 5 5 6 6 6 6 6 6</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="28">3 7 4 7 7 5 6 8 6 8 8 9 10 9 10 10 11 12 13 12 13 13 14 15 16 15 16 16</array>
                        <array dataType="xsd:double" dictRef="cc:angle" size="28">116.462 112.5623 122.2761 115.1786 117.7371 109.7948 110.2358 107.462 111.8584 108.9687 108.401 114.8779 114.4308 120.1471 118.9904 115.6748 110.8679 110.6226 111.6233 107.5659 107.9544 108.0543 110.8779 110.935 110.6319 107.7553 108.1489 108.3803</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="28">-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0001|-DE/DX =   -0.0001|-DE/DX =    0.0001|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =   -0.0001|-DE/DX =    0.0|-DE/DX =    0.0001|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0</array>
                     </list>
                     <list cmlx:templateRef="dihed">
                        <array dataType="xsd:string" dictRef="g:symbol" size="30">D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="30">1 1 1 4 4 4 7 7 7 3 3 7 7 2 2 2 6 6 6 8 8 8 2 2 2 5 5 5 8 8</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="30">2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="30">3 3 3 3 3 3 3 3 3 4 4 4 4 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 6 6</array>
                        <array dataType="xsd:integer" dictRef="g:atom4" size="30">5 6 8 5 6 8 5 6 8 9 10 9 10 11 12 13 11 12 13 11 12 13 14 15 16 14 15 16 14 15</array>
                        <array dataType="xsd:double" dictRef="cc:dihed" size="30">163.0328 -73.2975 44.649 92.9195 -143.4108 -25.4642 -61.9283 61.7414 179.6879 -152.4414 1.0167 1.8002 155.2583 60.9753 -179.7782 -59.4217 -61.7399 57.5065 177.8631 178.4232 -62.3303 58.0262 -62.8249 177.4811 57.164 59.6391 -60.0549 179.628 179.8084 60.1144</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="30">-DE/DX =   -0.0001|-DE/DX =   -0.0001|-DE/DX =   -0.0001|-DE/DX =    0.0001|-DE/DX =    0.0001|-DE/DX =    0.0001|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =   -0.0001|-DE/DX =    0.0001|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l103.catchall">
                     <list cmlx:templateRef="l103.discard">
                        <scalar dataType="xsd:string" dictRef="x:discard"/>
                     </list>
                  </module>
                  <scalar dictRef="l103.converged.count">1</scalar>
               </module>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation">
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.orient">
                     <molecule cmlx:templateRef="atom"
                               formalCharge="0"
                               id="mol.l202.orient"
                               spinMultiplicity="1">
                        <atomArray>
                           <atom elementType="O"
                                 id="a1"
                                 x3="1.5817"
                                 y3="-0.7368"
                                 z3="0.1788">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a2"
                                 x3="0.5609"
                                 y3="-0.0131"
                                 z3="-0.4825">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a3"
                                 x3="-0.7560"
                                 y3="0.0025"
                                 z3="0.2903">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C" id="a4" x3="1.7428" y3="0.6833" z3="0.0683">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a5"
                                 x3="-1.5312"
                                 y3="1.2865"
                                 z3="0.0043">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a6"
                                 x3="-1.5982"
                                 y3="-1.2224"
                                 z3="-0.0593">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a7"
                                 x3="0.4575"
                                 y3="-0.1096"
                                 z3="-1.5540">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a8"
                                 x3="-0.5438"
                                 y3="-0.0301"
                                 z3="1.3672">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a9"
                                 x3="2.4925"
                                 y3="1.0471"
                                 z3="-0.6223">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a10"
                                 x3="1.6382"
                                 y3="1.2704"
                                 z3="0.9714">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a11"
                                 x3="-1.7709"
                                 y3="1.3758"
                                 z3="-1.0611">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a12"
                                 x3="-2.4686"
                                 y3="1.3127"
                                 z3="0.5694">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a13"
                                 x3="-0.9427"
                                 y3="2.1667"
                                 z3="0.2844">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a14"
                                 x3="-1.8500"
                                 y3="-1.2405"
                                 z3="-1.1254">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a15"
                                 x3="-2.5318"
                                 y3="-1.2324"
                                 z3="0.5128">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a16"
                                 x3="-1.0523"
                                 y3="-2.1448"
                                 z3="0.1662">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a4" order="S"/>
                           <bond atomRefs2="a1 a2" order="S"/>
                           <bond atomRefs2="a2 a3" order="S"/>
                           <bond atomRefs2="a2 a4" order="S"/>
                           <bond atomRefs2="a2 a7" order="S"/>
                           <bond atomRefs2="a3 a6" order="S"/>
                           <bond atomRefs2="a3 a5" order="S"/>
                           <bond atomRefs2="a3 a8" order="S"/>
                           <bond atomRefs2="a4 a9" order="S"/>
                           <bond atomRefs2="a4 a10" order="S"/>
                           <bond atomRefs2="a5 a11" order="S"/>
                           <bond atomRefs2="a5 a13" order="S"/>
                           <bond atomRefs2="a5 a12" order="S"/>
                           <bond atomRefs2="a6 a14" order="S"/>
                           <bond atomRefs2="a6 a16" order="S"/>
                           <bond atomRefs2="a6 a15" order="S"/>
                        </bondArray>
                        <formula concise="C 5 H 10 O 1"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">76.05290000000001</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1S/C5H10O/c1-4(2)5-3-6-5/h4-5H,3H2,1-2H3">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:5,6,4,3,2,1/E:(1,2)/rA:16OCCCCCHHHHHHHHHH/rB:s1;s2;s1s2;s3;s3;s2;s3;s4;s4;s5;s5;s5;s6;s6;s6;/rC:;;;;;;;;;;;;;;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
                  <module cmlx:templateRef="l202.distmat">
                     <array dataType="xsd:double" dictRef="cc:distance" size="136">0.000000 1.415306 0.000000 2.454351 1.526987 0.000000 1.433474 1.478256 2.599380 0.000000 3.716765 2.510541 1.526888 3.329718 0.000000 3.225564 2.510621 1.527056 3.848409 2.510600 0.000000 2.158657 1.080794 2.210564 2.216426 2.886576 2.774591 0.000000 2.535640 2.154540 1.098092 2.724816 2.136794 2.137344 3.089066 0.000000 2.157224 2.207860 3.532249 1.082279 4.079228 4.711839 2.519374 3.786501 0.000000 2.158763 2.218507 2.793503 1.082228 3.313705 4.213156 3.110643 2.570813 1.821969 0.000000 4.152151 2.775088 2.177672 3.755155 1.095677 2.789995 2.723074 3.062510 4.298508 3.970407 0.000000 4.556089 3.470174 2.174286 4.287556 1.094871 2.753106 3.885077 2.478800 5.109130 4.126645 1.774626 0.000000 3.848904 2.756896 2.172246 3.075563 1.095235 3.468978 3.243735 2.481433 3.725078 2.817156 1.766864 1.771697 0.000000 3.705566 2.780696 2.178553 4.246662 2.786321 1.095582 2.605223 3.063377 4.933916 4.782126 2.618285 3.126315 3.797333 0.000000 4.156688 3.470174 2.174385 4.705283 2.757649 1.094992 3.803716 2.475413 5.632776 4.885000 3.139879 2.546514 3.759160 1.774434 0.000000 2.986734 2.750885 2.171196 3.977476 3.468339 1.095299 3.062780 2.484538 4.834828 4.421621 3.797009 3.758029 4.314512 1.767007 1.772435 0.000000</array>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">6.0093388 2.6632313 2.0419197</array>
                  </module>
               </module>
               <module cmlx:templateRef="l601.popanal" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="g:alphaocc" size="19">-9.87670 -1.01138 -0.72820 -0.61991 -0.60120 -0.57655 -0.51696 -0.44482 -0.43170 -0.39821 -0.37336 -0.36341 -0.34648 -0.33886 -0.30334 -0.29690 -0.28978 -0.25485 -0.21135</array>
                  <array dataType="xsd:double" dictRef="g:alphavirt" size="56">0.05684 0.07153 0.09200 0.10721 0.12116 0.12702 0.13450 0.15293 0.16731 0.17799 0.19009 0.20271 0.21442 0.22235 0.23362 0.24429 0.26473 0.27949 0.30415 0.32034 0.32686 0.33117 0.34558 0.38302 0.38597 0.42208 0.43705 0.45024 0.47896 0.49582 0.52616 0.62975 0.76865 0.81828 0.84550 0.85793 0.93242 0.96583 0.98805 1.05294 1.07015 1.09005 1.10507 1.13770 1.15390 1.16500 1.24558 1.28222 1.36822 1.65204 22.41806 22.54461 22.62363 22.63903 22.67947 41.50812</array>
                  <module cmlx:templateRef="l601.orbital.closedshell">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="80">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</array>
                     <array dataType="xsd:string"
                            delimiter="|"
                            dictRef="cc:occupation"
                            size="80">O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V</array>
                     <array dataType="xsd:double" dictRef="cc:eigenvalues" size="80">-18.76823 -9.94453 -9.93885 -9.90083 -9.88058 -9.87670 -1.01138 -0.72820 -0.61991 -0.60120 -0.57655 -0.51696 -0.44482 -0.43170 -0.39821 -0.37336 -0.36341 -0.34648 -0.33886 -0.30334 -0.29690 -0.28978 -0.25485 -0.21135 0.05684 0.07153 0.09200 0.10721 0.12116 0.12702 0.13450 0.15293 0.16731 0.17799 0.19009 0.20271 0.21442 0.22235 0.23362 0.24429 0.26473 0.27949 0.30415 0.32034 0.32686 0.33117 0.34558 0.38302 0.38597 0.42208 0.43705 0.45024 0.47896 0.49582 0.52616 0.62975 0.76865 0.81828 0.84550 0.85793 0.93242 0.96583 0.98805 1.05294 1.07015 1.09005 1.10507 1.13770 1.15390 1.16500 1.24558 1.28222 1.36822 1.65204 22.41806 22.54461 22.62363 22.63903 22.67947 41.50812</array>
                     <matrix cols="80"
                             dataType="xsd:double"
                             dictRef="g:orbitalcoeff"
                             rows="80">0.58052 -0.00001 -0.00001 0.00000 0.00000 0.00000 -0.10988 0.02191 -0.02357 -0.06865 -0.00001 -0.01343 -0.03552 -0.02750 -0.00978 -0.00725 0.01877 0.00773 0.00651 -0.00998 0.00789 0.00133 -0.02691 0.00086 -0.03947 0.03415 0.00399 0.01615 -0.00510 -0.00884 0.00818 0.00865 -0.00070 0.00824 -0.00347 0.00911 0.01854 -0.00552 0.00155 -0.01419 -0.00202 -0.01003 -0.00791 0.00007 0.00101 0.00037 -0.01656 -0.00642 0.00846 -0.01023 -0.00599 0.01046 0.01496 -0.00499 0.00256 0.03009 -0.00750 -0.00120 0.00294 0.00240 -0.00861 -0.00526 0.00684 -0.01151 -0.00691 0.01177 -0.00538 -0.00029 0.00069 -0.00550 -0.03252 -0.00371 -0.00546 0.14670 -0.00103 0.00028 -0.00123 -0.00142 -0.00129 -1.73065 0.45931 0.00000 -0.00001 0.00002 0.00001 -0.00002 -0.14584 0.02926 -0.03152 -0.09180 -0.00002 -0.01797 -0.04739 -0.03666 -0.01299 -0.00972 0.02509 0.01041 0.00868 -0.01331 0.01063 0.00196 -0.03615 0.00126 -0.05224 0.04506 0.00559 0.02208 -0.00656 -0.01156 0.01136 0.01220 -0.00122 0.01138 -0.00425 0.01207 0.02490 -0.00790 0.00211 -0.01975 -0.00223 -0.01448 -0.01084 0.00056 0.00240 0.00094 -0.02444 -0.00853 0.01108 -0.01781 -0.00786 0.01494 0.02041 -0.00762 0.00212 0.04107 -0.00989 -0.00103 0.00505 0.00367 -0.01438 -0.00881 0.01173 -0.01912 -0.01131 0.01857 -0.00926 -0.00074 0.00092 -0.00888 -0.05354 -0.00599 -0.00804 0.24568 0.00044 0.00004 0.00032 0.00028 0.00025 1.88589 0.00874 0.00014 0.00029 -0.00010 -0.00012 0.00020 0.41710 -0.08565 0.09257 0.26979 0.00032 0.05337 0.13813 0.10607 0.03730 0.02942 -0.07445 -0.03186 -0.02519 0.03963 -0.03320 -0.00899 0.11285 -0.00696 0.13158 -0.10973 -0.02116 -0.07367 0.01041 0.02319 -0.04195 -0.04907 0.01063 -0.04059 0.00155 -0.03027 -0.06869 0.03446 -0.00513 0.07293 -0.00773 0.06545 0.03545 -0.01267 -0.03548 -0.01434 0.12707 0.02283 -0.02445 0.15785 0.01545 -0.06224 -0.06224 0.04684 0.03481 -0.12268 0.03923 -0.01160 -0.03683 -0.02275 0.11661 0.07117 -0.11397 0.15262 0.08244 -0.12065 0.07994 0.01135 -0.00073 0.06406 0.41355 0.04084 0.03128 -2.12918 -0.01251 -0.00870 0.00366 0.00969 0.00863 -0.45608 -0.00675 0.00094 0.00009 -0.00062 0.00026 -0.00057 0.33798 -0.08520 0.10170 0.30656 -0.00109 0.05453 0.17826 0.14285 0.03744 0.03404 -0.09357 -0.03914 -0.03645 0.03842 -0.03727 0.00038 0.09932 0.02444 0.68726 -0.63214 0.01310 -0.17282 0.16201 0.24070 -0.04374 0.03439 -0.02495 -0.04005 0.15916 -0.20298 -0.39349 0.00543 -0.04823 0.13567 0.23467 -0.02466 0.12646 0.09830 0.22306 0.11618 -0.19607 0.12947 -0.29559 -0.69965 0.17905 -0.06359 -0.37092 -0.18340 -0.69564 -0.63892 -0.47006 0.15292 -0.07830 0.03023 -0.30528 -0.12531 0.64039 -0.29808 -0.03232 -0.00691 -0.16017 -0.07689 -0.07466 -0.08630 -0.47542 0.08734 0.47403 3.72244 -0.01914 -0.02404 -0.04503 -0.02503 0.02473 0.50319 -0.00066 0.00025 -0.00020 0.00009 0.00006 -0.00005 -0.07598 -0.02550 -0.02520 0.00323 0.15760 0.02716 0.21371 0.00893 -0.15183 0.25107 -0.07925 0.27792 0.03507 0.08830 0.04511 0.06117 0.12638 -0.37214 0.14331 0.29760 -0.08237 0.03220 -0.08272 -0.05895 0.03791 0.16037 -0.01140 -0.03752 -0.07028 0.04674 0.09734 0.05215 -0.03295 -0.06365 0.07628 -0.04651 0.04470 -0.08669 -0.05816 -0.08509 -0.06586 0.06764 -0.02934 -0.26218 0.01248 -0.17016 0.08303 -0.12902 -0.06957 -0.25934 0.15293 -0.62609 0.27379 0.19550 0.07367 0.12802 -0.19670 -0.00582 -0.07664 0.02439 0.15571 0.02551 -0.02973 -0.13286 0.06852 0.05318 -0.07583 0.03358 -0.00254 0.00801 -0.01031 -0.00179 -0.00336 0.00361 0.00160 -0.00003 -0.00026 -0.00004 0.00008 -0.00005 0.17881 -0.02899 -0.03458 -0.05173 0.09059 0.01396 -0.16985 -0.14368 -0.23661 0.07967 0.11238 0.20990 0.07790 -0.07700 0.11885 -0.00900 -0.32365 0.11282 0.39910 -0.08901 -0.09589 -0.05255 -0.03434 0.06832 -0.02169 0.00027 0.03114 -0.00377 -0.03930 0.01089 -0.11335 0.11296 0.04555 0.01126 0.00475 -0.02015 0.02454 0.01987 -0.17290 -0.02701 0.29050 0.04525 -0.15062 0.29280 -0.18111 -0.02057 0.09148 -0.05862 -0.10072 0.44601 -0.39744 -0.37680 0.01938 -0.16194 -0.05637 0.10606 0.08610 -0.10077 -0.09649 0.03768 0.09057 -0.03137 0.00163 -0.06798 0.05615 0.00451 0.06147 -0.01874 0.00508 0.00520 -0.00449 -0.00386 0.00168 -0.00621 -0.00062 0.00018 -0.00005 0.00002 -0.00004 0.00003 -0.06698 0.00577 -0.00697 0.01034 0.06366 0.14770 -0.03796 0.17808 -0.06577 0.05316 -0.08542 0.15796 0.00277 0.18426 0.11264 0.00556 0.17891 0.56054 0.01044 0.21085 -0.08696 0.00681 -0.05366 -0.12692 0.03879 0.04328 -0.05870 0.11440 0.03114 0.11871 -0.01905 0.01884 0.03691 -0.01223 -0.06387 0.01793 0.05229 0.05958 0.01477 0.12820 -0.03348 -0.11900 0.19584 -0.04246 -0.08535 -0.14477 -0.07121 0.08742 -0.12771 -0.22781 0.12335 -0.15272 -0.00815 -0.76044 -0.03070 -0.07099 0.05634 -0.12394 -0.09991 0.03635 -0.02857 -0.07007 0.07535 0.04318 -0.00832 0.03268 0.00906 0.01786 -0.00315 0.00153 -0.00562 0.00342 -0.00002 0.00387 0.00100 -0.00068 0.00114 -0.00009 -0.00036 0.00064 -0.01256 -0.00423 -0.00595 0.00577 0.03577 0.00938 0.06126 0.00171 -0.03926 0.07838 -0.03275 0.07730 0.01113 0.02716 0.00956 0.01257 0.06835 -0.19639 0.18932 0.31002 -0.16862 -0.00969 -0.23154 -0.08402 0.08591 0.24224 0.01473 -0.01684 -0.16073 0.03561 0.11601 -0.00793 -0.01030 -0.01480 0.07096 0.05519 -0.11882 -0.15067 -0.11728 0.00674 -0.21121 -0.00264 0.19108 0.21958 -0.07148 -0.09528 0.25084 0.03607 0.14863 0.60384 -0.19163 1.20170 -0.93861 -0.31836 -0.43413 -0.50104 0.17859 0.21015 0.45080 0.17833 -0.32983 0.00518 0.28409 0.47283 -0.37420 -0.39256 -0.17152 -0.62274 -0.00599 -0.03316 0.06908 0.02075 0.00603 -0.05881 -0.00195 -0.00111 -0.00033 -0.00002 -0.00036 0.00003 0.01952 -0.00176 -0.01011 -0.01619 0.01995 0.00422 -0.04501 -0.04114 -0.07178 0.01759 0.04247 0.06902 0.03031 -0.03883 0.05445 -0.00408 -0.17126 0.05211 0.40492 -0.08179 -0.21306 -0.02276 -0.03606 0.06939 -0.01773 0.00429 -0.02484 -0.03508 -0.02494 0.04286 -0.11593 0.05637 -0.02926 0.09536 -0.01375 0.07204 -0.00127 -0.02204 -0.01588 0.09112 -0.00735 0.00114 0.04132 0.03996 -0.01634 -0.24909 -0.04793 0.08940 0.12290 -1.06227 0.83815 0.76762 -0.26267 0.56075 -0.18432 -0.36833 -0.05642 0.16201 0.29001 -0.03566 -0.25617 0.18073 0.01035 0.26890 -0.36651 -0.14756 -0.23329 0.81011 0.02622 -0.00934 0.02976 0.00863 -0.01049 0.09488 0.00080 -0.00008 0.00064 -0.00001 0.00028 0.00003 -0.00710 -0.00083 0.00200 0.00139 0.01260 0.03520 -0.00972 0.04957 -0.01069 0.01030 -0.02804 0.05423 -0.00129 0.07419 0.04397 0.00520 0.09639 0.27918 0.04367 0.17187 -0.13198 0.03069 -0.08902 -0.11980 0.08101 0.04617 -0.05996 0.15453 -0.03022 0.15931 0.00140 0.05299 0.06536 -0.06886 -0.14164 -0.15103 0.00644 0.20092 -0.09733 0.26143 -0.02535 -0.08948 0.02623 -0.05708 -0.09589 -0.02010 -0.00239 -0.02172 0.06992 0.45597 -0.28675 0.29508 -0.17524 1.68038 -0.04178 0.09628 -0.36208 0.45848 0.38944 -0.08447 0.10475 0.28692 -0.22371 -0.08019 0.02794 -0.22692 0.03689 -0.34439 -0.00879 -0.01037 0.02724 -0.01239 0.00370 -0.04235 0.00001 0.60029 -0.00852 -0.00067 0.00007 0.00005 -0.05700 -0.03720 0.01226 0.06015 0.07036 0.04301 0.01741 -0.00190 -0.00577 0.00801 0.01285 -0.00689 0.00116 -0.01796 -0.01308 0.00647 0.00146 0.00546 0.02928 -0.01000 0.01051 0.03086 0.05002 0.03323 -0.01218 -0.04302 0.00122 0.01156 0.00031 -0.01002 -0.01283 -0.00844 -0.01079 -0.01931 -0.00323 -0.00105 -0.01367 0.00872 0.03077 -0.00401 0.00814 0.00369 -0.00718 0.05061 0.04004 0.04165 -0.03447 0.00661 -0.01239 0.04171 0.05741 -0.02645 -0.01979 -0.01347 -0.03414 -0.01660 -0.07199 0.03502 0.04622 0.04119 0.01615 0.00182 0.02150 0.00201 -0.02295 -0.03067 -0.00347 0.00513 -1.10348 0.06756 -1.33110 0.16852 0.28484 0.00053 0.00002 0.43395 -0.00602 -0.00038 0.00012 0.00010 -0.07143 -0.04696 0.01556 0.07652 0.08981 0.05521 0.02290 -0.00183 -0.00707 0.01056 0.01618 -0.00857 0.00145 -0.02281 -0.01669 0.00853 0.00188 0.00716 0.03888 -0.01446 0.01378 0.04025 0.06364 0.04274 -0.01451 -0.05649 0.00099 0.01610 -0.00129 -0.01440 -0.01582 -0.01094 -0.01381 -0.02518 -0.00507 -0.00168 -0.01896 0.01245 0.04078 -0.00513 0.01110 0.00706 -0.01061 0.07221 0.05454 0.06195 -0.05009 0.01009 -0.01718 0.06471 0.09972 -0.04401 -0.02917 -0.02299 -0.05822 -0.02863 -0.11969 0.05887 0.07525 0.07073 0.02712 0.00211 0.03960 0.00269 -0.04409 -0.05729 -0.01590 0.01097 1.20708 -0.07417 1.47204 -0.18653 -0.31577 -0.00119 0.00008 0.02023 -0.00093 -0.00066 -0.00076 -0.00072 0.20149 0.13161 -0.04610 -0.22416 -0.25912 -0.16786 -0.08166 -0.00738 0.00608 -0.03143 -0.03845 0.02995 -0.00037 0.05950 0.05150 -0.02507 -0.01936 -0.02014 -0.10948 0.06980 -0.02544 -0.09924 -0.08437 -0.08562 0.00064 0.13975 0.02117 -0.07682 0.06604 0.07838 0.00673 0.02694 0.00610 0.06444 0.03411 0.01990 0.07982 -0.07249 -0.10852 -0.00140 -0.05529 -0.07628 0.06409 -0.40024 -0.23137 -0.36719 0.29112 -0.07327 0.05873 -0.52456 -1.02214 0.42210 0.31829 0.21357 0.63101 0.32535 1.26558 -0.62745 -0.72690 -0.77665 -0.30300 -0.01562 -0.52254 -0.03433 0.59859 0.82634 0.54502 0.08921 -0.30334 -0.00186 -0.46105 0.05912 0.08873 0.00376 0.00163 -0.02173 0.00599 0.00529 0.00244 0.00242 0.04029 0.08431 -0.01706 -0.14596 -0.24351 -0.13293 -0.02851 0.02650 0.14858 -0.11304 -0.09186 -0.07313 -0.03962 0.09061 0.03163 -0.08308 0.04241 -0.05282 -0.46428 -0.23353 -0.45543 -1.18966 -2.22030 -1.10557 0.66792 1.70596 -0.43124 0.39097 -0.87358 -0.49410 0.56513 -0.00881 1.10562 0.26088 0.34502 -0.35548 0.37252 0.34319 -0.88278 0.62996 -0.08947 0.38471 -0.14163 0.55833 0.78073 -0.04910 -0.94615 0.11247 0.51540 1.64954 1.19588 -0.88477 -2.93003 -0.03560 -2.32582 -1.21687 -3.95699 2.07398 1.97366 1.86588 0.89805 0.31009 1.60659 0.60859 -1.43032 -2.66347 -2.83596 -1.41608 0.28416 -0.01116 0.93787 -0.10880 -0.26589 -0.14027 0.00017 0.00120 -0.00033 -0.00017 0.00004 0.00010 0.13198 -0.10449 -0.01788 -0.00218 0.09116 -0.12084 -0.14642 -0.27592 0.00324 -0.08674 0.03459 -0.08764 -0.00757 -0.21573 -0.18535 0.07946 0.10726 0.07834 -0.17065 0.11420 -0.11989 0.07602 -0.00284 -0.01773 0.14377 0.03661 -0.09916 0.25163 -0.02740 0.08786 -0.08827 0.01363 -0.31823 -0.12521 0.11168 -0.00830 -0.13314 -0.08065 0.01659 -0.14405 0.04964 0.03240 0.41485 -0.30232 0.25009 -0.71937 0.13521 -0.09671 -0.51727 0.30610 -0.02785 0.05611 -0.02965 0.06378 -0.18234 -0.03023 0.01851 0.03203 0.29521 0.10115 0.04249 -0.02665 0.02943 -0.10826 -0.05671 -0.05838 0.26849 -0.23634 0.01097 0.00370 0.00041 0.00108 0.01138 -0.01750 -0.00024 -0.00039 -0.00047 0.00003 0.00005 -0.00007 -0.04111 0.01224 -0.08761 -0.12182 0.09058 0.02312 -0.07657 -0.04529 -0.14955 0.15725 -0.06697 0.07422 -0.03058 0.14956 -0.05480 -0.00326 0.38733 -0.04885 -0.23964 -0.44007 0.06313 -0.04313 0.06085 0.15440 0.06974 -0.05515 -0.01007 -0.07842 -0.04229 -0.24015 -0.23508 -0.09541 0.01919 0.02847 -0.08704 0.14188 -0.08417 0.06195 0.05591 0.19539 -0.01078 0.20971 -0.29191 0.50785 -0.30335 -0.56821 0.11792 -0.07010 -0.02386 -0.17074 0.10890 0.05942 -0.01357 0.10693 -0.06293 0.02183 -0.01309 -0.02608 -0.01549 0.01670 0.00382 0.00212 -0.01232 0.00315 -0.10823 0.07290 -0.00668 0.25936 0.00975 0.01005 -0.00763 -0.00240 -0.00286 0.02240 0.00012 0.00052 -0.00008 0.00003 -0.00004 0.00003 0.07759 0.01948 0.00447 0.03326 0.01586 0.23579 -0.27333 0.01887 -0.03254 -0.03157 0.22704 -0.22070 -0.01236 0.13870 0.08244 -0.12847 0.00802 -0.10687 -0.01008 0.04562 0.05218 0.19400 0.23483 0.07223 0.06771 0.21324 -0.07172 -0.18465 -0.10277 -0.11265 0.14675 -0.17535 -0.04667 -0.43540 0.04234 -0.04958 0.56442 -0.06546 -0.27167 0.14135 -0.19082 -0.07035 0.03139 -0.26509 -0.28248 -0.15250 0.11348 -0.02504 0.14170 0.09124 -0.08575 -0.03219 -0.32550 -0.10334 -0.05512 -0.06356 -0.35106 0.20341 0.12731 -0.00771 0.03795 -0.00119 0.04313 0.06900 0.17097 0.19311 0.09404 -0.10165 0.00320 0.00102 0.00409 0.00213 -0.00341 -0.01324 0.00124 -0.00060 0.00547 -0.00310 -0.00125 -0.00172 -0.05413 0.00782 0.00406 0.01567 -0.01168 0.01795 0.05605 0.01456 0.06616 0.00163 -0.02377 -0.04482 -0.01430 -0.03619 -0.05349 0.00350 0.05855 0.01746 -0.26500 0.13583 -1.56210 0.31929 -0.24882 0.27668 0.76427 -0.24466 -0.17462 0.41598 -0.23551 0.16590 -0.21188 -0.25990 -0.84156 -1.29958 -0.73418 -0.18060 -1.37749 0.43052 -1.05924 0.01585 0.70507 -0.72645 -0.92990 0.08400 0.26312 0.45833 0.92753 0.50633 4.11851 -0.57549 0.69798 -1.41460 -0.61332 -0.15928 -0.47707 -0.07979 0.97097 -0.11408 -0.16665 -0.57031 -0.36927 0.60926 -0.08475 2.26242 0.48700 -1.35955 0.14274 -0.67426 -0.07672 -0.25483 0.05059 -0.03969 0.07697 -0.09995 -0.00068 -0.00084 0.00230 -0.00024 -0.00015 -0.00060 -0.00130 0.00466 -0.00853 0.00027 -0.01179 0.00698 -0.01673 -0.00294 -0.02968 0.03043 -0.00524 0.01403 -0.01362 0.04646 0.01112 -0.00422 0.07278 0.07566 -0.35257 -0.75867 -0.28953 -0.17623 -0.19407 0.48076 0.26270 -0.02029 -0.24511 -0.02392 0.42460 -0.32271 -0.04285 0.02020 -0.33341 0.08742 0.04495 -0.32911 0.59936 0.21279 -0.11811 -1.05179 0.92327 0.59148 -0.17540 -1.52971 1.05928 1.07155 0.19354 -0.58625 0.94476 -0.00532 -0.07378 -1.20929 -0.29066 -1.58924 -0.47330 -0.06927 0.49992 -0.33453 -0.16180 -0.00771 0.21951 -0.44499 -0.00942 0.56912 0.07300 -0.48419 -0.31869 0.37802 -0.02999 -0.08342 0.06296 -0.02503 -0.00648 0.05480 0.00192 -0.00477 0.00100 0.00483 -0.00028 -0.00034 -0.05869 -0.00032 0.00203 0.00170 0.01226 0.07573 -0.02993 0.03754 0.03003 0.00038 0.05536 -0.06672 -0.00072 0.06279 0.04619 -0.09330 0.02838 -0.02560 0.05466 0.02682 -0.44859 -0.57590 -0.69854 -0.45510 -0.10265 0.22015 0.06622 -0.72709 -0.91793 -0.20595 0.88801 -0.13856 -0.66544 -0.27109 -1.33023 0.91191 0.83910 -0.90441 1.91720 -1.08644 0.24591 1.80430 3.82740 2.29527 0.11629 0.27113 2.60502 0.60357 3.23318 0.86401 1.85026 -1.04628 0.03976 -0.22786 -0.08393 -0.01884 0.16722 -1.32804 -1.12997 0.06626 -0.18325 0.14170 -0.26185 0.13470 -1.17329 -2.19218 -3.93176 -1.92687 -0.01901 0.03771 0.18413 -0.00286 -0.22960 -0.17309 0.00000 0.00066 -0.00011 0.60047 -0.00149 -0.00124 -0.00832 -0.09463 -0.00273 0.00668 0.02525 -0.06381 -0.03303 0.01710 0.01763 -0.00612 -0.01243 0.00306 -0.00157 0.00429 0.00030 0.00361 0.00337 0.01329 -0.00200 -0.00657 0.02012 0.03117 -0.04305 0.01440 -0.03383 0.02981 0.01707 -0.01527 -0.00797 -0.00740 0.01498 -0.00183 0.01039 0.00222 0.01108 -0.00688 0.00598 -0.00677 -0.02011 -0.00099 -0.01246 0.03752 0.01194 -0.01761 -0.07790 0.01309 -0.04141 0.00360 0.03754 0.00242 0.02774 -0.01653 0.04492 0.00739 -0.02120 0.00613 0.08520 0.02584 0.05764 0.01770 -0.00076 -0.01051 0.02290 0.00315 -0.00499 -0.01096 0.06581 -0.00621 -0.62354 0.68191 0.25359 0.13704 -1.47227 0.00132 0.00002 0.00058 -0.00002 0.43388 -0.00099 -0.00081 -0.01023 -0.11869 -0.00346 0.00848 0.03199 -0.08121 -0.04229 0.02195 0.02269 -0.00789 -0.01610 0.00395 -0.00204 0.00556 0.00035 0.00505 0.00430 0.01742 -0.00188 -0.00906 0.02703 0.04135 -0.05378 0.01823 -0.04086 0.03842 0.02126 -0.01934 -0.01059 -0.00983 0.01980 -0.00259 0.01342 0.00209 0.01462 -0.00985 0.00697 -0.00841 -0.02849 -0.00094 -0.01661 0.05104 0.01521 -0.02512 -0.10978 0.01935 -0.05932 0.00548 0.05305 0.00534 0.04839 -0.02750 0.07426 0.01253 -0.03626 0.01016 0.14401 0.04158 0.09518 0.02850 -0.00185 -0.01733 0.03579 0.00365 -0.01222 -0.02363 0.12450 -0.00948 0.68060 -0.74953 -0.27978 -0.15135 1.62931 -0.00243 -0.00012 -0.00054 -0.00061 0.02100 -0.00030 -0.00033 0.02319 0.32244 0.01043 -0.02324 -0.09002 0.23643 0.12396 -0.06188 -0.06642 0.02113 0.04985 -0.01474 0.00603 -0.01723 -0.00064 -0.02521 -0.01119 -0.05187 -0.01774 0.03354 -0.10254 -0.13058 0.04358 -0.02812 -0.00862 -0.08516 -0.01660 0.02470 0.02260 0.02212 -0.05159 0.01299 -0.03381 0.01912 -0.03856 0.04630 0.00945 0.01613 0.15602 -0.00394 0.05363 -0.19225 -0.00702 0.14486 0.51016 -0.10893 0.31353 -0.03406 -0.27517 -0.03066 -0.43920 0.23331 -0.83996 -0.13055 0.41257 -0.09348 -1.51834 -0.36642 -0.92207 -0.24780 0.04239 0.17662 -0.30540 0.00331 0.23154 0.39518 -1.86035 0.07256 -0.18409 0.24145 0.08330 0.04783 -0.52071 0.00290 -0.00024 0.00460 0.00165 -0.02766 0.00316 0.00325 0.04010 0.21019 -0.00152 -0.03349 -0.08182 0.16810 0.11912 -0.10318 -0.06920 0.05599 0.04168 0.02023 0.00847 -0.01000 0.00472 0.06540 -0.05063 -0.10734 0.14548 0.18491 -0.30469 -0.64321 2.25948 -0.60223 2.17502 -0.93585 -0.89162 0.78145 0.33571 0.23547 -0.45805 -0.06495 -0.05685 -0.32930 -0.01377 -0.09149 -0.73935 0.18667 -1.06364 0.17657 0.14767 -0.56211 -1.61136 -0.52091 0.63547 0.06620 -0.64907 0.02824 0.64730 -0.94155 -0.54594 -0.09242 3.97667 0.17254 -1.38930 0.25980 4.45993 0.97816 2.33800 0.65469 -0.16603 -0.66079 0.90079 -0.23087 -0.57056 -0.84866 7.16525 0.39313 0.22517 -0.37723 -0.20612 -0.09421 1.14352 0.05297 -0.00008 0.00001 -0.00018 0.00003 0.00000 0.00001 0.02220 -0.02186 -0.02358 -0.09857 -0.14903 0.05513 -0.10610 0.13556 0.12908 0.13712 0.06711 -0.00029 -0.00039 0.27520 0.17220 0.10777 -0.10045 -0.18787 0.01761 0.04189 -0.08545 0.15045 0.08039 0.16952 -0.09364 0.07251 0.08866 0.17895 0.09418 0.09130 -0.16207 0.01665 -0.09478 -0.02750 -0.19418 0.07345 -0.10914 0.04626 0.04573 -0.03800 0.11910 0.13416 0.17810 0.08047 0.44571 -0.42212 -0.81232 0.00605 0.30613 0.29752 0.09308 -0.05981 0.02556 0.02983 0.14791 0.08572 0.13033 -0.19284 -0.17281 -0.09408 -0.04235 -0.00900 -0.14042 -0.08382 0.05542 0.12319 0.03085 0.09828 0.00439 0.00588 -0.00692 0.00146 -0.00212 0.00817 0.00000 0.00000 0.00002 -0.00002 -0.00007 0.00006 -0.00203 0.00530 -0.16904 0.04526 -0.00728 0.00085 -0.02200 -0.01231 -0.09021 0.16159 -0.20110 -0.17424 0.00868 0.15582 -0.26768 -0.04716 -0.17203 0.04084 -0.01833 -0.08457 -0.02385 0.07115 0.07490 -0.22792 -0.10854 -0.00893 0.07622 -0.01745 -0.28296 0.16003 -0.20919 -0.00952 0.03637 0.00236 -0.00672 -0.05273 -0.02863 0.00671 -0.13891 -0.08469 -0.07793 -0.18423 0.15181 0.04641 0.04911 0.14310 -0.04947 -1.07068 0.12991 -0.07666 0.07196 0.12468 -0.04420 -0.17239 -0.13996 0.23179 0.00065 0.00198 0.01383 0.01681 -0.04132 -0.07299 -0.01176 -0.01679 0.07351 -0.04325 0.00049 -0.01000 0.00029 -0.00148 0.00073 0.00077 0.00151 -0.00123 0.00005 0.00001 0.00009 0.00009 0.00004 0.00006 -0.00730 -0.02737 -0.00025 0.02972 0.03698 0.14633 -0.03834 -0.23661 0.20227 0.02480 -0.07039 0.03232 -0.01081 -0.01512 -0.06918 0.37454 0.00086 0.06096 -0.02108 0.02387 -0.06055 -0.16826 0.21747 -0.03919 0.04916 0.38970 0.10760 0.06921 0.00382 -0.08275 0.02098 0.02942 0.07101 0.20884 -0.24621 0.30900 0.06427 -0.22265 0.23968 -0.27364 0.10310 -0.28375 -0.21036 -0.20935 -0.51894 0.06823 -0.14683 -0.04525 0.13761 0.13039 0.17710 -0.01903 -0.19179 0.07524 -0.06833 -0.07151 -0.19776 -0.09916 -0.31829 -0.07945 -0.03622 0.08880 -0.12494 0.07715 -0.06396 -0.17013 0.11071 -0.05855 -0.00904 0.00237 0.00261 0.00079 -0.00422 -0.00399 -0.00083 0.00541 0.00148 -0.00149 -0.00171 -0.00230 0.02275 0.00217 0.00375 0.01848 0.00714 -0.00446 -0.01052 0.01734 0.00448 0.01679 0.00872 -0.00870 -0.00390 0.03996 0.01000 0.06101 -0.00962 -0.04584 -0.16366 0.07703 -0.67419 1.26962 0.73731 1.02342 -0.11122 0.11153 0.93648 0.45032 1.06961 0.55597 -1.28217 0.47046 -1.06995 0.38634 0.79168 -0.44119 -1.14061 0.47985 -0.41316 0.46393 -0.36646 -0.34823 -1.60977 -1.18511 -1.40339 1.24372 0.22584 -0.35142 -3.60733 -1.50214 -1.46195 0.79829 -0.70152 0.21807 0.31328 0.14578 0.89953 0.83357 0.74824 -0.39748 -0.09403 0.39051 -0.37740 0.86096 1.06367 1.08054 1.24773 0.99984 -0.09482 -0.13018 -0.20615 0.00213 0.03537 0.08036 -0.00033 -0.00024 0.00007 0.00061 0.00447 -0.00421 0.00533 0.00130 0.01384 -0.02498 0.00979 -0.00706 -0.01039 -0.02119 -0.01405 0.01919 -0.02953 -0.01645 0.02022 -0.01252 -0.05619 -0.00094 -0.04368 -0.16054 0.08214 -0.32674 -0.25067 0.67649 0.50382 -1.58375 -0.70213 0.16141 0.26106 -0.19475 -1.21996 0.55958 -0.52300 -0.56702 0.06896 0.37496 -0.14503 0.72450 -0.23291 -0.71112 0.11419 2.01515 0.60945 -0.40441 1.47334 0.26379 -0.57901 0.24285 -0.15498 3.13378 -1.17985 -0.09643 -0.25766 -0.37447 0.43714 2.20206 0.15729 1.02579 -0.61470 0.13560 -0.03940 -0.16692 0.82627 0.67888 -0.09145 -0.63369 1.41099 -1.23831 -0.14179 0.62547 -0.00757 0.02610 -0.01942 -0.25687 -0.04811 0.03099 -0.00093 -0.00007 -0.00061 -0.00033 0.00014 0.00002 0.01351 0.01623 0.00197 0.00011 -0.00367 0.00841 -0.03622 -0.06919 0.04733 -0.02559 -0.02394 -0.00799 -0.01377 0.00183 -0.02939 0.12681 0.02020 0.01880 -0.05396 0.07713 0.43428 -0.01224 0.98135 -0.08369 0.33676 1.83390 0.56794 1.04398 -0.07402 -0.78121 0.30387 0.08445 2.54116 1.40483 1.29024 -0.60285 1.14041 0.24920 -1.30914 1.01480 -0.80820 1.80058 -0.52048 0.71262 1.94640 0.57995 -1.10852 -0.35019 -3.94690 -0.72293 -1.34575 1.04537 0.08573 -0.03052 0.11362 0.15584 0.78921 1.00552 1.46547 0.77551 0.32425 -0.48078 0.80637 -0.87184 0.07617 1.14586 -0.30624 0.84648 0.04094 0.00763 -0.00894 -0.00411 0.01818 0.08675 0.00001 0.00851 0.60028 0.00011 0.00002 0.00002 -0.05409 0.00365 0.03725 0.07742 -0.07480 -0.01196 -0.00497 -0.00293 -0.00042 0.00784 -0.00936 -0.00052 -0.00208 0.00415 0.00021 0.00368 -0.00347 0.00053 0.02585 -0.03939 -0.05559 0.02347 -0.02244 0.01238 0.03546 0.01533 -0.02449 -0.00963 -0.01471 -0.00155 -0.00412 0.00929 0.01350 0.00908 0.00303 -0.00044 0.00917 -0.00902 -0.03241 -0.00776 0.02470 0.00572 -0.00139 -0.00580 -0.02551 -0.03239 0.02520 -0.00345 -0.01936 0.04721 0.03951 0.04654 0.07625 -0.02742 0.08530 0.02622 -0.03275 0.02132 -0.00757 -0.00245 -0.00451 -0.00731 -0.00793 -0.00572 -0.00086 0.01637 0.00026 0.01323 -1.07038 -1.11734 0.82337 -0.16350 0.06285 -0.00083 0.00000 0.00630 0.43402 0.00013 0.00002 0.00004 -0.06764 0.00465 0.04738 0.09856 -0.09543 -0.01523 -0.00596 -0.00335 0.00016 0.00996 -0.01243 -0.00108 -0.00285 0.00551 0.00019 0.00508 -0.00446 0.00068 0.03532 -0.05183 -0.07132 0.03115 -0.02868 0.01650 0.04687 0.01975 -0.03174 -0.01284 -0.01963 -0.00169 -0.00435 0.01215 0.01973 0.01216 0.00344 -0.00150 0.01224 -0.01219 -0.04775 -0.01084 0.03514 0.00707 -0.00105 -0.00817 -0.03746 -0.04153 0.03509 -0.00396 -0.02943 0.07392 0.07153 0.07962 0.12567 -0.04282 0.13604 0.03951 -0.05563 0.03053 -0.01646 -0.00199 -0.00765 -0.01479 -0.01302 -0.01692 -0.00204 0.03364 0.00055 0.02503 1.17037 1.23006 -0.91001 0.18092 -0.06979 0.00129 0.00018 -0.00051 0.01939 -0.00057 -0.00003 -0.00027 0.18644 -0.01230 -0.13694 -0.28751 0.27532 0.04233 0.00642 -0.00098 -0.00855 -0.03534 0.04763 0.00308 0.01105 -0.02598 0.00058 -0.02292 -0.00273 0.00145 -0.12886 0.13716 0.13427 -0.08974 0.04315 -0.04983 -0.12649 -0.04428 0.06162 0.03261 0.05805 -0.00305 -0.01014 -0.02964 -0.09798 -0.02349 0.00151 0.03121 -0.03629 0.03762 0.28440 0.04506 -0.18240 -0.00152 -0.01842 0.01419 0.23757 0.07758 -0.15734 -0.01026 0.23356 -0.59370 -0.77374 -0.80420 -1.24689 0.34874 -1.24924 -0.33569 0.55883 -0.16863 0.30069 -0.00863 0.07084 0.24129 0.15162 0.41842 -0.03907 -0.59627 -0.06452 -0.12880 -0.27904 -0.34277 0.25875 -0.06021 0.03041 -0.00567 0.00082 0.00716 -0.01916 0.00024 0.00037 0.00089 0.09576 -0.02052 -0.10077 -0.21337 0.26351 0.03027 0.04089 0.03098 -0.06499 0.03114 0.01198 0.09754 0.02150 0.01962 0.00797 0.02540 0.10334 -0.04402 -0.11367 0.76978 2.24228 -0.67485 1.22696 -0.26271 -1.11890 -0.10935 1.07763 0.44903 0.52089 0.02600 -0.19040 -0.16791 -0.06996 -0.25906 0.40943 -0.21008 -0.06391 0.23167 -0.12079 0.54147 -0.51213 -0.33696 -0.13656 0.10897 -0.69656 0.52727 -0.78220 -0.03075 -2.98386 1.31658 -0.07216 2.01972 4.00882 -0.42512 4.01393 1.54068 -0.75528 0.33151 -1.06644 -0.48528 -0.00085 -0.64708 -0.77985 -1.94379 0.82554 2.76104 1.84153 -0.16499 0.28940 0.55267 -0.61819 0.12141 0.03745 -0.05317 0.00011 0.00006 -0.00041 0.00013 0.00012 -0.00002 -0.05489 -0.02610 0.02003 0.05547 0.10358 0.01452 0.32867 0.04324 0.10252 0.05765 0.09899 -0.04426 0.01269 0.05749 0.13182 -0.00530 -0.34963 0.07447 -0.20286 -0.23601 0.08587 -0.13283 -0.02366 -0.01300 -0.02896 -0.04789 0.21028 0.21643 0.24537 0.07309 -0.22592 -0.11218 0.21026 -0.01542 -0.18433 0.13656 -0.02896 -0.10387 -0.36219 0.06707 -0.15376 0.23416 0.12349 -0.30792 -0.09849 -0.38783 0.46980 0.01761 0.22606 0.16822 0.17254 -0.07030 -0.14600 0.01753 -0.20387 -0.07008 -0.14135 -0.09839 -0.03479 0.20187 0.02870 -0.09877 0.26786 0.01893 0.04876 -0.04425 -0.13774 -0.11640 -0.00391 0.00226 0.00708 -0.00482 -0.00501 -0.00894 -0.00036 -0.00007 -0.00121 0.00007 -0.00001 -0.00007 -0.14100 0.03293 -0.02815 -0.09332 0.02130 0.02991 0.09231 0.16841 0.24346 -0.17418 -0.07353 -0.21900 -0.06043 -0.01207 -0.09647 -0.01292 0.13366 -0.01661 0.34767 0.05717 -0.02705 -0.22595 0.04417 -0.00207 -0.15754 0.05226 0.09162 -0.02615 0.00147 0.06632 -0.07153 0.19960 -0.24191 0.03216 0.13522 -0.04246 0.23766 -0.02255 -0.54059 -0.16053 0.65878 0.03538 0.02634 0.19554 -0.10569 -0.27263 0.10179 0.03791 -0.02678 -0.24382 0.22521 0.06518 -0.15661 0.12912 -0.32115 -0.13432 0.02797 -0.09162 0.02085 0.02761 -0.00785 -0.01583 -0.00323 -0.09822 -0.10343 0.03844 -0.09891 0.37287 -0.00022 -0.00195 0.00399 -0.00197 -0.00524 0.03399 0.00008 0.00019 -0.00003 0.00012 0.00004 0.00003 -0.00980 -0.00454 0.01091 0.04874 0.04244 0.17618 -0.13539 0.27657 -0.02000 -0.13481 -0.21262 0.18212 0.02333 -0.16533 -0.03836 0.02888 -0.21198 -0.06905 -0.16070 -0.13655 0.04522 -0.07497 0.19887 0.05147 0.00068 0.12030 0.07160 -0.20484 -0.25152 -0.18995 0.42534 0.15050 -0.24555 0.25434 -0.24817 -0.14615 -0.38165 0.30943 -0.18077 0.16096 -0.01951 0.04690 0.05237 -0.20554 0.02548 -0.23499 0.09295 -0.02085 -0.02632 0.06839 0.00963 -0.01076 -0.07928 -0.15322 -0.14535 -0.00608 -0.00642 0.10058 0.07294 -0.04690 0.03459 0.02351 -0.35825 -0.18676 -0.08394 -0.06376 -0.06039 -0.10081 -0.00693 0.00222 -0.00012 0.00023 -0.00276 -0.00732 -0.00003 -0.00227 0.00226 0.00048 0.00044 -0.00097 0.00248 0.00070 0.00721 0.00248 0.00410 -0.01204 0.06791 -0.00624 0.02502 -0.00234 0.04086 -0.02131 -0.00215 0.01034 0.03319 -0.03195 -0.10531 -0.03810 -0.44196 -0.51104 -0.52673 -0.40478 -0.39635 -0.09410 0.35295 0.87873 -0.02204 0.46552 -0.14328 -0.10844 -0.31474 0.04326 -0.76269 -0.54652 -0.30254 -0.35073 0.85943 0.71361 0.73848 0.36160 0.51588 0.56971 1.30083 0.64388 -0.41364 1.02936 0.20635 0.18840 -0.48821 -0.52694 0.05875 -0.89879 -0.03143 0.66979 -0.06708 0.29284 -0.19399 0.49964 0.40928 -0.38067 0.31177 0.63321 -0.97401 0.22936 -0.26078 -1.21124 -0.79551 -0.00459 0.00130 -0.05458 0.10563 -0.05672 -0.04587 -0.00354 -0.00050 -0.00142 0.00196 -0.00072 -0.00040 -0.00020 0.01190 0.00290 -0.00660 -0.01419 0.00527 0.00584 -0.00468 0.02405 0.04999 -0.04612 0.00037 -0.06914 -0.01094 -0.03469 -0.02284 -0.03573 0.01186 0.00147 0.72936 -0.10935 -0.54462 -0.53996 -0.35080 -0.04826 0.28770 0.73295 0.31477 0.39121 -0.42131 -0.30404 -0.45340 -0.34106 -0.63933 -0.93014 -0.03185 0.03328 -0.99324 0.17736 0.07762 0.63391 -0.91289 0.02768 -0.18870 0.11998 0.06671 0.12826 0.29986 0.19910 0.73325 -0.07544 0.09703 0.12443 -0.35954 0.03096 0.13089 -0.12506 0.17602 0.31859 0.22601 -0.01794 -0.32112 0.34367 0.20457 1.13318 -0.27939 -0.96958 -0.13200 0.16725 0.01232 -0.06612 0.06412 -0.00685 0.01072 0.02990 -0.00024 -0.00041 0.00177 -0.00203 -0.00047 -0.00006 -0.00057 0.00716 -0.00116 0.01095 -0.01628 0.04409 -0.03999 0.08501 0.00309 -0.02944 -0.07809 0.03640 0.00129 -0.02524 -0.01033 0.02553 -0.07087 0.09696 -0.40277 -0.13548 -0.14402 -0.01570 -0.31112 0.11424 0.26914 0.12334 -0.14808 0.00584 -0.18390 -0.50280 -0.23539 -0.50820 -0.35187 -0.80057 1.39563 0.11745 -1.42350 -0.77781 -1.49492 -0.80284 0.16731 -1.19126 -2.79093 -0.82953 1.19405 -0.25960 -0.92454 -0.01818 1.05722 -0.18031 -0.10023 -0.37080 -0.38292 -1.73621 -0.14035 -0.28834 0.44884 -0.30564 -0.17617 0.35949 -0.24893 -0.42718 1.93854 1.52805 0.53931 0.20861 0.94549 0.31297 0.00606 -0.09522 0.02853 -0.00333 0.07407 0.02072 0.00000 -0.00007 -0.00001 0.00149 0.60040 0.00106 -0.00125 -0.06375 0.07700 -0.05988 -0.02812 0.03205 0.01043 -0.00475 -0.00788 0.00057 -0.00480 0.00024 -0.00087 0.00100 0.01302 0.01017 0.00908 -0.00751 0.01635 -0.03998 0.02632 0.02216 0.00648 -0.05959 0.02442 -0.00971 0.00122 0.01197 0.00857 0.00849 0.01562 0.00068 -0.00521 -0.00875 -0.00199 -0.00090 -0.00983 -0.00315 -0.00506 0.00970 0.01361 -0.02238 0.00145 0.01055 0.01284 0.01030 0.02562 -0.04078 -0.01660 0.00717 0.03530 -0.04192 -0.06941 0.01265 0.09176 -0.07830 0.04433 0.00236 0.00936 -0.00062 -0.01726 -0.00750 -0.00825 -0.00892 -0.01413 0.02366 0.00676 -0.00426 -0.42426 0.88119 0.34117 -1.32551 0.52287 0.00091 0.00000 0.00002 0.00000 0.00117 0.43395 0.00083 -0.00154 -0.08004 0.09712 -0.07547 -0.03553 0.04062 0.01333 -0.00599 -0.00993 0.00081 -0.00628 0.00024 -0.00120 0.00139 0.01662 0.01321 0.01192 -0.00956 0.02105 -0.05210 0.03445 0.02885 0.00767 -0.07585 0.03265 -0.01342 0.00223 0.01548 0.01157 0.01028 0.02003 0.00154 -0.00621 -0.01294 -0.00282 -0.00169 -0.01470 -0.00356 -0.00865 0.01310 0.01796 -0.02931 0.00012 0.01398 0.01593 0.01526 0.03480 -0.05791 -0.02518 0.01571 0.05919 -0.06910 -0.10978 0.02068 0.14569 -0.12867 0.07641 0.00393 0.01403 -0.00523 -0.03087 -0.00823 -0.01534 -0.00549 -0.02837 0.04999 0.00535 -0.00831 0.46233 -0.96708 -0.37608 1.46220 -0.57779 -0.00171 -0.00005 -0.00076 -0.00005 -0.00043 0.02007 -0.00073 0.00507 0.21710 -0.26658 0.20439 0.09832 -0.11550 -0.03990 0.01392 0.02528 -0.00370 0.01906 0.00116 0.00554 -0.00672 -0.04572 -0.03850 -0.03981 0.02214 -0.04077 0.13239 -0.08389 -0.06356 0.01201 0.12852 -0.08883 0.05866 -0.03101 -0.02569 -0.03136 -0.00097 -0.02477 -0.02927 -0.00658 0.06728 -0.00163 0.03115 0.08181 -0.02172 0.08344 -0.02442 -0.02501 0.06668 0.06257 -0.03248 -0.02100 -0.09615 -0.12798 0.29348 0.19607 -0.25524 -0.58310 0.64196 0.98452 -0.17154 -1.26840 1.24729 -0.77291 -0.02867 -0.07018 0.17748 0.38207 -0.03644 0.21683 -0.21340 0.43560 -0.85747 0.18596 0.13952 -0.09160 0.24805 0.11584 -0.43823 0.15835 0.00844 -0.00010 0.00209 -0.00032 0.00498 -0.02243 0.00243 0.00038 0.15711 -0.23781 0.22100 0.08785 -0.09954 -0.04129 0.04525 0.05589 -0.00628 0.04436 -0.01398 -0.01135 0.01621 -0.07931 -0.07273 -0.03013 0.15215 -0.62767 0.96210 -0.83130 -0.81641 -0.38690 2.33048 -0.71989 -0.03990 0.36134 -0.47836 -0.07752 -0.46502 -0.94451 0.49735 0.36447 0.22766 0.64178 -0.60400 0.13040 0.75412 -0.44723 -1.03255 -1.17378 0.78691 -1.13816 -0.66235 -0.34485 0.22721 -0.41142 -0.80608 -1.10316 0.86930 1.06344 -0.95432 -3.45757 -0.56520 3.40479 -3.58413 1.34082 -0.01398 -0.15448 -0.34179 -1.11634 -0.11776 -0.72208 0.77139 -0.95721 2.92325 -1.81274 -0.23850 0.05931 -0.30459 -0.18588 0.79410 -0.40394 -0.00636 0.00001 -0.00006 -0.00014 0.00011 -0.00004 -0.00003 0.00092 0.03329 -0.01083 -0.03367 -0.04644 0.07244 0.01912 0.04450 -0.03822 0.34876 -0.07729 -0.17682 -0.10012 -0.26754 -0.05993 -0.09531 -0.05318 0.09420 -0.01553 0.00652 0.13834 0.09249 0.02118 0.01160 -0.05059 0.09173 -0.15427 0.33335 -0.08119 0.19827 0.11904 0.43819 -0.20844 0.05699 0.30249 0.09396 0.08439 -0.06711 0.19237 0.18858 -0.04411 0.43205 -0.30869 -0.12991 -0.12870 -0.04456 -0.04026 0.10981 0.32820 0.07846 0.01784 0.08283 -0.16098 -0.13398 0.10410 -0.06975 -0.03618 0.12133 -0.18076 -0.13702 0.29389 -0.29150 0.04771 -0.07371 -0.07355 -0.00175 -0.15207 -0.00887 0.00268 0.00474 -0.00224 0.00183 -0.00779 -0.00093 0.00000 0.00003 0.00002 -0.00019 0.00000 -0.00006 -0.00094 -0.05824 -0.03236 0.01967 0.01984 -0.08887 -0.12688 0.07303 0.23653 0.13561 0.06654 0.06565 0.00640 -0.13504 0.33242 0.10059 0.10521 -0.06157 -0.08294 -0.04548 -0.01721 -0.13440 0.09160 0.08382 -0.11360 -0.04802 -0.13032 -0.07195 -0.17915 -0.09332 -0.23904 0.39557 0.09887 0.00377 0.15174 0.19941 0.07230 -0.06493 -0.00142 0.38245 -0.02719 -0.53434 0.15850 0.02305 0.32007 0.10838 0.39657 -0.19230 0.07274 0.09301 0.17473 -0.08524 0.19545 0.03626 -0.20249 0.08592 0.14706 0.07712 0.02829 -0.27558 0.11998 -0.03383 0.08650 0.06605 -0.17029 0.05453 0.20763 -0.02392 0.00403 -0.00618 -0.00264 -0.00245 0.00914 -0.00026 0.00003 -0.00008 0.00002 0.00006 -0.00003 -0.00005 0.00007 0.00737 0.00110 0.00523 0.00375 0.06973 -0.00210 -0.15588 0.14614 0.02600 -0.20701 -0.00893 0.35980 0.01469 0.05937 -0.23088 0.00514 0.01500 0.00376 -0.00662 0.06891 0.02148 0.14853 -0.03980 -0.01366 0.23958 -0.13216 -0.20531 0.27134 -0.04648 -0.22578 0.14514 0.11101 -0.01611 0.09167 -0.68345 -0.24397 -0.28699 0.17100 0.02307 0.04913 0.01228 0.12632 0.05403 -0.07641 -0.09333 0.03379 0.11635 0.24416 0.04412 0.06434 0.00875 -0.06370 -0.06719 0.06620 -0.03668 -0.09965 -0.26248 0.22209 -0.18565 0.16645 0.24150 0.08381 -0.11797 0.02821 0.01777 -0.05162 -0.01991 0.00082 -0.00064 0.00298 -0.00090 -0.00493 -0.00347 0.00063 0.00092 0.00039 0.00160 -0.00088 -0.00024 -0.02086 -0.00476 -0.00598 0.00200 -0.00725 0.01529 0.02454 0.03146 0.01540 0.10242 -0.03714 -0.05053 -0.04360 -0.07263 -0.03008 -0.03596 0.01820 0.04538 0.09429 -0.10379 0.16455 -0.15954 -0.36792 0.74221 -0.26928 0.43633 -0.49291 0.82712 0.27825 -0.36808 1.34562 0.60681 0.86630 -1.11634 -0.52499 -0.14300 -0.16411 0.40470 -0.27339 -1.42949 -0.64642 -0.74265 0.43894 1.57366 0.14980 -0.62241 0.38616 -0.44910 0.84503 -0.44596 0.35081 0.02128 -0.06903 0.11255 0.04345 0.21721 0.07434 -0.59949 -0.00602 0.14932 -1.27549 0.83636 -0.22571 0.36873 0.35721 0.31198 -0.64139 -0.47658 -0.06003 -0.00402 -0.02997 0.02888 -0.06657 -0.06050 0.00015 -0.00078 -0.00044 -0.00176 0.00149 -0.00125 0.00044 0.00551 -0.01091 -0.00355 -0.00292 -0.00692 -0.02259 0.00717 0.05026 0.04347 0.02903 0.02821 0.00754 -0.04977 0.11380 0.01599 0.03358 -0.04775 -0.02968 -0.27441 -0.10374 -0.62586 0.44005 -1.06172 -0.27949 -0.58662 -0.73512 -0.06583 -0.87084 0.35591 0.03646 0.33001 0.33418 -0.54506 -0.23916 -0.29249 0.21289 0.55940 -0.08929 -1.57447 -0.93574 0.17275 0.22322 0.51684 -0.31087 -0.57295 -0.29944 0.87686 0.65991 0.30468 0.41438 -0.16213 0.28795 0.22717 0.14090 0.10857 0.06898 -0.32886 -0.05557 0.62198 -0.59282 -0.07322 -0.00358 -0.69851 0.86611 -1.13568 0.23877 -0.03225 0.05300 -0.01270 -0.00265 -0.08518 0.05371 -0.01137 -0.00003 -0.00058 -0.00022 0.00057 -0.00038 0.00001 0.00200 -0.00329 -0.00538 0.00461 0.00199 0.01751 -0.00001 -0.03666 0.03137 0.01266 -0.05070 0.00189 0.11799 0.00127 0.02614 -0.06872 -0.02683 0.04093 -0.03980 0.08181 0.01227 0.29655 -0.61935 -0.07497 -0.56818 -0.32034 -0.94859 -0.95054 1.37737 -0.15947 -0.59702 0.53651 -1.53837 -0.51078 -0.83977 0.82865 -0.22532 0.83677 0.09468 -0.99760 -0.16739 -0.22481 -0.80530 -0.81914 -0.35697 0.08974 0.34260 -0.78349 0.40014 0.35536 0.20513 -0.13541 -0.20496 -0.58322 -0.25083 -0.01126 -0.05710 0.58981 -0.61782 0.56444 -0.55755 -0.91331 -0.30167 0.62778 0.00270 -0.03489 -0.29121 -0.07101 0.01479 0.00803 0.01699 0.01385 -0.03052 0.00199 0.00000 -0.00005 -0.00002 0.00124 -0.00106 0.60040 -0.00154 -0.06090 -0.08881 0.00422 -0.05246 0.03026 0.01749 -0.00303 -0.00230 -0.00677 0.00022 0.00030 0.00008 0.01107 -0.00511 0.00744 -0.01298 0.00017 0.01322 0.02262 0.04932 -0.00690 -0.01400 0.01757 0.05882 -0.01201 -0.01496 -0.00700 -0.01283 -0.00242 -0.01370 0.00419 0.00058 0.00111 -0.00809 -0.00525 0.00326 0.01538 0.00815 -0.00814 0.00422 -0.00604 -0.01225 -0.00163 0.01291 0.00415 0.03009 0.03921 -0.02190 0.00203 0.04895 -0.00089 -0.08070 0.00248 0.01587 0.12315 0.02863 -0.00592 -0.00332 -0.00295 0.01345 -0.00322 0.00368 -0.00425 0.02410 -0.00446 0.00592 0.01306 -0.41300 0.78046 0.68799 1.12840 0.75963 -0.00171 -0.00001 0.00002 0.00000 0.00099 -0.00071 0.43394 -0.00195 -0.07641 -0.11199 0.00530 -0.06624 0.03832 0.02231 -0.00385 -0.00279 -0.00864 0.00028 0.00043 0.00016 0.01415 -0.00652 0.00974 -0.01682 0.00007 0.01725 0.02919 0.06294 -0.00739 -0.01853 0.02170 0.07643 -0.01566 -0.01905 -0.00925 -0.01729 -0.00247 -0.01746 0.00454 0.00059 0.00103 -0.01094 -0.00799 0.00441 0.02128 0.01104 -0.01020 0.00585 -0.00756 -0.01640 -0.00234 0.01579 0.00803 0.03988 0.05520 -0.03382 0.00527 0.08182 -0.00235 -0.12772 0.00499 0.02230 0.19950 0.05066 -0.00996 -0.00651 -0.00802 0.02176 -0.00467 0.00338 -0.00425 0.05476 -0.01089 0.00311 0.02384 0.44996 -0.85637 -0.75818 -1.24455 -0.83938 0.00317 0.00014 -0.00060 -0.00021 -0.00050 -0.00080 0.02017 0.00675 0.20636 0.30644 -0.01377 0.18216 -0.10846 -0.06417 0.00962 0.00536 0.02383 -0.00078 -0.00109 -0.00192 -0.03886 0.01860 -0.02949 0.05076 0.00511 -0.04400 -0.06945 -0.11186 -0.02438 0.06262 -0.01893 -0.16525 0.04001 0.02620 0.03009 0.04851 -0.00882 0.01867 0.01902 0.00340 0.00336 0.01931 0.04935 -0.01484 -0.07204 -0.04500 -0.02199 -0.02059 0.00356 0.04263 0.00029 -0.00021 -0.10089 -0.11587 -0.25728 0.28758 -0.11204 -0.79202 0.04281 1.12637 -0.08209 -0.13455 -1.83809 -0.51715 0.11308 0.12596 0.18013 -0.21495 0.01200 0.05242 -0.03976 -1.01136 0.20943 0.23930 -0.35617 -0.08588 0.22094 0.22376 0.37520 0.24167 -0.01378 -0.00066 0.00162 0.00030 0.00577 0.00255 -0.02257 -0.00117 0.15462 0.27933 -0.02491 0.18341 -0.09929 -0.08962 0.01212 0.01637 0.04571 -0.00002 -0.01399 0.01178 -0.08636 0.01398 -0.04738 0.07359 -0.09141 -0.30850 -0.46646 -1.76113 0.52671 0.36517 -0.84340 -2.02045 0.31356 0.83963 0.12114 0.51330 0.16930 0.55636 -0.45205 -0.03649 0.30725 0.81831 0.04433 -0.15908 -0.61938 -0.03663 1.73274 -0.10066 0.29370 0.50499 0.11240 -0.98152 0.62268 -0.76983 0.34984 -2.34708 0.25149 1.30774 0.01161 -3.38971 1.07041 0.76413 4.95208 0.18348 -0.21454 -0.64166 -0.53789 0.79547 0.50275 -0.35042 -0.01876 3.01474 -0.10633 -2.08768 1.25483 0.03511 -0.25046 -0.36116 -0.65311 -0.57822 0.06137 0.00000 -0.00005 -0.00004 0.00018 -0.00004 -0.00003 0.00188 0.03481 0.00401 -0.01869 -0.06104 0.06781 0.07186 0.05831 0.08057 0.00822 0.30912 0.21490 0.14886 -0.16332 -0.18284 -0.10338 0.12877 0.02634 0.02864 -0.05560 0.12107 0.11291 -0.01056 0.07915 0.01352 0.07751 -0.22071 0.22017 -0.05236 -0.09488 -0.17381 -0.15634 -0.27121 0.49038 0.07502 0.00389 -0.01214 -0.10184 -0.38149 -0.05509 -0.31754 -0.13595 0.34805 0.15204 -0.22380 0.12296 -0.20660 -0.07892 0.15494 -0.00740 -0.07459 -0.16570 -0.10682 0.08643 0.10557 0.13181 -0.15177 0.13984 -0.16179 -0.14566 -0.22219 0.07724 0.19760 -0.25986 -0.06291 0.00001 -0.18646 -0.00327 -0.00133 0.00389 0.00011 0.00138 -0.01040 -0.00021 -0.00004 -0.00003 0.00003 0.00020 0.00008 0.00002 0.00161 0.05664 -0.02376 0.01010 -0.02961 0.07642 0.13644 -0.05707 -0.19515 -0.19899 -0.01079 -0.06550 0.00198 -0.23132 0.27715 -0.00330 0.17105 0.00192 -0.06269 -0.01463 0.08424 0.11488 -0.03110 0.02933 0.10653 -0.00004 0.11249 -0.10193 -0.18247 -0.09383 -0.18682 0.35742 0.17260 -0.24609 -0.14193 0.22911 -0.26619 -0.24895 -0.22416 0.02747 0.11958 0.25990 0.32641 -0.15867 -0.23252 0.19053 -0.45932 -0.19970 -0.06991 -0.13385 -0.16628 0.09099 -0.19462 0.03108 0.10616 0.14031 -0.14136 -0.07525 -0.06109 0.24793 0.16682 0.11373 -0.11967 0.09592 -0.13636 0.14468 -0.18907 0.00888 -0.00488 0.00535 0.00339 -0.00192 -0.00949 0.00269 0.00001 -0.00010 0.00001 0.00007 -0.00004 -0.00004 0.00006 0.01006 -0.00019 0.00544 0.00201 0.07226 0.00905 -0.15453 0.13918 -0.04254 -0.05180 0.19276 -0.35950 -0.00625 0.03640 -0.24223 -0.00876 -0.00355 0.01560 -0.03856 0.06178 0.01236 0.13636 0.07594 0.05698 0.21384 -0.05618 -0.22916 0.11223 0.32299 -0.02518 -0.17580 0.16677 -0.02501 0.46851 0.31997 -0.25195 0.47114 0.03184 -0.06258 0.11241 0.03073 0.25846 -0.00373 -0.10532 0.00336 -0.00760 -0.06228 0.18775 0.02636 0.00750 -0.10604 -0.05323 0.03717 0.04622 0.07462 -0.19904 -0.23498 0.24686 -0.14018 -0.11897 -0.26915 -0.10304 0.06750 -0.02840 -0.00235 -0.07662 -0.00956 0.00158 -0.00028 0.00366 0.00046 -0.00550 -0.00128 -0.00022 0.00028 0.00124 0.00159 -0.00019 -0.00137 -0.01592 -0.00197 0.00766 -0.00330 -0.01498 0.01349 0.03220 0.03089 0.04715 0.00620 0.07010 0.06047 0.04991 -0.05717 -0.05762 -0.03263 0.03623 0.00839 -0.04684 -0.08616 -0.06255 0.43907 -0.07801 -0.27235 -0.70174 0.53997 -0.49704 0.25033 -1.39528 -0.20149 -0.46911 -1.27973 0.49187 0.11432 -0.63524 0.11489 -0.00762 -0.24593 0.32132 0.72721 1.90174 0.67155 0.28956 -0.78274 0.91402 0.53824 0.78098 0.81546 1.07881 -0.16694 0.16582 -0.55094 -0.15604 -0.07205 0.03094 -0.17829 0.27735 -0.65210 -0.10090 0.03802 0.90549 -0.00806 -0.81335 1.18472 0.61754 -0.18674 -0.70976 0.24570 -0.06306 -0.03634 -0.00226 -0.02822 -0.08178 0.01283 -0.00023 0.00091 0.00041 0.00173 0.00140 -0.00156 0.00158 -0.00538 -0.00719 0.01072 0.00133 0.00329 0.02363 -0.00792 -0.04092 -0.06417 -0.01088 -0.02536 -0.00249 -0.06894 0.08734 0.01998 0.07848 -0.00596 -0.08149 -0.28283 -0.06078 0.99185 0.04668 -0.19124 -0.31856 0.66002 1.12495 0.22655 -0.10282 0.30943 -0.62812 0.87812 0.02570 0.14381 0.11451 -0.49711 0.30840 1.19012 -0.10639 -1.08659 -1.06019 -0.53478 -0.62365 0.37625 -0.02646 -0.15419 0.20852 0.62856 -1.03435 -0.42401 -0.45314 0.31225 -0.17144 0.16735 -0.01333 -0.03129 -0.23444 0.35565 0.17699 -0.48328 -0.62495 -0.09289 0.21410 -0.35987 1.37938 -0.50315 -0.29658 0.44829 -0.05629 0.02137 -0.02362 -0.07552 -0.06591 0.02014 0.00016 -0.00020 -0.00047 0.00101 0.00022 -0.00019 0.00607 -0.00629 0.00276 -0.00143 0.00830 0.01106 0.00022 -0.04377 0.02548 -0.00297 -0.00883 0.06103 -0.10644 -0.01065 0.00486 -0.07036 0.00508 -0.04053 0.01171 -0.26305 0.15493 0.06883 -0.33194 0.30102 -0.45935 -0.21996 -0.04654 -0.91141 -0.25632 2.06112 -0.29842 -0.18084 -1.26994 -0.26608 -0.95116 0.15172 -0.52486 -1.16700 0.29278 0.67137 -0.16431 -1.05322 -0.10761 -0.03434 -0.87022 -0.11442 -0.02007 0.74383 -0.57676 0.15972 0.09839 0.14463 0.01503 0.68324 0.09037 -0.12876 -0.20646 0.69354 -0.60847 0.36297 0.45653 1.13666 0.24947 -0.30113 0.27288 0.09152 -0.20655 -0.09611 0.00418 0.03303 0.00540 -0.00879 -0.04206 -0.01568 -0.00020 -0.00009 -0.00030 -0.00042 -0.00011 -0.00014 0.02548 0.03476 -0.01279 -0.08022 -0.09764 -0.14278 0.09218 0.01497 0.02812 -0.00401 -0.14269 0.13727 0.00898 -0.03549 -0.00592 0.07822 -0.04051 0.10229 0.01280 -0.00373 -0.02596 0.01068 0.09116 0.02208 -0.01383 -0.00792 0.05487 -0.04349 0.00089 -0.02102 -0.00476 0.00314 -0.08809 0.01442 0.00379 0.08514 0.03366 -0.10662 0.01882 -0.06189 -0.06426 0.11171 0.04901 0.11270 0.07652 0.02919 0.03989 0.02658 0.09484 -0.04098 -0.08181 -0.05526 -0.20591 -0.10195 -0.03602 -0.03876 -0.49719 0.43756 0.26945 -0.03498 0.02769 0.05735 -0.21094 0.12044 0.57392 0.78522 0.92779 0.37014 0.02928 -0.00412 -0.00420 -0.00189 0.01165 0.01700 0.00099 0.00075 0.00055 0.00244 -0.00073 -0.00076 -0.03327 0.00957 -0.00430 -0.02708 -0.02074 -0.02776 0.05537 0.03902 0.02394 0.01458 -0.09083 0.10205 0.01435 -0.01265 0.01361 0.06519 -0.03901 0.15810 0.19193 -0.08105 -0.24622 0.09154 0.63643 0.18951 -0.02033 0.03064 0.09350 -0.72700 -0.57264 -0.34656 0.49955 -0.41199 -0.87603 -0.91018 -0.69839 0.69301 1.00522 -0.91503 1.08657 -0.83174 -0.08404 1.34392 2.37157 1.42716 0.38778 0.25618 1.79015 0.36173 2.07219 0.19294 0.86227 -0.61612 0.71061 -0.34934 0.51417 0.31291 1.73187 -1.70012 -1.40102 -0.25728 -0.36958 -0.15105 0.09104 0.01125 -1.04311 -1.72903 -3.12133 -1.24088 -0.09623 0.00078 -0.03705 0.01612 -0.11318 -0.08931 -0.00007 -0.00018 -0.00021 -0.00016 -0.00018 -0.00015 0.00492 0.07804 0.00269 -0.00450 -0.02423 0.14174 0.02026 -0.11313 0.08219 0.03026 -0.01095 0.01753 -0.00332 0.01044 -0.01803 0.23580 -0.01442 0.00087 0.01342 -0.01917 0.01012 -0.03388 -0.06781 0.00813 -0.05558 -0.08024 0.06560 0.02148 -0.03882 -0.06160 0.00778 0.00205 -0.02199 0.00456 0.03917 -0.03504 -0.00026 0.06419 0.09854 0.02232 0.05050 -0.11047 0.05913 -0.02909 -0.06989 -0.05251 -0.02092 0.02055 0.10718 -0.06389 -0.20798 0.00632 0.09699 -0.06999 0.08868 0.11700 0.30989 0.40319 0.69334 0.34603 0.11274 -0.20189 0.36069 -0.16922 0.26828 0.60463 -0.91645 0.09787 0.01701 -0.00526 -0.00323 0.00135 -0.00114 0.00387 0.00054 -0.00047 0.00032 0.00460 0.00051 0.00030 -0.00640 -0.00411 0.00169 0.00132 -0.00363 0.06638 0.02489 -0.03269 0.05470 0.03055 -0.00970 0.02541 0.00281 0.00648 -0.00797 0.20349 -0.02630 0.02052 0.08994 -0.22531 -0.01532 0.11607 -1.47808 0.02130 -0.61294 -1.56021 -0.21798 -0.73327 -0.32503 0.18127 0.06641 -0.17055 -1.24047 -1.06503 -0.11791 -0.26805 -0.45418 0.24333 0.61662 -0.14962 0.38972 -0.72798 0.90969 -0.38267 -1.31940 -0.51305 0.41230 0.30515 2.61096 0.55089 0.79682 -0.65774 -0.78856 0.09845 0.17493 -0.21100 -2.09209 -1.33252 -1.85626 -1.20288 -0.17922 0.62016 -1.12600 0.54445 -0.28057 -1.27202 0.18213 -0.56043 -0.08886 0.09243 0.05880 0.00513 -0.16774 -0.05497 -0.00010 -0.00031 -0.00037 -0.00001 0.00000 -0.00009 0.02147 -0.00364 -0.04401 -0.10122 0.10852 -0.01508 0.15297 -0.03055 0.08248 0.01659 0.11236 -0.12119 -0.01110 0.08418 0.05611 -0.02663 -0.03415 0.09806 0.01732 -0.01880 -0.02459 0.05042 0.00350 -0.01130 -0.01076 -0.01325 -0.01728 -0.08827 -0.03253 -0.01526 0.04927 0.01068 0.03409 0.08033 0.04338 0.07216 -0.00577 -0.12652 -0.01342 -0.07259 -0.01474 -0.01206 -0.04247 0.01773 0.02590 -0.13903 0.01595 0.01230 0.02868 -0.03815 -0.15234 -0.10469 0.04249 -0.25756 0.28138 0.20236 0.03822 0.63371 0.43857 -0.34052 0.00414 0.38126 -0.87605 0.13487 -0.29899 -0.57578 -0.22187 0.09847 0.02521 0.01424 -0.00221 -0.00148 -0.00511 0.00731 -0.00015 0.00020 0.00282 -0.00043 -0.00026 0.00062 -0.00237 0.00107 -0.01466 -0.02620 0.02440 0.01006 0.06450 0.00225 0.06263 0.00532 0.05600 -0.09732 -0.00917 0.08313 0.05125 0.00264 -0.05430 0.20562 0.03756 -0.10030 -0.31692 0.74388 -0.14354 0.17907 0.24255 -0.36763 -0.65478 -0.98051 -0.54094 -0.35295 0.76085 0.06179 0.35558 0.65508 0.73852 0.26921 -0.93819 -0.80668 -0.55295 -0.81939 -0.03184 -0.68881 -1.59361 -0.58430 0.88458 -0.97201 -0.58574 -0.22135 0.59119 0.03736 -0.12078 0.07972 -0.95686 -0.66874 -1.14675 -0.76373 0.32549 -1.18987 -0.50971 0.84277 -0.17247 -0.82986 2.39521 0.35853 0.41834 0.96460 0.52021 0.08888 -0.07765 -0.09090 0.06907 0.01072 0.03293 0.01804 -0.00011 -0.00031 -0.00031 -0.00021 0.00005 -0.00016 0.02121 0.00253 -0.04597 -0.09850 0.10435 0.07520 -0.02821 0.14146 0.05789 -0.11891 -0.10352 0.01824 -0.00270 -0.11249 -0.06666 0.01356 -0.04535 -0.08797 0.00152 -0.00330 -0.05472 0.01379 0.00133 0.02663 0.02261 -0.05082 -0.05628 0.00527 0.02633 0.06027 -0.02681 0.05947 0.06668 0.08682 -0.04498 -0.00702 0.09404 0.01300 0.07558 0.00160 0.04247 0.02297 0.03494 -0.00931 0.00308 -0.15325 -0.02132 -0.08718 0.01741 -0.01327 -0.17233 -0.07521 0.05893 0.00669 0.52895 0.11632 -0.13879 0.09827 0.04153 -0.01701 -0.04059 0.11698 0.83383 1.04322 0.09634 -0.39357 0.10493 0.15664 0.02730 0.00785 -0.00334 -0.00721 0.00309 0.00821 0.00006 -0.00012 0.00207 0.00133 0.00023 0.00057 0.00168 -0.00307 -0.01407 -0.03047 0.03623 0.01643 -0.00058 0.05026 0.04876 -0.08254 -0.06048 0.00655 -0.00136 -0.11074 -0.06026 0.02309 -0.05886 -0.16814 0.07097 -0.17306 -0.44558 0.65474 -0.26741 0.06544 0.31905 -0.49991 -0.65275 -0.08353 0.39961 0.60705 -0.07827 0.32191 1.05748 0.79453 -0.75289 0.03796 1.62617 0.18360 1.16279 0.23395 0.04706 0.57772 1.45431 0.32457 -0.77035 -0.13492 0.26258 -0.20184 -0.50907 -0.10624 -0.04796 -0.10421 -0.60893 1.19183 -1.31980 -0.29711 -0.13449 0.06489 0.39394 -0.06562 0.32326 0.16873 -1.92440 -2.08676 -0.56145 0.23605 -0.68245 -0.19754 -0.08157 -0.02560 0.08102 0.00373 -0.03817 -0.00075 -0.00006 -0.00010 -0.00002 -0.00024 -0.00039 -0.00015 0.00254 0.05272 -0.08095 0.06551 0.03420 -0.07810 -0.02024 0.07442 -0.04573 -0.04718 0.12336 0.02834 -0.17700 0.01786 -0.03777 0.15114 -0.01074 -0.00704 0.00362 0.01947 0.00003 0.01726 -0.00491 -0.06695 -0.04525 0.07180 -0.07898 -0.01595 0.07683 -0.04619 -0.00471 0.03055 -0.01491 -0.00819 -0.09629 0.07779 -0.03222 -0.01819 -0.03084 0.02504 0.01167 0.02334 -0.03215 0.04485 0.01650 0.03526 0.04394 -0.06541 0.06749 -0.09350 -0.06913 0.12212 -0.11950 -0.09577 0.40297 -0.18810 -0.08773 -0.46931 0.52612 -0.31624 0.63947 0.35387 0.35629 -0.71324 0.21708 -0.39160 0.26487 0.12564 0.01531 -0.01698 -0.00330 0.00807 0.00080 0.00607 0.00022 -0.00053 0.00024 0.00013 0.00372 -0.00028 -0.00864 0.00397 -0.01880 0.01329 0.01051 -0.02866 -0.00072 0.04361 -0.02369 -0.02456 0.06905 0.02144 -0.11740 0.01663 -0.02314 0.16835 -0.01558 0.01434 0.19743 -0.22448 0.40339 0.60407 -0.17029 -0.62456 -0.12184 0.43464 -1.03930 -0.38636 1.61423 -0.14025 -0.07797 0.59785 -0.85860 -0.52992 -0.63024 -0.01662 -0.52125 0.14653 0.05932 -0.36012 0.08340 -0.11137 -0.38880 0.01304 0.06694 0.06590 0.53496 -0.76575 0.42409 -0.22095 -0.18506 0.22564 0.53034 -0.35864 -1.23518 1.01181 -0.10998 0.93882 -0.71250 0.99430 -0.91535 -0.94145 -0.38342 1.14704 -0.00603 -0.04659 -0.32083 -0.21988 -0.03087 0.06773 0.04664 -0.13219 0.03604 -0.01603 -0.00005 -0.00021 -0.00011 -0.00023 -0.00040 -0.00011 0.00135 0.05175 -0.07839 0.07447 0.04709 -0.05147 -0.02603 -0.04779 0.06582 -0.14565 -0.01730 0.08019 0.14833 0.14664 0.03646 -0.04559 0.01266 -0.04338 0.01487 -0.05871 0.00396 0.01380 0.01258 0.05596 -0.02540 -0.01294 -0.00241 0.09119 -0.00335 0.04203 0.07785 0.00739 0.03733 -0.05449 0.01651 0.01609 -0.08278 -0.05458 0.03574 -0.02070 0.06117 -0.07378 0.09673 0.04128 -0.00246 -0.03979 0.01081 -0.01048 0.01459 -0.14433 -0.11853 0.02930 -0.18087 0.05777 0.22251 -0.16519 0.05362 0.60127 -0.39534 0.09016 0.49601 -1.02606 0.01963 -0.25082 0.06536 -0.46226 0.19709 0.09109 0.01991 -0.01355 -0.00204 0.01022 -0.00005 0.00533 0.00043 0.00136 0.00081 0.00011 0.00373 -0.00064 -0.01301 -0.00062 -0.01265 0.01896 0.01680 -0.02287 0.00270 -0.01435 0.05345 -0.08859 -0.03692 0.05574 0.08693 0.13214 0.03651 -0.03272 0.04254 -0.07147 0.28147 -0.52188 0.37839 0.28672 0.10613 0.11753 0.26626 0.18981 -0.08462 1.63971 -0.30199 0.24296 1.56216 0.38490 0.51799 -0.64734 0.11577 0.14138 -0.19274 -0.16852 0.02968 -0.13242 0.07886 -0.39943 0.30239 1.04320 -0.01153 -0.20215 0.46722 -0.24204 0.55147 -0.76506 -0.18722 0.39806 0.72813 0.13839 -0.75201 1.09463 -0.22806 -1.18705 0.62780 -0.13065 -0.80247 1.96304 0.00340 0.24345 0.42100 0.14406 0.09339 -0.25511 -0.09460 0.04806 -0.01159 -0.13885 0.04463 -0.03762 0.00000 -0.00016 -0.00005 -0.00022 -0.00042 -0.00018 0.00167 0.05076 -0.09231 0.06297 0.02974 -0.04476 -0.05728 0.02662 0.11166 0.15093 -0.01719 -0.02734 0.02553 -0.15927 0.12865 -0.03918 0.03235 0.01802 -0.00477 0.02268 0.02686 0.01176 -0.02520 -0.00374 0.06717 0.00162 0.09357 -0.03759 0.02561 -0.02227 0.03760 -0.04904 -0.05135 0.05106 0.02338 -0.00534 0.06330 -0.03098 0.05310 0.09917 0.09754 -0.04535 -0.02620 0.01325 0.03972 -0.04987 0.03507 -0.04606 0.08581 -0.10828 -0.10311 -0.04161 -0.07897 0.02169 0.33028 -0.00374 -0.05198 -0.16426 0.08348 0.95291 -0.75557 0.05402 -0.20366 -0.32194 0.45707 -0.50932 0.17794 0.02081 0.01713 -0.01683 -0.00369 0.00887 -0.00151 0.00116 -0.00017 -0.00013 0.00029 -0.00023 0.00373 0.00121 0.00295 -0.00035 -0.01586 0.00656 0.01213 -0.02514 -0.03686 0.01409 0.06548 0.08737 -0.02413 -0.02410 0.01735 -0.13162 0.10852 -0.01250 0.04232 0.00396 0.23916 -0.02542 0.30817 0.61117 -0.19580 -0.28069 1.04546 0.05728 1.00617 -0.03314 0.51521 0.02111 0.16579 -1.25201 -0.44048 0.65136 -0.01562 0.04364 -0.03182 -0.53546 0.13813 1.30790 1.18478 0.07570 -0.07819 -0.43408 0.19318 0.36520 -0.13851 -0.69026 -0.44844 -0.34743 -0.62505 0.47079 0.64165 -0.17872 -1.08423 0.51087 -0.42786 0.45820 0.08731 -1.37743 1.91502 -0.23783 0.50855 0.26999 -1.07478 0.45784 0.43177 0.13091 -0.04243 0.08838 0.06259 -0.09443 0.08042 0.01805 0.00001 -0.00006 -0.00014 -0.00025 -0.00016 -0.00037 0.00230 0.05006 0.09221 -0.00535 0.06323 -0.07380 -0.03648 0.06767 -0.07124 0.03169 -0.01093 -0.12457 0.17120 0.00619 0.01032 0.15966 0.00978 0.00409 -0.01353 -0.01644 0.02150 -0.04878 -0.00977 0.05493 0.00187 0.06061 -0.02569 -0.01268 -0.03779 0.13669 0.00460 -0.01918 0.00839 0.01841 -0.09518 0.01410 -0.00200 -0.02075 -0.03421 -0.04395 -0.00843 0.00448 -0.06045 0.00448 0.03254 0.04108 0.02194 0.08059 0.03107 -0.11300 -0.14715 -0.10935 -0.12913 0.01409 0.16571 0.41046 -0.31105 -0.41947 0.55919 -0.25951 -0.45642 -0.77865 0.02693 -0.07357 -0.70250 0.14386 0.23360 -0.09897 0.01759 -0.01266 -0.01025 -0.00632 -0.00002 -0.00038 0.00016 -0.00043 0.00043 0.00024 -0.00016 0.00381 -0.00295 0.00185 0.01987 0.00097 0.01480 -0.03242 -0.00657 0.03604 -0.03651 0.01862 -0.01212 -0.07853 0.11408 0.00905 -0.00144 0.17406 0.00605 -0.00596 0.08375 -0.12484 0.73297 0.07634 -0.09686 0.54842 0.34321 0.39393 -0.46536 -0.73743 -0.58626 1.86367 -0.63567 -0.40803 -0.50452 -0.02342 -0.48785 0.34675 -0.54309 -0.11381 -0.04794 0.18367 0.14241 -0.44601 0.03601 -0.03988 -0.08246 0.15082 0.39132 0.84311 -0.10110 -0.17501 -0.36069 0.06158 0.72609 0.30050 -0.15854 -1.54161 0.22049 1.00918 -0.62887 0.82210 0.77006 1.56071 0.17914 0.05551 0.42914 -0.07321 -0.17999 -0.10565 -0.03821 0.05896 0.08860 0.10824 0.05859 -0.01548 0.00003 -0.00014 -0.00016 -0.00022 -0.00011 -0.00035 0.00142 0.04897 0.09206 0.00203 0.07745 -0.04662 -0.05080 -0.05539 0.00781 -0.00819 -0.15219 -0.04203 -0.17028 0.06849 0.12042 -0.04172 -0.05518 -0.02571 0.01398 0.05207 0.02252 0.03685 0.00667 0.01001 -0.04333 -0.00856 -0.04932 0.05322 -0.04045 -0.07328 -0.07967 -0.04395 0.00998 0.00567 -0.02829 -0.03469 -0.04579 0.07088 0.06301 -0.08488 0.08741 0.04002 0.01560 -0.05103 0.01841 -0.02946 0.06365 0.02783 0.05427 -0.09344 -0.11182 -0.00703 -0.19359 -0.07480 0.07672 0.29087 0.01380 0.61916 -0.38488 -0.00621 -0.33361 0.51450 0.61324 -0.63875 -0.61779 0.16169 0.24752 -0.11121 0.01885 -0.01008 -0.00731 -0.00789 -0.00093 -0.00217 -0.00013 0.00087 0.00128 -0.00018 -0.00064 0.00332 -0.01010 0.00130 0.01868 0.00830 0.01561 -0.01866 -0.00703 -0.01509 0.02635 -0.01378 -0.11547 -0.02540 -0.11267 0.07339 0.10197 -0.02871 -0.06519 -0.01455 0.11398 0.26040 0.46974 0.47006 -0.00971 0.06611 0.27115 0.14605 -0.70915 0.90543 -1.10518 -1.16666 -0.80379 -0.63566 0.25501 0.50001 -0.44437 -0.24603 0.08184 0.26457 -0.16283 -0.34053 0.95355 0.38979 0.10960 -0.51879 0.61695 0.47942 0.79849 0.50455 0.99471 -0.47406 -0.40910 -0.37800 0.68628 -0.23182 -0.07349 -1.37231 0.13321 -1.19199 0.68217 -0.00280 0.48281 -0.95043 -1.26335 1.57425 0.37615 -0.26678 0.01217 0.11946 -0.08650 0.00994 0.04491 0.11269 0.07099 0.00801 0.00008 -0.00016 -0.00006 -0.00021 -0.00020 -0.00036 0.00104 0.04729 0.09972 -0.01014 0.05588 -0.04322 -0.05734 0.02457 0.11500 0.08795 0.07776 0.10458 -0.00226 0.04674 -0.18726 -0.07706 -0.02735 0.01739 0.00722 -0.02435 0.01241 0.02297 -0.01476 -0.03926 0.04734 -0.00021 0.09920 -0.03847 -0.01277 -0.02400 -0.03708 0.08756 -0.00201 0.00375 0.01261 0.00984 0.07193 0.05725 -0.01394 -0.06651 -0.04605 -0.11004 0.03150 -0.00388 0.06186 -0.01925 0.03829 0.07332 0.11440 -0.09358 -0.06435 0.11601 -0.11864 0.00376 0.22077 0.23198 0.07375 -0.23280 -0.04791 0.82805 0.76465 0.20350 -0.28156 0.27956 -0.66145 0.31643 0.24822 -0.16584 0.01716 -0.01486 -0.00560 -0.00603 -0.00261 -0.00538 -0.00018 0.00020 0.00014 -0.00030 0.00132 0.00362 0.00758 -0.00412 0.01519 0.00795 0.01129 -0.02295 -0.02809 0.01413 0.07036 0.03704 0.04259 0.06005 -0.00888 0.04905 -0.15372 -0.04195 -0.01624 0.02896 0.01097 -0.06386 0.50365 0.49006 -0.06176 -0.16720 0.92127 0.01361 0.99369 -0.10918 -0.04311 -0.16235 -0.55107 1.60126 0.25859 -0.44748 -0.09768 -0.15281 0.17010 0.90299 -0.21761 -1.17272 -0.84139 -0.39184 -0.38322 0.19112 0.03320 -0.24209 -0.14245 0.59480 -0.52323 -0.35321 -0.76221 0.14971 0.78556 0.03044 -0.38447 -1.10054 -0.52484 0.60364 0.38029 -1.09338 -1.61241 -0.44748 0.77279 -0.93839 0.63514 -0.79840 0.30333 0.22728 -0.04489 0.08587 0.07038 0.05885 0.09949 0.01361</matrix>
                     <list dictRef="x:label">
                        <scalar dataType="xsd:string" dictRef="x:label">1   O  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2   C  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">3   C  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">4   C  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5   C  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6   C  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">7   H  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">8   H  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">9   H  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">10  H  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">11  H  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">12  H  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">13  H  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">14  H  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">15  H  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">16  H  1S</scalar>
                        <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                     </list>
                  </module>
                  <array dataType="xsd:integer" dictRef="cc:serial" size="1">1</array>
                  <module cmlx:templateRef="l601.grossorbpop">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="80">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</array>
                     <array dataType="xsd:string" delimiter="|" dictRef="x:label" size="80">1   O  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|2   C  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|3   C  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|4   C  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|5   C  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|6   C  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|7   H  1S|2S|8   H  1S|2S|9   H  1S|2S|10  H  1S|2S|11  H  1S|2S|12  H  1S|2S|13  H  1S|2S|14  H  1S|2S|15  H  1S|2S|16  H  1S|2S</array>
                     <matrix cols="1" dataType="xsd:double" dictRef="g:totaloccup" rows="80">1.13257 0.85906 0.97030 0.93727 1.11195 0.99524 1.27045 0.30566 0.26120 0.41160 1.17432 0.81405 0.76895 0.47588 0.84151 0.82966 0.93459 -0.02334 0.06725 0.15338 1.17430 0.81415 0.73197 0.52413 0.86485 0.86467 0.90533 0.02892 0.02472 0.15552 1.17425 0.81426 0.76312 0.58364 0.93278 0.75438 0.96588 0.14201 0.07117 0.19365 1.17422 0.81432 0.72627 0.67816 0.91176 0.88947 0.92150 0.21197 0.15821 0.22063 1.17422 0.81431 0.72683 0.68241 0.90890 0.89665 0.91859 0.20954 0.16860 0.21224 0.52536 0.23356 0.51849 0.26264 0.52081 0.26472 0.52065 0.26601 0.51477 0.27733 0.51475 0.26659 0.51584 0.26347 0.51473 0.28141 0.51489 0.26841 0.51394 0.24756</matrix>
                  </module>
                  <list cmlx:templateRef="multipole" dictRef="cc:multipole">
                     <array dataType="xsd:double" dictRef="cc:dipole" size="3">-1.0555 1.7977 -0.5621</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">2.1591</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-39.2478 -39.4429 -36.3364</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">4.2049 -1.3060 0.9061</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">-0.9054 -1.1005 2.0059 4.2049 -1.3060 0.9061</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">11.5548 -3.8366 -0.9032 4.4783 6.4488 -0.1973 4.5475 -0.5489 1.3455 0.8275</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-520.5311 -250.6748 -79.0117 6.7258 -10.7515 -3.9297 -1.0129 1.8075 -1.0737 -135.6090 -97.2870 -56.1254 -1.3774 -0.0617 -1.0555</array>
                  </list>
               </module>
               <module cmlx:templateRef="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.orient">
                     <molecule cmlx:templateRef="atom"
                               formalCharge="0"
                               id="mol.l202.orient"
                               spinMultiplicity="1">
                        <atomArray>
                           <atom elementType="O"
                                 id="a1"
                                 x3="1.613165"
                                 y3="-0.865777"
                                 z3="0.014334">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a2"
                                 x3="0.528654"
                                 y3="0.069077"
                                 z3="-0.480611">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a3"
                                 x3="-0.783203"
                                 y3="0.055324"
                                 z3="0.291587">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a4"
                                 x3="1.789499"
                                 y3="0.634732"
                                 z3="0.09537">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a5"
                                 x3="-1.604433"
                                 y3="1.323598"
                                 z3="-0.047198">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a6"
                                 x3="-1.570935"
                                 y3="-1.23968"
                                 z3="-0.015199">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a7"
                                 x3="0.427012"
                                 y3="0.055437"
                                 z3="-1.577641">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a8"
                                 x3="-0.533518"
                                 y3="0.06552"
                                 z3="1.371904">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a9"
                                 x3="2.562178"
                                 y3="1.045113"
                                 z3="-0.566761">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a10"
                                 x3="1.773619"
                                 y3="1.039498"
                                 z3="1.116232">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a11"
                                 x3="-1.847229"
                                 y3="1.359502"
                                 z3="-1.126774">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a12"
                                 x3="-2.558982"
                                 y3="1.329515"
                                 z3="0.509725">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a13"
                                 x3="-1.052551"
                                 y3="2.246816"
                                 z3="0.208918">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a14"
                                 x3="-1.845098"
                                 y3="-1.290288"
                                 z3="-1.086775">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a15"
                                 x3="-2.505119"
                                 y3="-1.282719"
                                 z3="0.574158">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a16"
                                 x3="-0.964958"
                                 y3="-2.130369"
                                 z3="0.22723">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a2" order="S"/>
                           <bond atomRefs2="a1 a4" order="S"/>
                           <bond atomRefs2="a2 a3" order="S"/>
                           <bond atomRefs2="a2 a4" order="S"/>
                           <bond atomRefs2="a2 a7" order="S"/>
                           <bond atomRefs2="a3 a5" order="S"/>
                           <bond atomRefs2="a3 a6" order="S"/>
                           <bond atomRefs2="a3 a8" order="S"/>
                           <bond atomRefs2="a4 a10" order="S"/>
                           <bond atomRefs2="a4 a9" order="S"/>
                           <bond atomRefs2="a5 a11" order="S"/>
                           <bond atomRefs2="a5 a13" order="S"/>
                           <bond atomRefs2="a5 a12" order="S"/>
                           <bond atomRefs2="a6 a14" order="S"/>
                           <bond atomRefs2="a6 a15" order="S"/>
                           <bond atomRefs2="a6 a16" order="S"/>
                        </bondArray>
                        <formula concise="C 5 H 10 O 1"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">76.05290000000001</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1S/C5H10O/c1-4(2)5-3-6-5/h4-5H,3H2,1-2H3">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:5,6,4,3,2,1/E:(1,2)/rA:16OCCCCCHHHHHHHHHH/rB:s1;s2;s1s2;s3;s3;s2;s3;s4;s4;s5;s5;s5;s6;s6;s6;/rC:;;;;;;;;;;;;;;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
                  <module cmlx:templateRef="l202.distmat">
                     <array dataType="xsd:double" dictRef="cc:distance" size="136">0.000000 1.514954 0.000000 2.582223 1.522317 0.000000 1.513007 1.497146 2.644430 0.000000 3.892311 2.512316 1.548455 3.466069 0.000000 3.206114 2.517485 1.546504 3.849437 2.563697 0.000000 2.188602 1.101813 2.226799 2.234036 2.842052 2.847867 0.000000 2.705284 2.135424 1.108843 2.711079 2.177951 2.168833 3.102021 0.000000 2.211288 2.257273 3.592772 1.097206 4.208105 4.754694 2.561302 3.781713 0.000000 2.206807 2.245342 2.861115 1.098293 3.584065 4.202479 3.168387 2.517317 1.858580 0.000000 4.269463 2.779846 2.201086 3.904448 1.107124 2.840367 2.660082 3.105418 4.455931 4.271302 0.000000 4.740414 3.478932 2.196483 4.423087 1.105152 2.802239 3.859603 2.538413 5.240800 4.384449 1.784831 0.000000 4.102699 2.778166 2.209529 3.269397 1.105667 3.531941 3.191088 2.525863 3.887420 3.204384 1.789669 1.789207 0.000000 3.654071 2.801787 2.199586 4.279424 2.823304 1.107250 2.685965 3.098962 5.014837 4.834900 2.650093 3.149891 3.849424 0.000000 4.177021 3.484777 2.198909 4.727536 2.826696 1.105393 3.875344 2.518205 5.691923 4.898381 3.210502 2.613584 3.834185 1.787285 0.000000 2.879451 2.751269 2.194181 3.905151 3.523369 1.104222 3.157987 2.513632 4.811942 4.282311 3.845897 3.819884 4.378100 1.790807 1.791916 0.000000</array>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">5.7588577 2.5672304 1.9542553</array>
                  </module>
               </module>
               <module cmlx:templateRef="l302">
                  <module cmlx:templateRef="l302.basis2">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="5">Precomputing XC quadrature grid using</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">IXCGrd= 4 IRadAn= 0 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">NSgBfM= 80 80 80 80 80 MxSgAt= 16 MxSgA2= 16.</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l301">
                  <module cmlx:templateRef="l301.basis">
                     <scalar dataType="xsd:string" dictRef="cc:basis">SDD</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:diffuse">(6D, 10F)</scalar>
                     <module cmlx:templateRef="ernie">
                        <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                        <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                        <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                     </module>
                     <scalar dataType="xsd:string" dictRef="g:misc">IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX=  0.000000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  1.000000  1.000000  1.000000  1.000000 ScalE2=  1.000000  1.000000</scalar>
                     <module cmlx:templateRef="natoms">
                        <scalar dataType="xsd:integer" dictRef="cc:natoms">16</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">16</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">16</scalar>
                        <scalar dataType="xsd:double" dictRef="g:sfac">1.00e+00</scalar>
                        <scalar dataType="xsd:integer" dictRef="g:natfmm">60</scalar>
                        <scalar dataType="xsd:string" dictRef="g:big">F</scalar>
                     </module>
                  </module>
               </module>
               <module cmlx:templateRef="l301">
                  <module cmlx:templateRef="l301.basis">
                     <scalar dataType="xsd:string" dictRef="cc:basis">SDD</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:diffuse">(6D, 10F)</scalar>
                     <module cmlx:templateRef="ernie">
                        <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                        <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                        <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                     </module>
                     <scalar dataType="xsd:string" dictRef="g:misc">IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX=  0.000000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  1.000000  1.000000  1.000000  1.000000 ScalE2=  1.000000  1.000000</scalar>
                     <module cmlx:templateRef="natoms">
                        <scalar dataType="xsd:integer" dictRef="cc:natoms">16</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">16</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">16</scalar>
                        <scalar dataType="xsd:double" dictRef="g:sfac">1.00e+00</scalar>
                        <scalar dataType="xsd:integer" dictRef="g:natfmm">60</scalar>
                        <scalar dataType="xsd:string" dictRef="g:big">F</scalar>
                     </module>
                  </module>
               </module>
               <module cmlx:templateRef="l301">
                  <module cmlx:templateRef="l301.basis">
                     <scalar dataType="xsd:string" dictRef="cc:basis">SDD</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:diffuse">(6D, 10F)</scalar>
                     <module cmlx:templateRef="ernie">
                        <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                        <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                        <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                     </module>
                     <scalar dataType="xsd:string" dictRef="g:misc">IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX=  0.000000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  1.000000  1.000000  1.000000  1.000000 ScalE2=  1.000000  1.000000</scalar>
                     <module cmlx:templateRef="natoms">
                        <scalar dataType="xsd:integer" dictRef="cc:natoms">16</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">16</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">16</scalar>
                        <scalar dataType="xsd:double" dictRef="g:sfac">1.00e+00</scalar>
                        <scalar dataType="xsd:integer" dictRef="g:natfmm">60</scalar>
                        <scalar dataType="xsd:string" dictRef="g:big">F</scalar>
                     </module>
                  </module>
               </module>
               <module cmlx:templateRef="l301">
                  <module cmlx:templateRef="l301.basis">
                     <scalar dataType="xsd:string" dictRef="cc:basis">SDD</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:diffuse">(6D, 10F)</scalar>
                     <module cmlx:templateRef="ernie">
                        <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                        <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                        <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                     </module>
                     <scalar dataType="xsd:string" dictRef="g:misc">IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX=  0.000000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  1.000000  1.000000  1.000000  1.000000 ScalE2=  1.000000  1.000000</scalar>
                     <module cmlx:templateRef="natoms">
                        <scalar dataType="xsd:integer" dictRef="cc:natoms">16</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">16</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">16</scalar>
                        <scalar dataType="xsd:double" dictRef="g:sfac">1.00e+00</scalar>
                        <scalar dataType="xsd:integer" dictRef="g:natfmm">60</scalar>
                        <scalar dataType="xsd:string" dictRef="g:big">F</scalar>
                     </module>
                  </module>
               </module>
               <module cmlx:templateRef="l302">
                  <module cmlx:templateRef="l302.basis">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="11">NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="5">One-electron integrals computed using PRISM.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="6">1 Symmetry operations used in ECPInt.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">ECPInt: NShTT= 1596 NPrTT= 7906 LenC2= 1579 LenP2D= 6058.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="6">LDataN: DoStor=T MaxTD1= 2 Len= 12</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NBasis= 80 RedAO= T EigKep= 3.60D-03 NBF= 80</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="7">NBsUse= 80 1.00D-06 EigRej= -1.00D+00 NBFU= 80</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l302.basis2">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="5">Precomputing XC quadrature grid using</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">IXCGrd= 4 IRadAn= 0 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">NSgBfM= 80 80 80 80 80 MxSgAt= 16 MxSgA2= 16.</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l303.basis">
                  <list cmlx:templateRef="l303">
                     <scalar dataType="xsd:integer" dictRef="g:dipdrv">1</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l401"/>
               <module cmlx:templateRef="l502">
                  <scalar dataType="xsd:string" dictRef="g:l502.type">Closed</scalar>
                  <module cmlx:templateRef="l502.cycle">
                     <list cmlx:templateRef="cycle">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="cc:cycle">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:pass">0</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:idiag">1</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="l502.e">
                        <list cmlx:templateRef="l502.e">
                           <scalar dataType="xsd:double" dictRef="g:l502.e">-271.180980044616</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.229658295829</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.048678251213</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.326840544726</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.097182248897</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.328189056487</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.001348511761</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331012603438</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.002823546951</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331084295858</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000071692420</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331086014470</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000001718612</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331057510127</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000028504344</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331057577453</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000067326</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331057575992</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000000001461</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331057586488</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000010496</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331057586705</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000218</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331057586752</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000047</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331057586754</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000003</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331057586752</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000000000002</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <module cmlx:templateRef="l502.footer">
                     <list cmlx:templateRef="scfdone">
                        <list>
                           <scalar dataType="xsd:double" dictRef="g:rbhflyp" units="nonsi:hartree">-271.331057587</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:ncycle">15</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="scfdone">
                        <list cmlx:templateRef="scfdone">
                           <list>
                              <scalar dataType="xsd:double" dictRef="cc:kinener">2.704726737811e+02</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:potener">-1.129107399437e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:eener">3.389173482643e+02</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <list cmlx:templateRef="l502">
                     <scalar dataType="xsd:string" dictRef="g:l502">Using DIIS extrapolation, IDIIS=  1040.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Two-electron integral symmetry not used.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Keep J ints in memory in canonical form, NReq=6192188.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">IVT=       38742 IEndB=       38742 NGot=   939524096 MDV=   934234935</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">LenX=   934234935 LenY=   934228094</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on RMS density matrix=1.00D-08 within 128 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on MAX density matrix=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on             energy=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">No special actions if energy rises.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">FoFCou: FMM=F IPFlag=           0 FMFlag=           0 FMFlg1=           0</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NFxFlg=           0 DoJE=F BraDBF=F KetDBF=F FulRan=T</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">wScrn=  0.000000 ICntrl=     600 IOpCl=  0 I1Cent=           0 NGrid=           0</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NMat0=    1 NMatS0=   3240 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Symmetry not used in FoFCou.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Integral accuracy reduced to 1.0D-05 until final iterations.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502"/>
                  </list>
               </module>
               <module cmlx:templateRef="l716.dipole">
                  <array cmlx:templateRef="dipole"
                         dataType="xsd:double"
                         dictRef="x:d"
                         size="3">-4.15261535e-01 7.07254712e-01 -2.21157702e-01</array>
               </module>
               <module cmlx:templateRef="l716.forces">
                  <list cmlx:templateRef="force">
                     <array dataType="xsd:integer" dictRef="x:serial" size="16">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16</array>
                     <array dataType="xsd:integer" dictRef="x:elementType" size="16">8 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1</array>
                     <list>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.039776507 -0.061970336 0.016055378</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.048285864 0.020998300 0.004269236</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.003748692 0.004550802 -0.007660304</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.004694232 0.036848612 -0.003901285</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000370230 0.005155688 -0.000484196</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.001776156 -0.006073264 0.000600115</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.001377204 -0.005363654 -0.013917491</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.006472540 -0.000533544 0.005063720</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.010153653 0.001379393 -0.005530100</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000599162 0.003448706 0.010842353</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.002694889 0.000540730 -0.006916565</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.006237687 0.000442121 0.002468500</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.002801674 0.006575170 0.001739666</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.002598001 0.000551614 -0.007071516</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.005919506 -0.000386389 0.002874279</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.002661606 -0.006163948 0.001568210</array>
                     </list>
                  </list>
                  <list cmlx:templateRef="cartesianforce">
                     <scalar dataType="xsd:double" dictRef="cc:maxforce">0.061970336</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:rmsforce">0.015060392</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l716">
                  <list cmlx:templateRef="l716">
                     <scalar dataType="xsd:string" dictRef="g:l716">(Enter /mnt/data/applications/G09/g09/l716.exe)</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l502">
                  <scalar dataType="xsd:string" dictRef="g:l502.type">Closed</scalar>
                  <module cmlx:templateRef="l502.cycle">
                     <list cmlx:templateRef="cycle">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="cc:cycle">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:pass">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:idiag">1</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="l502.e">
                        <list cmlx:templateRef="l502.e">
                           <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342055861293</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342079148334</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000023287041</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342077408325</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000001740009</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342079592918</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000002184593</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342079634320</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000041402</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342079637645</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000003325</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342079637699</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000054</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342079637702</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000003</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342079637702</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000000000000</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <module cmlx:templateRef="l502.footer">
                     <list cmlx:templateRef="scfdone">
                        <list>
                           <scalar dataType="xsd:double" dictRef="g:rbhflyp" units="nonsi:hartree">-271.342079638</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:ncycle">9</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="scfdone">
                        <list cmlx:templateRef="scfdone">
                           <list>
                              <scalar dataType="xsd:double" dictRef="cc:kinener">2.699635145768e+02</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:potener">-1.118425394192e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:eener">3.339632734327e+02</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <list cmlx:templateRef="l502">
                     <scalar dataType="xsd:string" dictRef="g:l502">Using DIIS extrapolation, IDIIS=  1040.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Two-electron integral symmetry not used.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Keep J ints in memory in canonical form, NReq=6192188.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">IVT=       38742 IEndB=       38742 NGot=   939524096 MDV=   934234935</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">LenX=   934234935 LenY=   934228094</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on RMS density matrix=1.00D-08 within 128 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on MAX density matrix=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on             energy=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">No special actions if energy rises.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">FoFCou: FMM=F IPFlag=           0 FMFlag=           0 FMFlg1=           0</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NFxFlg=           0 DoJE=F BraDBF=F KetDBF=F FulRan=T</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">wScrn=  0.000000 ICntrl=     600 IOpCl=  0 I1Cent=           0 NGrid=           0</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NMat0=    1 NMatS0=   3240 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Symmetry not used in FoFCou.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502"/>
                  </list>
               </module>
               <module cmlx:templateRef="l716">
                  <list cmlx:templateRef="l716">
                     <scalar dataType="xsd:string" dictRef="g:l716">(Enter /mnt/data/applications/G09/g09/l716.exe)</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l601.kinetic">
                  <module>
                     <scalar dataType="xsd:string" dictRef="g:spintype">alpha</scalar>
                     <array dataType="xsd:integer" dictRef="x:serial" size="80">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</array>
                     <array dataType="xsd:string" dictRef="x:label" size="80">O O O O O O O O O O O O O O O O O O O O O O O O V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V</array>
                     <array dataType="xsd:double" dictRef="g:orbitalener" size="80">-18.764983 -9.949297 -9.944304 -9.910398 -9.889774 -9.881861 -0.952055 -0.725719 -0.618749 -0.607102 -0.569136 -0.511049 -0.436805 -0.422957 -0.388687 -0.370003 -0.360831 -0.339298 -0.323856 -0.306521 -0.297432 -0.291449 -0.261062 -0.206497 0.032773 0.047952 0.086633 0.103243 0.117157 0.118080 0.129340 0.139614 0.161605 0.171179 0.187477 0.193624 0.197734 0.215120 0.229402 0.239318 0.262600 0.278565 0.297352 0.315099 0.318378 0.330309 0.334161 0.376094 0.385529 0.414421 0.438977 0.443107 0.462233 0.482976 0.528932 0.637088 0.771912 0.811509 0.835043 0.840224 0.929644 0.955174 0.988294 1.035820 1.051749 1.074272 1.098908 1.127545 1.142266 1.155738 1.230022 1.275957 1.363618 1.620377 22.408140 22.534211 22.616757 22.628169 22.666608 41.492836</array>
                     <array dataType="xsd:double" dictRef="g:kineticener" size="80">29.118636 15.957486 15.957613 15.959032 15.957319 15.957149 2.307966 1.418733 1.421605 1.866255 1.451690 1.243640 1.342799 1.121132 1.093959 1.153567 1.163442 1.012185 1.620137 1.294819 1.399510 1.146465 1.741216 2.275402 2.023040 2.045590 1.072011 1.036949 1.186547 1.021829 1.088566 1.261430 0.947449 1.265686 1.114123 1.172589 1.306156 1.311227 0.999901 1.368725 1.153366 1.428339 1.696194 1.709475 1.401581 1.649439 1.136752 1.957284 1.667068 1.934724 1.933375 2.674929 2.101696 2.186220 1.586785 2.344996 2.414642 2.736451 2.751392 2.801213 3.084341 3.170375 2.936440 2.639314 2.784738 2.596451 2.598655 2.591560 2.631242 2.578857 2.658444 2.641453 2.872983 5.096804 57.415086 57.401354 57.389535 57.397374 57.375366 105.848490</array>
                  </module>
                  <scalar dataType="xsd:string" dictRef="g:totalkineticener">2.699635145768D+02</scalar>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:jobtime">
                  <scalar dataType="xsd:string">PT207.500S</scalar>
               </property>
               <property dictRef="cc:jobdatetime.end">
                  <scalar dataType="xsd:date">2017-07-26T19:40:33.000+02:00</scalar>
               </property>
               <property>
                  <module cmlx:templateRef="l601.mullik">
                     <scalar dataType="xsd:string" dictRef="g:title">Mulliken charges:</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:serial">1</scalar>
                     <list cmlx:templateRef="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="16">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="16">O C C C C C H H H H H H H H H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="16">-0.255303 -0.036235 -0.088556 -0.395158 -0.706527 -0.712277 0.241083 0.218865 0.214467 0.213340 0.207895 0.218653 0.220689 0.203863 0.216705 0.238498</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">0.00000</scalar>
                  </module>
               </property>
               <property dictRef="cc:popanal">
                  <module cmlx:templateRef="l601.popanal">
                     <array dataType="xsd:double" dictRef="g:alphaocc" size="19">-9.88186 -0.95206 -0.72572 -0.61875 -0.60710 -0.56914 -0.51105 -0.43680 -0.42296 -0.38869 -0.37000 -0.36083 -0.33930 -0.32386 -0.30652 -0.29743 -0.29145 -0.26106 -0.20650</array>
                     <array dataType="xsd:double" dictRef="g:alphavirt" size="56">0.03277 0.04795 0.08663 0.10324 0.11716 0.11808 0.12934 0.13961 0.16161 0.17118 0.18748 0.19362 0.19773 0.21512 0.22940 0.23932 0.26260 0.27856 0.29735 0.31510 0.31838 0.33031 0.33416 0.37609 0.38553 0.41442 0.43898 0.44311 0.46223 0.48298 0.52893 0.63709 0.77191 0.81151 0.83504 0.84022 0.92964 0.95517 0.98829 1.03582 1.05175 1.07427 1.09891 1.12755 1.14227 1.15574 1.23002 1.27596 1.36362 1.62038 22.40814 22.53421 22.61676 22.62817 22.66661 41.49284</array>
                     <module cmlx:templateRef="l601.orbital.closedshell">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="80">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</array>
                        <array dataType="xsd:string"
                               delimiter="|"
                               dictRef="cc:occupation"
                               size="80">O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V</array>
                        <array dataType="xsd:double" dictRef="cc:eigenvalues" size="80">-18.76498 -9.94930 -9.94430 -9.91040 -9.88977 -9.88186 -0.95206 -0.72572 -0.61875 -0.60710 -0.56914 -0.51105 -0.43680 -0.42296 -0.38869 -0.37000 -0.36083 -0.33930 -0.32386 -0.30652 -0.29743 -0.29145 -0.26106 -0.20650 0.03277 0.04795 0.08663 0.10324 0.11716 0.11808 0.12934 0.13961 0.16161 0.17118 0.18748 0.19362 0.19773 0.21512 0.22940 0.23932 0.26260 0.27856 0.29735 0.31510 0.31838 0.33031 0.33416 0.37609 0.38553 0.41442 0.43898 0.44311 0.46223 0.48298 0.52893 0.63709 0.77191 0.81151 0.83504 0.84022 0.92964 0.95517 0.98829 1.03582 1.05175 1.07427 1.09891 1.12755 1.14227 1.15574 1.23002 1.27596 1.36362 1.62038 22.40814 22.53421 22.61676 22.62817 22.66661 41.49284</array>
                        <matrix cols="80"
                                dataType="xsd:double"
                                dictRef="g:orbitalcoeff"
                                rows="80">0.58056 0.00000 0.00000 0.00000 0.00000 0.00000 -0.11089 0.02614 -0.02907 -0.06814 0.00859 -0.01671 -0.03359 -0.01784 -0.01311 -0.00944 0.01788 -0.00414 0.00891 0.01334 -0.00315 -0.00081 -0.02552 0.00057 -0.04765 -0.02014 0.00216 0.01008 0.00601 -0.00552 -0.00286 0.00321 0.00150 0.00854 -0.00509 -0.00190 -0.01261 -0.00116 0.00132 0.01172 -0.00580 -0.00262 0.01355 -0.00154 -0.00021 -0.01053 0.00276 -0.00532 -0.00649 -0.00271 0.00341 0.01185 0.01176 -0.00557 0.00062 0.03367 -0.00910 0.00017 0.00210 0.00193 -0.00864 -0.00654 0.00998 -0.01234 -0.00290 -0.00918 -0.00090 0.00339 -0.00269 -0.00461 -0.03056 -0.00133 -0.01904 0.14695 0.00029 0.00104 0.00003 0.00196 -0.00081 -1.73057 0.45934 0.00000 -0.00001 0.00001 0.00002 -0.00002 -0.14703 0.03479 -0.03876 -0.09085 0.01145 -0.02235 -0.04485 -0.02376 -0.01751 -0.01265 0.02394 -0.00550 0.01194 0.01791 -0.00424 -0.00103 -0.03441 0.00092 -0.06302 -0.02663 0.00319 0.01401 0.00799 -0.00747 -0.00453 0.00487 0.00179 0.01184 -0.00652 -0.00287 -0.01711 -0.00192 0.00176 0.01659 -0.00723 -0.00407 0.01910 -0.00391 0.00042 -0.01570 0.00307 -0.00622 -0.00823 -0.00644 0.00651 0.01633 0.01500 -0.00859 -0.00105 0.04746 -0.01323 0.00095 0.00345 0.00288 -0.01460 -0.01081 0.01736 -0.02026 -0.00459 -0.01418 -0.00084 0.00479 -0.00444 -0.00748 -0.04960 -0.00248 -0.02997 0.24451 0.00002 -0.00019 -0.00001 -0.00040 0.00019 1.88465 0.00847 0.00010 0.00021 -0.00003 -0.00021 0.00016 0.42073 -0.10128 0.11345 0.26583 -0.03324 0.06663 0.13152 0.06845 0.05171 0.03794 -0.07174 0.01569 -0.03577 -0.05484 0.01338 0.00228 0.10890 -0.00625 0.16254 0.06807 -0.01597 -0.05203 -0.01983 0.02282 0.02955 -0.02861 0.00030 -0.04359 0.01039 0.01515 0.05301 0.01507 -0.00363 -0.06729 0.00462 0.02419 -0.07648 0.05962 -0.02151 0.08423 0.00861 -0.00441 0.00892 0.09148 -0.06736 -0.05295 -0.01796 0.05295 0.05572 -0.17756 0.07494 -0.02006 -0.02246 -0.02027 0.12274 0.08470 -0.16686 0.15643 0.02945 0.08500 -0.00715 -0.01750 0.03271 0.05432 0.36801 0.02953 0.20021 -2.07879 -0.00934 -0.00785 0.00021 -0.01253 0.00267 -0.44555 -0.00628 0.00119 0.00045 -0.00067 0.00047 -0.00045 0.35862 -0.10213 0.12491 0.30224 -0.03969 0.07139 0.16376 0.09260 0.05237 0.05263 -0.08453 0.02383 -0.04587 -0.05550 0.01815 0.00107 0.09372 0.02189 0.73982 0.32176 0.04183 -0.07849 -0.11963 0.08402 -0.08698 0.11823 -0.05542 -0.02946 0.15176 -0.00855 0.20520 -0.06517 -0.03734 -0.06072 0.29723 -0.04375 -0.08780 -0.38900 0.17866 -0.12077 -0.19028 0.27755 0.22975 -0.53783 0.31820 -0.22237 -0.54478 -0.11225 -0.65042 -0.46794 -0.41988 0.14601 -0.11763 0.09285 -0.33220 -0.16584 0.68213 -0.25322 0.04232 0.01282 0.06460 -0.15943 -0.00919 -0.09496 -0.40226 -0.19188 0.12867 3.45231 -0.03459 -0.02236 -0.03305 0.03602 0.04085 0.46600 -0.00056 0.00012 -0.00017 0.00010 0.00007 -0.00003 -0.06333 -0.01893 -0.01472 0.01420 0.11864 0.05207 0.17173 -0.01012 -0.03639 0.19254 0.00078 0.05766 0.35511 -0.11423 -0.16823 0.12691 0.17533 -0.30470 0.01214 -0.40292 -0.06826 0.04671 0.09883 -0.03444 -0.06158 0.11800 0.00555 -0.01309 -0.09100 -0.01468 -0.07245 0.07068 0.00861 0.04101 0.02917 -0.05215 -0.01369 0.07982 0.04508 -0.08312 -0.04808 0.06416 0.06241 -0.22542 -0.01877 -0.14599 -0.05526 -0.13283 -0.10224 -0.20902 0.08634 -0.63728 0.26372 -0.22004 0.08420 0.11201 -0.21690 -0.05793 -0.08167 -0.04030 -0.16242 0.05958 0.14142 -0.05919 0.00327 -0.03935 -0.07436 0.04551 0.00045 0.00806 -0.00416 0.00284 -0.00411 0.00454 0.00149 0.00004 -0.00011 -0.00006 0.00006 -0.00004 0.16880 -0.02469 -0.03017 -0.04441 0.06407 -0.01344 -0.16402 -0.11462 -0.18019 0.04937 0.16735 -0.01559 0.23878 0.12493 -0.09479 -0.00377 -0.33374 0.01024 0.47734 0.02485 -0.05812 -0.01363 -0.03046 0.06787 -0.01502 0.00901 0.02368 -0.01984 -0.03533 0.06461 0.13259 0.07945 0.01827 -0.00720 -0.00952 -0.02961 -0.06380 0.23437 -0.19239 0.18291 0.09054 0.04175 -0.13336 0.08321 -0.14480 0.07979 0.11776 -0.03742 -0.06944 0.44798 -0.47290 -0.29769 -0.14459 -0.08654 -0.05872 0.08534 0.13253 -0.08151 -0.05294 -0.00262 -0.13774 -0.00109 0.08006 -0.02907 0.03099 -0.01020 0.08488 -0.07746 -0.00108 0.00058 -0.00341 0.00358 0.00364 -0.00935 -0.00027 0.00008 -0.00006 0.00001 -0.00004 0.00003 -0.02839 0.00156 -0.00285 0.00596 0.04691 0.11313 -0.04412 0.14393 -0.05066 0.03777 -0.03009 0.03270 0.14803 -0.09128 -0.16805 0.01381 0.09900 0.63132 0.00456 -0.19265 -0.08085 -0.01515 0.07435 -0.07380 0.00283 -0.00963 -0.04441 0.11533 0.02241 0.09881 -0.02206 0.01142 0.03263 0.00490 -0.05702 0.02978 -0.01595 -0.09573 -0.03103 -0.03261 0.10628 -0.13553 0.11837 0.03452 -0.19835 0.01586 0.02776 0.10672 -0.11825 -0.17478 0.14107 -0.01768 -0.55886 -0.56419 -0.06114 -0.09682 0.08814 -0.08311 -0.07240 -0.00556 -0.04923 -0.01121 -0.08805 -0.03982 0.00124 -0.03132 0.00626 0.03726 -0.00031 0.00144 -0.00290 -0.00241 0.00021 0.00370 0.00093 -0.00087 0.00110 0.00011 -0.00042 0.00055 -0.01549 -0.00310 -0.00448 0.00572 0.02796 0.01639 0.05420 -0.00416 -0.00597 0.06374 -0.01064 0.01716 0.11450 -0.04354 -0.05789 0.04470 0.08924 -0.16395 0.05581 -0.40135 -0.15275 0.04407 0.20019 0.00988 -0.07202 0.13826 0.00729 -0.01442 -0.15724 -0.02774 -0.05244 -0.01697 0.04147 0.03504 -0.01382 0.10048 0.09823 0.07371 0.15722 -0.16416 0.07725 -0.06882 -0.07585 0.24556 -0.21675 -0.01177 0.29219 0.01006 0.25591 0.51254 -0.01816 1.09323 -0.65822 0.75637 -0.44648 -0.33679 0.19838 0.35424 0.38771 -0.09396 0.34620 0.00159 -0.58043 0.14690 -0.17344 0.41544 -0.19898 -0.58124 -0.00476 -0.03508 0.06222 -0.02913 -0.01112 -0.05502 -0.00195 -0.00076 -0.00016 -0.00010 -0.00019 -0.00003 0.02910 -0.00338 -0.00858 -0.01004 0.01421 -0.00386 -0.04913 -0.03658 -0.06453 0.01146 0.06324 -0.00917 0.08606 0.06345 -0.03965 -0.00442 -0.17794 -0.00034 0.43693 0.00258 -0.13337 0.02483 -0.03207 0.04289 -0.01389 0.01311 -0.03678 -0.04548 0.00294 0.06335 0.06458 -0.01747 -0.02127 -0.08800 0.04012 0.04644 -0.03911 -0.05112 0.10941 -0.02020 0.00586 0.04193 0.07435 -0.05450 -0.10696 -0.15730 -0.06771 -0.00149 0.03225 -1.05034 0.87310 0.50620 0.28474 0.44347 -0.16144 -0.24360 -0.05793 0.16007 0.20885 0.03538 0.34146 0.04138 -0.24153 0.16281 -0.18166 0.09843 -0.23648 0.88268 0.01734 -0.01096 0.01857 -0.00444 -0.00540 0.09852 0.00043 -0.00027 0.00047 -0.00006 0.00022 0.00001 -0.00520 -0.00060 0.00223 -0.00027 0.01096 0.02757 -0.01044 0.04212 -0.01056 0.00468 -0.01242 0.01238 0.04967 -0.03561 -0.06386 0.00637 0.05630 0.31274 0.03672 -0.16102 -0.12079 0.02484 0.08521 -0.05672 -0.03983 -0.02315 -0.04921 0.15266 0.00431 0.15275 -0.03136 0.03063 0.04237 0.02368 -0.13069 -0.06727 0.06878 -0.17803 -0.14818 -0.10375 0.22479 -0.03047 -0.06067 -0.09197 -0.09217 0.07283 -0.06370 0.00316 0.04352 0.26741 -0.25953 0.00241 1.03837 1.30624 -0.01616 0.19580 -0.37975 0.36245 0.26267 -0.02074 0.20194 0.07475 0.23786 0.16262 -0.03907 0.22409 0.05899 -0.21708 -0.00221 -0.01055 0.02627 0.00790 0.00107 -0.02619 0.00001 0.60037 -0.00778 -0.00078 0.00008 0.00006 -0.05471 -0.04049 0.02154 0.06294 0.06181 0.04874 0.01669 -0.00333 -0.00372 0.00859 0.01400 -0.00138 0.00245 0.01219 0.02041 0.00498 -0.00085 0.00278 0.03026 0.01147 0.02106 0.02641 -0.06657 -0.00094 0.01271 -0.03883 -0.00348 0.01009 0.00258 -0.00379 0.00835 -0.01246 -0.02203 0.01387 -0.00105 0.00283 0.01548 -0.01820 -0.00443 0.02759 -0.00898 0.00593 -0.02143 0.05607 0.03389 0.00284 -0.01721 0.00928 -0.01532 0.04594 0.05466 -0.02814 -0.02305 -0.00217 -0.03243 -0.00105 -0.07617 0.04433 0.03870 -0.04095 -0.00821 0.00900 -0.02067 -0.01194 -0.02271 0.03751 -0.00853 0.00623 -1.10297 0.15910 -1.29805 0.01467 0.42003 -0.00080 0.00000 0.43400 -0.00549 -0.00045 0.00012 0.00011 -0.06868 -0.05108 0.02736 0.07999 0.07871 0.06241 0.02192 -0.00386 -0.00424 0.01109 0.01759 -0.00165 0.00327 0.01539 0.02608 0.00668 -0.00086 0.00371 0.04012 0.01564 0.02743 0.03465 -0.08485 -0.00099 0.01508 -0.05109 -0.00530 0.01402 0.00175 -0.00643 0.01146 -0.01649 -0.02897 0.01840 -0.00222 0.00360 0.02103 -0.02382 -0.00737 0.03723 -0.01112 0.01001 -0.03035 0.07990 0.04830 0.00799 -0.02405 0.01380 -0.02154 0.07337 0.09368 -0.04498 -0.03517 -0.00553 -0.05489 -0.00260 -0.12593 0.07425 0.06317 -0.06930 -0.01461 0.01563 -0.03708 -0.02283 -0.04118 0.06878 -0.02357 0.00815 1.20612 -0.17496 1.43538 -0.01625 -0.46552 0.00111 -0.00002 0.01990 -0.00097 -0.00075 -0.00073 -0.00080 0.19257 0.14431 -0.08052 -0.23331 -0.22476 -0.18647 -0.07507 0.00418 -0.00192 -0.02934 -0.04137 0.00376 0.00163 -0.04011 -0.08031 -0.01943 -0.00840 -0.01234 -0.12505 -0.06731 -0.05930 -0.09515 0.14240 -0.01913 -0.00394 0.13738 0.03998 -0.06447 0.05030 0.06311 -0.05407 0.04905 0.06271 -0.06407 0.02850 -0.00364 -0.08026 0.06577 0.08319 -0.14573 -0.00554 -0.08487 0.17144 -0.44342 -0.23544 -0.13198 0.11532 -0.09617 0.08150 -0.64757 -0.92561 0.39490 0.34637 -0.01319 0.60449 0.04451 1.29387 -0.78143 -0.61173 0.73088 0.17674 -0.19283 0.47630 0.29482 0.50613 -0.96464 0.58500 0.18632 -0.29974 0.02792 -0.45409 0.00802 0.13999 0.01191 0.00162 -0.02157 0.00566 0.00597 0.00212 0.00256 0.05780 0.08534 -0.04329 -0.15746 -0.22092 -0.16357 -0.03406 0.01971 0.10079 -0.10783 -0.13171 0.00124 -0.15328 -0.05718 -0.05392 -0.08669 0.02955 -0.01689 -0.29658 0.11044 -0.72592 -0.91045 2.58593 0.32724 -0.64316 1.32979 -0.34587 0.28232 -0.77069 -0.57461 0.23473 0.10722 1.06459 0.31518 0.24884 -0.29916 -0.30565 -0.09102 -0.54046 -0.27231 0.73989 0.34086 -0.27113 1.06525 0.06882 -0.20699 -0.72127 0.32284 0.73475 1.65749 1.27619 -1.00952 -2.08264 1.74546 -2.24664 -0.16645 -3.74248 2.35707 1.39599 -1.59172 -0.34926 0.68027 -1.69441 -0.45324 -1.11563 2.95186 -2.99833 -1.57314 0.27945 -0.05876 0.89417 -0.03199 -0.39358 -0.14018 0.00017 0.00082 -0.00035 -0.00014 0.00002 0.00009 0.11829 -0.10484 -0.02599 -0.01534 0.11486 -0.10428 -0.19958 -0.24722 -0.07185 -0.03695 0.03216 -0.00980 -0.05822 0.12255 0.27135 0.03679 0.10855 0.05375 -0.20507 -0.09506 -0.13828 0.06361 0.02171 -0.05586 -0.12462 0.03197 -0.09538 0.22789 -0.03186 0.05163 -0.04873 -0.06324 -0.36706 -0.01128 0.11452 -0.00457 0.11760 0.13187 0.04789 -0.07237 -0.07716 -0.18952 0.44313 -0.17278 -0.24640 -0.75206 0.00203 -0.02763 -0.44502 0.32465 -0.04644 0.07499 0.01586 0.08937 -0.17960 -0.00928 0.03712 0.04317 0.25954 -0.11813 0.00680 -0.06325 0.03350 -0.12194 -0.06755 0.05629 0.28468 -0.16788 0.01264 0.00481 0.00130 -0.00209 0.00967 -0.01382 -0.00027 -0.00039 -0.00034 0.00002 0.00005 -0.00006 -0.04993 0.01679 -0.08321 -0.09453 0.07752 0.00485 -0.03297 -0.02505 -0.06702 0.18701 -0.04036 0.06179 0.11654 -0.17640 -0.01337 0.03039 0.37456 -0.00873 -0.01497 0.56527 0.01499 -0.05052 -0.07110 0.13055 -0.05367 -0.03640 -0.02262 -0.08377 0.04553 -0.02244 0.31762 -0.11726 -0.02759 -0.03965 0.00866 0.14713 -0.01967 0.01305 -0.01858 0.15132 0.12691 0.33990 -0.20691 0.15539 -0.70057 -0.15194 0.22654 -0.15972 -0.05241 -0.18503 0.14321 0.01686 0.12838 0.08974 -0.04817 0.03378 -0.00994 -0.03147 -0.00024 0.00024 0.00487 0.00757 -0.00074 0.02102 -0.12829 -0.04783 -0.04446 0.24058 0.00719 0.00821 -0.00503 0.00301 -0.00174 0.02204 0.00007 0.00027 -0.00011 0.00001 -0.00005 0.00000 0.05390 0.02492 -0.00116 -0.00097 0.02326 0.22847 -0.25871 0.08790 -0.07507 0.02654 0.21547 -0.05538 -0.22595 -0.10898 -0.12126 -0.13578 0.04063 -0.09638 -0.08290 -0.04687 0.05861 0.18985 -0.22684 -0.12647 -0.14484 0.21175 -0.05550 -0.19118 -0.10097 -0.19300 -0.05783 -0.10284 -0.11088 0.40500 0.06537 -0.14137 -0.57315 -0.06748 -0.02843 -0.22228 0.18790 -0.05219 0.07216 -0.32976 -0.24735 0.13514 0.01010 -0.00325 0.11486 0.03035 -0.09528 -0.04344 -0.26861 0.18577 -0.05957 0.01954 -0.33031 0.21393 0.06157 0.00681 0.04544 -0.00018 -0.07163 0.01625 0.12001 -0.21659 0.08781 -0.02417 0.00453 0.00108 0.00159 -0.00217 -0.00381 -0.00651 0.00116 -0.00054 0.00578 -0.00321 -0.00118 -0.00171 -0.04448 0.00841 0.00862 0.01648 -0.01716 0.02237 0.04653 -0.00140 0.06572 -0.00548 -0.02663 -0.00176 -0.05058 0.01800 0.07202 -0.00436 0.05519 -0.00857 -0.16330 -0.10158 -1.54231 0.42013 0.01247 0.01917 -0.67147 -0.35923 -0.03071 0.41627 0.01031 0.02670 0.00276 -0.58701 -1.30015 0.80427 -0.95472 0.12627 1.16095 0.82648 -0.92968 0.01472 0.66129 -0.38947 -1.48886 -0.44977 0.27071 0.28524 0.51262 0.16245 4.09128 -0.80371 0.85626 -1.59596 -0.38484 0.06571 -0.39766 -0.03275 1.00314 0.44186 -0.02908 0.83424 0.16888 0.62685 -1.03012 1.90306 0.88742 1.44865 0.35591 -0.44860 -0.07613 -0.26471 0.05976 0.04440 0.08962 -0.09344 -0.00107 0.00006 0.00187 -0.00062 0.00009 -0.00055 0.00452 0.00351 -0.01023 -0.00160 -0.00875 -0.00138 -0.01503 -0.00202 -0.02256 0.04310 0.00510 0.02216 0.04223 -0.03595 -0.03120 0.00598 0.06402 0.09212 -0.04713 0.72392 -0.28912 -0.02784 -0.04031 0.40455 -0.32798 0.04176 -0.18017 0.00593 0.45536 -0.31339 0.06085 -0.00007 -0.23920 -0.14061 0.09951 -0.63270 -0.37628 0.42210 -0.75420 0.36234 -0.68218 0.16334 0.44594 -1.21264 2.04733 -0.22059 -0.89341 -0.43343 0.62722 -0.07363 -0.19907 -0.70087 -1.31559 -1.12922 -0.37564 -0.07820 0.59313 -0.07459 -0.09435 0.14723 -0.45818 -0.41230 -0.32756 0.20841 0.25813 0.21108 0.05494 0.74500 -0.03375 -0.07327 0.02902 0.02712 0.01959 0.08817 0.00143 -0.00433 0.00139 0.00546 -0.00010 -0.00049 -0.04288 -0.00547 0.00328 -0.00238 0.00729 0.06052 -0.03452 0.03436 0.02072 -0.00854 0.05651 -0.01494 -0.06832 -0.03208 -0.06233 -0.08083 0.01159 -0.00282 0.01422 -0.08650 -0.45475 -0.27500 0.67973 -0.08851 0.02870 0.18371 0.02405 -0.83869 -0.82893 -0.91086 -0.33060 0.09724 -0.63134 0.15323 -1.16853 -0.02612 -0.82182 -0.38170 1.15715 0.91408 -1.34861 0.20788 3.23759 3.19738 0.39283 -0.05936 3.99101 -0.87636 2.94021 0.84072 1.50728 -1.14349 -0.03056 -0.50144 -0.05437 -0.06249 0.48335 -1.44692 -0.75896 0.26135 -0.40216 0.29217 0.43940 0.56227 -0.85095 2.44808 -3.83473 -1.63926 -0.04090 0.02092 0.16022 -0.01009 -0.27548 -0.12460 0.00000 0.00078 -0.00013 0.60051 -0.00116 -0.00086 -0.00972 -0.09484 -0.00454 0.00701 0.02905 -0.06468 -0.02791 0.01775 0.01321 -0.00595 -0.01358 0.00185 -0.00253 -0.00451 -0.00100 0.00377 0.00159 0.01094 -0.00168 0.00147 0.01431 0.04260 0.02742 0.03148 0.02886 0.03745 0.01789 -0.01513 -0.01038 -0.01107 -0.00277 0.00432 0.01458 0.00321 0.00991 -0.00765 -0.00715 0.01963 -0.00066 -0.02305 0.00293 0.03296 0.03782 -0.00686 -0.03037 0.07249 -0.02432 0.00354 0.02887 0.00546 0.02691 -0.01505 0.04246 -0.02987 -0.00970 -0.00020 0.07876 0.04004 0.05245 -0.02121 0.00074 -0.00982 -0.01257 -0.01722 -0.00147 0.00953 0.07257 0.00107 -0.63475 0.59309 0.11816 -0.15605 -1.52035 0.00074 0.00001 0.00067 -0.00004 0.43389 -0.00076 -0.00053 -0.01205 -0.11900 -0.00573 0.00891 0.03682 -0.08231 -0.03567 0.02276 0.01699 -0.00763 -0.01760 0.00242 -0.00323 -0.00583 -0.00118 0.00527 0.00203 0.01433 -0.00176 0.00210 0.01965 0.05575 0.03447 0.03925 0.03447 0.04783 0.02241 -0.01900 -0.01358 -0.01455 -0.00361 0.00524 0.01854 0.00485 0.01312 -0.01021 -0.00826 0.02790 -0.00204 -0.03207 0.00471 0.04559 0.05105 -0.01129 -0.04230 0.10301 -0.03506 0.00554 0.04062 0.01037 0.04728 -0.02509 0.07062 -0.04964 -0.01697 -0.00077 0.13210 0.06500 0.08638 -0.03493 0.00159 -0.01717 -0.01837 -0.02853 -0.00571 0.02146 0.13454 0.00451 0.69279 -0.65186 -0.13034 0.17234 1.68227 -0.00138 -0.00004 -0.00057 -0.00058 0.02088 -0.00032 -0.00030 0.02927 0.32467 0.01665 -0.02506 -0.10439 0.23969 0.10466 -0.06454 -0.05066 0.02012 0.05373 -0.00842 0.00607 0.01853 0.00252 -0.02571 -0.00573 -0.04235 -0.00462 -0.00767 -0.09015 -0.15007 -0.03487 -0.03558 0.01877 -0.09415 -0.02378 0.01836 0.02732 0.03030 0.00999 -0.00096 -0.03684 -0.03277 -0.03421 0.02825 -0.00948 -0.15685 0.03822 0.14991 -0.04074 -0.20007 -0.16866 0.11375 0.18647 -0.50351 0.21043 -0.04255 -0.21456 -0.07418 -0.43292 0.19662 -0.77162 0.56352 0.22648 0.03130 -1.36974 -0.60000 -0.83654 0.32946 -0.02667 0.20100 0.11841 0.29458 0.14206 -0.37636 -1.94379 -0.15022 -0.18657 0.21070 0.03831 -0.05613 -0.54068 -0.00279 -0.00047 0.00461 0.00156 -0.02760 0.00315 0.00304 0.03725 0.21743 0.00385 -0.02994 -0.09415 0.18865 0.10342 -0.10354 -0.04136 0.05126 0.05821 0.00003 0.04273 0.00914 -0.00141 0.05663 -0.02365 -0.10506 0.01177 -0.06651 -0.15377 -1.11094 -1.36704 -1.52589 -1.90842 -1.26282 -0.82755 0.82795 0.41534 0.44102 0.10009 -0.28581 -0.31419 0.20332 -0.10433 0.26122 0.67725 0.80792 -0.52216 -0.38683 0.57812 0.04366 -1.61873 -0.92166 0.24472 -0.21352 -1.28717 0.35351 0.76919 -0.96102 -0.41218 0.20231 2.96231 -2.58399 -0.94237 -0.20101 3.92056 1.60047 2.11053 -0.89588 0.02456 -0.62403 -0.35205 -1.05522 -0.27346 0.74347 7.25900 1.12849 0.22952 -0.31645 -0.09821 0.11659 1.18475 0.06182 -0.00009 -0.00001 -0.00021 0.00010 -0.00002 -0.00003 0.02348 -0.00984 -0.03369 -0.11089 -0.14526 0.04093 -0.09308 0.15572 0.17917 0.05374 0.08347 -0.00391 -0.06352 -0.18720 -0.25681 0.13490 -0.09660 -0.13986 0.01651 -0.01018 -0.05875 0.14101 -0.19286 0.06849 0.09335 0.08659 0.06785 0.20628 0.11507 0.14665 0.04190 -0.03400 -0.12624 -0.02843 -0.21489 0.05282 0.09547 -0.05065 -0.02835 0.13919 -0.04124 0.02898 0.22090 0.41585 -0.17275 -0.45609 -0.74050 0.19400 0.35138 0.26646 0.14831 -0.07597 0.03644 -0.02349 0.15469 0.01886 0.12699 -0.22958 -0.14157 0.08094 -0.00232 -0.02121 0.12901 0.03105 0.02944 -0.11462 0.03942 0.09440 0.00668 0.00508 -0.00711 0.00000 -0.00189 0.00807 0.00002 0.00002 0.00003 0.00001 -0.00004 0.00004 -0.00221 0.00654 -0.16305 0.05605 -0.01145 0.00895 -0.01067 -0.00886 -0.04888 0.26950 -0.15433 -0.04259 -0.05471 -0.23617 0.17990 -0.06667 -0.19106 0.02449 0.00413 0.07180 -0.01041 0.03536 0.05487 -0.24223 0.12674 -0.01232 0.04493 -0.02036 -0.28356 0.26974 0.09004 -0.06028 -0.00905 0.03476 -0.02749 -0.05907 0.00701 0.06663 -0.01823 -0.13224 -0.05034 -0.30634 -0.03825 0.07934 0.06840 0.07212 -0.30789 -1.00386 0.05654 0.01016 0.07500 0.14990 -0.15588 -0.08272 -0.09631 0.25391 0.04171 -0.00748 -0.01618 -0.02687 0.02033 -0.07837 0.00013 -0.01436 0.08477 0.02980 0.00359 -0.01130 -0.00025 -0.00123 0.00016 0.00117 0.00106 -0.00141 0.00004 0.00001 0.00008 0.00005 0.00004 0.00005 -0.00844 -0.02991 0.00807 0.02031 0.03564 0.15783 -0.11178 -0.23261 0.17540 -0.02672 -0.06601 0.03421 -0.01045 -0.00310 0.11843 0.35779 -0.02013 0.06877 -0.02542 -0.00585 -0.06702 -0.19559 -0.13320 -0.14432 -0.11231 0.37153 0.09761 0.10457 -0.01901 -0.03300 0.08502 0.04365 0.17596 -0.14755 -0.21756 0.18845 -0.10994 0.07631 0.31266 0.32841 -0.35078 -0.10541 -0.02624 -0.35101 -0.21446 0.45696 -0.09616 0.02556 0.11169 0.12237 0.18899 -0.03660 -0.09501 0.16651 -0.08156 -0.05040 -0.17408 -0.13741 -0.27931 0.10527 0.00802 0.06661 0.04344 0.15969 -0.03761 0.18197 0.09812 -0.02612 -0.00831 0.00179 0.00184 -0.00092 -0.00479 -0.00318 -0.00064 0.00547 0.00113 -0.00225 -0.00184 -0.00192 0.01440 0.00343 0.00429 0.01975 0.00934 -0.00145 -0.01129 0.01876 0.00855 0.01949 0.00890 -0.00210 -0.01735 -0.03998 -0.01710 0.06335 -0.00096 -0.04910 -0.07795 0.02204 -0.52637 1.11317 -1.26948 0.16696 0.05997 0.18922 0.96323 0.72716 1.09248 1.24426 0.35426 0.01151 -0.88422 -0.93317 0.82898 0.13667 1.08171 0.17806 -0.45113 -0.69379 0.42840 0.30399 -1.38186 -2.01360 0.39346 1.26808 -0.41694 -0.08921 -3.80513 -1.40108 -1.34884 0.69350 -0.18998 0.73850 0.30032 0.08923 0.83333 0.99721 0.56250 0.19343 0.49322 -0.13598 -0.08593 0.66618 0.84526 -1.49016 1.42760 0.82201 -0.08369 -0.11534 -0.21681 0.01707 0.09819 0.06361 -0.00018 -0.00038 -0.00005 0.00061 0.00404 -0.00396 0.00046 0.00158 0.01386 -0.01916 0.00930 -0.00259 -0.00321 -0.01650 -0.00369 0.04001 -0.02788 -0.02194 -0.00213 -0.02248 0.05273 0.00048 -0.02199 -0.18575 0.13540 0.19638 -0.08619 0.41180 0.41672 -1.61722 0.81907 0.04176 0.25275 -0.11530 -1.06484 0.91115 0.25516 -0.74393 0.21600 -0.20320 -0.05306 0.82727 0.08986 -0.26344 0.87971 0.33683 1.85090 -0.65006 1.05687 0.64089 -0.17228 0.50586 1.13061 3.01937 -0.78008 -0.26663 -0.15970 -0.67423 1.76216 1.07316 0.24543 0.95139 -0.64710 0.08764 0.15969 0.23143 -0.43781 0.48394 1.04914 -0.26587 1.28756 0.91389 -0.34869 0.42892 -0.00010 0.02890 0.01259 0.23752 -0.04970 0.00913 -0.00067 0.00029 -0.00111 -0.00019 -0.00015 0.00039 0.01328 0.01169 0.00105 0.00483 -0.00011 0.00912 -0.04678 -0.06487 0.02537 -0.01758 -0.03315 0.01343 -0.03755 -0.01496 0.04513 0.10982 0.01454 0.02787 -0.10709 0.07313 0.42163 -0.22381 -0.62709 -0.45392 -0.52440 1.50870 0.42101 1.18056 -0.24407 -0.16469 0.61730 0.52198 2.89946 -0.17596 1.32515 -0.50849 -0.82107 -0.10462 -0.59037 -1.21782 1.23809 1.43256 -0.61310 1.45777 1.31285 -1.09271 -1.26503 0.05664 -3.79980 -0.56997 -1.20844 1.29678 0.09904 0.14646 0.21283 0.01915 0.62130 0.96645 1.15071 -0.94970 -0.04933 -0.47427 -0.16907 -1.38692 -0.18860 -1.44334 -0.32539 0.40103 0.03944 0.02743 -0.02611 -0.01816 0.01941 0.06159 0.00001 0.00778 0.60035 0.00013 0.00001 0.00002 -0.05338 0.00173 0.04024 0.07040 -0.08047 -0.01379 -0.00690 -0.00248 0.00382 0.00565 -0.00735 0.00183 -0.00116 -0.00356 -0.00256 0.00530 -0.00637 0.00052 0.03470 0.01789 -0.05872 0.03699 0.01949 0.00551 -0.04221 0.01015 -0.02467 -0.00953 -0.00918 0.00198 0.00934 0.00548 0.01150 -0.00273 0.00028 -0.00391 -0.01513 0.03347 -0.01167 -0.00069 0.00940 -0.00394 0.01100 -0.02586 -0.02490 -0.01131 0.02012 -0.00240 -0.01436 0.05231 0.02360 0.05842 0.03861 -0.06154 0.09106 0.01339 -0.03891 0.00650 -0.01517 -0.00262 0.00924 -0.00549 0.00537 -0.00303 -0.00442 -0.02083 -0.00162 0.01125 -1.06217 -1.16814 0.77250 0.10808 0.03710 -0.00134 -0.00001 0.00576 0.43407 0.00015 0.00001 0.00004 -0.06691 0.00217 0.05112 0.08950 -0.10247 -0.01752 -0.00840 -0.00290 0.00549 0.00718 -0.00996 0.00242 -0.00192 -0.00482 -0.00320 0.00721 -0.00798 0.00071 0.04628 0.02324 -0.07502 0.04888 0.02498 0.00722 -0.05565 0.01308 -0.03220 -0.01283 -0.01241 0.00243 0.01182 0.00743 0.01715 -0.00303 -0.00054 -0.00585 -0.02056 0.04786 -0.01768 -0.00190 0.01399 -0.00661 0.01457 -0.03591 -0.03313 -0.01182 0.02912 -0.00240 -0.02213 0.08332 0.04531 0.09727 0.06552 -0.09979 0.14483 0.01946 -0.06664 0.00505 -0.02767 -0.00650 0.01350 -0.01026 0.01203 -0.01079 -0.00824 -0.04057 -0.00233 0.01820 1.16107 1.28560 -0.85376 -0.11960 -0.04123 0.00211 0.00006 -0.00055 0.01904 -0.00055 0.00002 -0.00027 0.18395 -0.00463 -0.14783 -0.26098 0.29535 0.04844 0.01540 0.00210 -0.02359 -0.02640 0.03813 -0.00993 0.00264 0.02379 0.01310 -0.03171 0.00871 -0.00129 -0.15500 -0.05545 0.13989 -0.13529 -0.04109 -0.01665 0.15094 -0.03453 0.07144 0.03789 0.04120 -0.00721 -0.02710 -0.02863 -0.08752 -0.01296 0.01780 0.03691 0.07866 -0.25477 0.13144 0.02579 -0.09382 0.06338 -0.03633 0.15078 0.12309 -0.06938 -0.17255 -0.01954 0.19488 -0.70840 -0.50909 -0.92560 -0.69086 0.95296 -1.32245 -0.15004 0.68778 0.13357 0.37966 0.10534 -0.07498 0.15325 -0.25808 0.28312 0.06325 0.65498 -0.06018 -0.00744 -0.27596 -0.35462 0.24559 0.04290 0.02125 0.00367 0.00091 0.00658 -0.01911 0.00022 -0.00002 0.00098 0.10505 -0.01441 -0.11037 -0.18946 0.28295 0.04543 0.04838 0.02528 -0.05741 0.03188 0.02979 0.00798 0.11852 -0.02642 -0.03174 0.03059 0.11624 -0.02423 -0.28241 -0.35063 2.24082 -1.06016 -0.88251 -0.25873 1.14864 0.16127 0.92213 0.39427 0.29829 0.20826 -0.03636 -0.00264 -0.01460 0.08157 0.56963 0.00859 0.02597 -0.31421 -0.04093 -0.37144 0.25479 -0.04691 -0.26512 -0.03083 -0.25057 0.73616 -0.45987 0.26585 -2.88980 1.52346 -0.59245 2.43158 2.21870 -2.58353 3.99739 0.66300 -1.14840 -0.69139 -1.20414 -0.04639 0.15461 -0.59593 1.50635 -1.13464 0.08314 -2.88573 1.68020 -0.38690 0.30017 0.57933 -0.57098 -0.07880 0.06524 -0.06443 0.00010 0.00002 -0.00026 0.00019 0.00009 0.00002 -0.05442 -0.02737 0.02538 0.05962 0.10258 0.04897 0.33187 0.00339 0.14034 -0.00586 0.07361 -0.02349 -0.02539 0.01782 -0.13201 0.00995 -0.33991 0.04990 -0.10343 0.28321 0.04663 -0.15018 0.05081 0.04020 0.06031 0.03399 0.19684 0.22189 0.21756 0.15110 0.03107 -0.07592 0.10107 0.13096 -0.15975 0.04892 -0.12653 0.28311 0.07471 -0.42255 0.14954 0.12264 0.26344 -0.37991 -0.18492 -0.31501 0.34987 -0.09394 0.28916 0.18067 0.17258 -0.06267 -0.09738 0.11012 -0.23427 -0.03608 -0.11804 -0.08499 0.00586 -0.11904 -0.14791 0.04650 -0.21503 -0.15801 0.05217 0.05243 -0.14295 -0.12069 -0.00527 0.00150 0.00902 0.00169 -0.00838 -0.00863 -0.00040 -0.00004 -0.00084 0.00005 0.00003 -0.00008 -0.12556 0.02988 -0.03079 -0.07591 0.03921 0.01454 0.13343 0.09698 0.16440 -0.11220 -0.11991 -0.01154 -0.28853 -0.03433 0.12335 -0.03918 0.15980 -0.00435 0.41933 -0.21711 -0.02041 -0.19315 -0.01976 0.02244 0.09944 0.08547 0.08463 -0.00053 -0.00968 0.12928 0.00870 0.16034 -0.18227 -0.12556 0.11732 -0.18458 -0.35983 0.58767 -0.40370 0.26329 0.12158 -0.18868 0.09213 0.04190 -0.14343 -0.10131 0.08659 0.05116 0.00155 -0.24490 0.24821 0.02481 0.06377 0.19663 -0.25835 -0.06880 0.00722 -0.06872 0.03969 -0.00102 0.01719 -0.00340 -0.00889 -0.06511 -0.05706 -0.03882 -0.09688 0.35759 -0.00199 -0.00279 0.00328 0.00386 -0.00350 0.03306 0.00003 0.00013 -0.00010 0.00011 0.00002 0.00003 -0.02373 -0.00118 0.01067 0.02636 0.03664 0.16120 -0.10087 0.31948 -0.04335 -0.13320 -0.26558 0.03526 0.14436 0.12039 0.07187 0.02611 -0.14830 -0.08170 -0.05345 0.13087 0.03195 -0.09892 -0.14691 -0.07658 -0.05777 0.19689 0.10095 -0.25690 -0.29995 -0.36385 -0.05395 0.11341 -0.09169 -0.40620 -0.25455 -0.02488 0.35806 -0.02238 -0.33153 -0.18539 0.22192 -0.02358 0.09802 -0.19765 -0.13729 -0.18772 0.01115 0.00327 0.00540 0.02729 0.05606 0.01506 -0.12288 0.01482 -0.15061 -0.00502 -0.02555 0.06926 0.01895 -0.06052 0.12500 -0.15412 0.36704 0.07599 -0.13796 0.05202 -0.05119 -0.04592 -0.00573 0.00137 0.00074 -0.00060 -0.00307 -0.00241 0.00002 -0.00232 0.00225 0.00051 0.00037 -0.00077 0.00121 -0.00049 0.00658 0.00444 0.00637 -0.00682 0.06824 -0.01230 0.03047 -0.01128 0.02775 -0.00496 -0.01591 0.00854 -0.03459 -0.03230 -0.09536 -0.04260 -0.20445 0.41268 -0.68063 -0.33227 0.56239 0.00652 -0.43353 0.81684 0.04317 0.51708 -0.04404 -0.03279 0.23064 -0.17233 -1.07968 0.30230 -0.05743 -0.50737 -0.30661 -0.91296 -0.61379 0.49914 0.06954 0.03808 1.09627 1.00435 0.51304 0.90024 0.89107 -0.14157 -0.45126 -0.41567 0.00179 -0.98465 0.29744 0.15332 0.05271 0.30882 -0.13852 0.51090 0.21104 0.21215 0.19951 0.06799 0.74377 0.97573 -0.29230 1.29748 -0.78938 -0.07209 0.00008 -0.06043 0.10846 0.03727 -0.05467 -0.00722 -0.00039 -0.00126 0.00169 -0.00028 -0.00044 0.00005 0.00818 0.00211 -0.00741 -0.01280 0.00853 -0.00138 0.00891 0.01025 0.03358 -0.03287 -0.01352 -0.01436 -0.09630 0.02222 0.04875 -0.04513 0.02472 -0.02240 0.73851 -0.25464 -0.43510 -0.29924 0.32482 -0.01118 -0.30653 0.53810 0.26320 0.35239 -0.21044 -0.08583 0.27918 -0.48077 -0.73543 0.60332 -0.11574 0.29617 0.74865 -0.82208 0.39903 -0.63732 0.31713 0.40671 -0.20025 0.23881 -0.24832 0.12701 0.45820 -0.15604 0.53202 -0.05201 0.09212 0.05678 0.02467 0.46015 0.12917 -0.09486 0.12059 0.42022 0.18220 0.09849 0.34630 0.26659 -0.41791 0.71405 -0.18621 0.89664 -0.25505 0.11671 0.00408 -0.05419 0.05855 -0.01089 -0.00597 0.02246 -0.00031 -0.00028 0.00177 -0.00227 -0.00048 -0.00016 0.00346 0.00863 -0.00166 0.00620 -0.01811 0.04168 -0.03049 0.09648 -0.00123 -0.02257 -0.08505 0.00798 0.02151 0.02059 0.01343 0.01937 -0.05802 0.09569 -0.15254 0.13759 -0.22730 -0.01347 0.26953 0.18703 -0.28070 0.22151 0.04238 -0.05298 -0.12818 -0.38659 0.26537 -0.68090 -0.67556 0.71964 1.14425 0.52304 0.90519 1.84294 -0.00338 -0.15092 0.05961 -0.15538 -2.89718 -1.43905 0.46123 -0.83182 -2.15457 0.63859 1.28104 -0.33526 0.13962 -0.02240 -1.37464 -0.90266 -0.10057 -0.29759 0.51934 0.19233 0.05354 0.18951 -0.46061 0.54671 -2.54924 -0.19708 0.99271 -0.16771 1.03934 0.48392 0.01127 -0.10070 0.02526 0.00467 0.08611 0.02469 0.00000 -0.00007 -0.00001 0.00116 0.60044 0.00054 -0.00170 -0.06301 0.06919 -0.07012 -0.03102 0.02775 0.01018 -0.00469 -0.00553 0.00272 -0.00372 0.00098 -0.00078 0.00275 -0.01152 0.01212 0.00851 -0.00409 0.01990 0.02903 0.03561 0.01373 0.03187 -0.05695 -0.02070 -0.01659 -0.00189 0.01072 0.00616 -0.00274 -0.02032 0.00254 -0.00517 0.00192 -0.00236 -0.00036 0.00594 0.00440 -0.00325 0.00814 0.01448 -0.02669 -0.01597 -0.00046 0.01273 -0.00649 0.01288 -0.04080 -0.01849 0.00968 0.03629 -0.04912 -0.04012 0.05342 0.08158 -0.09256 0.03116 -0.00178 0.00532 -0.00636 0.01518 -0.00924 -0.00221 -0.00052 -0.01466 -0.02478 0.00632 -0.00888 -0.40969 0.91026 0.61902 1.23431 0.44720 0.00177 0.00001 0.00001 0.00000 0.00093 0.43397 0.00045 -0.00209 -0.07914 0.08725 -0.08835 -0.03921 0.03518 0.01300 -0.00591 -0.00693 0.00355 -0.00488 0.00132 -0.00110 0.00341 -0.01474 0.01570 0.01110 -0.00503 0.02596 0.03812 0.04624 0.01820 0.04120 -0.07228 -0.02779 -0.02215 -0.00182 0.01393 0.00874 -0.00385 -0.02592 0.00395 -0.00710 0.00366 -0.00331 -0.00069 0.00897 0.00704 -0.00563 0.00961 0.02002 -0.03469 -0.02313 -0.00186 0.01751 -0.00723 0.01663 -0.05751 -0.02818 0.01924 0.06090 -0.08047 -0.06270 0.08456 0.12913 -0.15119 0.05546 -0.00220 0.00704 -0.00592 0.02773 -0.01173 -0.00793 0.00790 -0.02985 -0.05007 0.00527 -0.01652 0.44643 -0.99888 -0.68239 -1.36146 -0.49410 -0.00330 -0.00014 -0.00075 -0.00001 -0.00045 0.01985 -0.00072 0.00633 0.21533 -0.24013 0.24034 0.10923 -0.10090 -0.03895 0.01391 0.01657 -0.01049 0.01489 -0.00537 0.00591 -0.00737 0.04194 -0.04607 -0.03581 0.00679 -0.06592 -0.11031 -0.10384 -0.04920 -0.09544 0.11501 0.07836 0.07162 -0.01902 -0.02378 -0.03323 0.00970 0.03641 -0.03362 0.02393 -0.03867 -0.00048 0.01982 -0.04991 -0.04519 0.06461 0.02553 -0.05812 0.07206 0.13261 0.04746 -0.08152 -0.01135 -0.03067 0.27940 0.22445 -0.27045 -0.59991 0.73857 0.56610 -0.74487 -1.11482 1.43325 -0.59557 0.02137 0.00782 -0.07673 -0.35832 0.01816 0.20482 -0.33834 0.46630 0.80346 0.16957 0.26437 -0.08755 0.25452 0.20388 0.40609 0.13570 0.01421 0.00016 0.00220 -0.00040 0.00482 -0.02172 0.00220 0.00291 0.15841 -0.21738 0.24931 0.10128 -0.08846 -0.04605 0.04320 0.03859 -0.02658 0.03339 0.00475 -0.01796 -0.02997 0.06738 -0.08469 -0.04260 0.13434 -0.52455 -0.49029 -1.12530 -0.47931 -1.07752 2.18833 0.55360 0.26317 0.38627 -0.39181 0.00749 0.25879 0.97856 0.39611 0.18454 -0.02770 0.63993 -0.49685 -0.05825 -0.04219 -0.65761 -1.12264 -1.03362 1.13023 -0.58766 -0.73135 0.16868 0.26413 -0.91387 -0.60014 -1.40100 0.83110 1.04420 -1.08631 -2.68454 2.00931 2.88694 -3.83494 0.99501 -0.19220 -0.35296 0.14633 0.93759 -0.23747 -0.81566 1.00817 -1.02307 -2.72504 -1.64744 -0.64595 0.05125 -0.31980 -0.35196 -0.72131 -0.36218 -0.01726 0.00000 -0.00005 -0.00011 0.00013 -0.00003 -0.00004 0.00174 0.03491 -0.00916 -0.03339 -0.05284 0.06811 0.04131 0.05075 0.05037 0.38830 -0.00160 0.05549 -0.03572 0.23169 0.16810 -0.12374 -0.05271 0.06151 -0.04024 -0.03116 0.12226 0.11094 -0.01286 0.00132 0.02113 0.11654 -0.20941 0.30483 -0.14756 0.09301 -0.21006 0.40736 -0.22071 -0.21455 0.25712 0.06104 -0.05012 -0.05498 0.07593 0.11108 0.11399 0.59450 0.02305 -0.15601 -0.03818 0.07732 -0.05493 0.06964 0.29856 0.04222 0.00181 0.07246 -0.20079 0.04795 0.11211 -0.05674 -0.06810 0.12414 -0.16655 0.18444 -0.24081 -0.24949 -0.02611 -0.15779 -0.07334 0.02136 -0.16722 -0.00738 0.00140 0.00415 -0.00211 -0.00120 -0.00880 0.00049 0.00000 0.00001 0.00002 -0.00021 -0.00001 -0.00003 -0.00173 -0.05490 -0.03219 0.02051 0.02642 -0.08554 -0.13219 0.08009 0.28369 0.03324 0.06448 -0.00982 0.00511 0.24652 -0.23496 0.12915 0.10981 -0.04014 -0.02251 0.08541 -0.03808 -0.14682 -0.09728 0.04639 0.10755 -0.01912 -0.17426 -0.07202 -0.14734 0.13666 0.29319 0.36169 -0.04305 0.03015 0.19098 0.18006 -0.06915 -0.24896 0.16543 -0.00496 0.32434 -0.53586 -0.16782 -0.08817 0.26028 -0.19229 0.25977 -0.21477 0.13413 0.10569 0.15140 -0.09626 0.16222 -0.14315 -0.14998 0.09219 0.12857 0.14240 0.03496 0.29314 -0.02685 -0.04306 -0.05136 -0.04045 -0.19525 -0.02738 0.20053 -0.01157 0.00424 -0.00551 -0.00054 0.00166 0.01108 -0.00019 0.00003 -0.00009 0.00000 0.00008 -0.00003 -0.00004 0.00032 0.00851 0.00375 0.00173 0.00089 0.07772 -0.04044 -0.16577 0.12779 0.01327 -0.21438 -0.35024 0.09926 0.00050 -0.07861 -0.20688 0.00535 0.01212 -0.00688 -0.01650 0.07279 0.02543 -0.08873 -0.12619 -0.01996 0.21388 -0.13848 -0.20839 0.32428 0.11965 0.17027 0.10157 0.05854 0.06487 0.18741 -0.63755 0.42469 0.05368 0.21409 0.06254 0.05276 0.01323 0.09463 0.04688 -0.12451 0.02099 0.06782 0.08521 0.20934 0.03035 0.04433 -0.01113 -0.10455 0.00956 0.05386 -0.01887 -0.13139 -0.13999 0.30268 0.24575 -0.00368 0.20250 0.13602 -0.08343 0.00214 -0.00515 -0.05297 -0.01992 0.00137 -0.00010 0.00264 0.00053 -0.00577 -0.00277 0.00080 0.00081 0.00046 0.00171 -0.00088 -0.00019 -0.01749 -0.00513 -0.00418 0.00317 -0.01094 0.01394 0.03031 0.02779 0.04352 0.10633 -0.01953 0.03069 -0.01712 0.05874 0.05945 -0.04431 0.00820 0.05104 0.10269 0.03540 0.05872 0.09347 -0.08269 0.78315 0.05862 0.58672 -0.55268 0.65487 0.09505 -1.12423 -0.69946 0.93705 0.35058 1.18300 -0.67759 -0.14399 0.31467 0.21456 -0.40407 -0.47752 -1.15407 -0.88851 -0.72222 1.27156 -0.90609 -0.33502 0.70516 -0.73480 0.84906 -0.34548 0.37274 -0.04388 0.03378 0.06300 -0.00539 0.18399 0.16544 -0.66778 -0.02826 -0.30262 0.96884 0.82109 -0.09921 0.77977 0.39434 -0.27432 -0.52713 -0.60292 -0.05880 -0.00469 -0.03407 -0.02441 -0.06818 -0.06972 0.00011 -0.00090 -0.00036 -0.00153 0.00144 -0.00128 0.00018 0.00545 -0.01054 -0.00362 -0.00266 -0.00638 -0.02455 0.01219 0.07175 0.01068 0.02938 -0.00416 0.01602 0.08393 -0.08382 0.02699 0.03628 -0.03686 0.05808 0.21739 -0.07568 -0.72750 0.25233 -0.86284 0.39387 -0.57252 -0.92590 -0.28158 -0.84131 0.12069 -0.16656 0.38495 -0.15314 0.67588 -0.41526 -0.32784 -0.07483 0.14391 -0.42808 -0.78106 -1.70020 0.26873 0.06300 0.59510 -0.83814 0.01126 0.24011 0.69077 0.81030 0.29849 0.43416 -0.20679 0.30414 -0.10697 0.15344 0.02007 0.03088 -0.52121 -0.09242 -0.77991 0.24623 0.06132 0.31714 -0.35186 1.04200 1.00801 0.17213 0.07202 0.05269 -0.00838 0.01854 0.08314 0.04399 -0.01035 -0.00016 -0.00042 0.00010 0.00053 -0.00030 -0.00002 0.00125 -0.00350 -0.00375 0.00282 0.00170 0.01758 -0.01282 -0.03890 0.02884 0.00451 -0.05010 -0.11162 0.04208 0.00610 -0.02871 -0.05915 -0.02716 0.04313 -0.04852 -0.17160 0.05481 0.34415 0.40357 0.20985 0.57309 -0.08455 -0.68493 -0.90043 1.55424 -0.06432 0.30775 0.24906 -1.61553 -0.33441 -0.86302 0.80360 -0.22618 -0.01638 -0.60345 0.01573 -1.14844 0.07787 -0.36979 -1.23296 0.11167 0.18573 -0.25378 -0.78528 0.19620 0.29896 0.08241 -0.06211 -0.57919 -0.29221 -0.27410 0.03350 0.09035 0.32099 -0.84930 -0.69513 0.00697 -0.75138 -0.63583 0.44225 0.10829 -0.03094 -0.20818 0.06162 0.00298 -0.00295 0.01352 -0.01102 -0.02889 0.01487 0.00000 -0.00006 -0.00002 0.00085 -0.00054 0.60043 -0.00227 -0.05797 -0.09181 0.00608 -0.05095 0.03039 0.01405 -0.00441 -0.00399 -0.00700 -0.00126 0.00003 -0.00329 -0.01003 0.00111 0.00597 -0.01353 0.00136 -0.00191 -0.02320 0.04637 -0.00784 0.00636 0.02845 -0.05917 -0.02034 -0.01345 -0.00347 -0.00661 0.00764 0.01999 -0.00064 -0.00224 0.00239 -0.00845 -0.00225 0.00260 -0.00951 -0.01075 0.00489 -0.00862 0.00305 -0.01262 -0.01131 0.01413 -0.01249 0.03400 0.03331 -0.01914 0.00182 0.05499 -0.01056 -0.04763 0.04916 0.03561 0.11835 0.03884 -0.00639 -0.00037 0.00400 -0.01575 -0.00258 0.01041 -0.00637 0.02632 -0.00132 0.00424 0.01252 -0.43261 0.73011 0.65186 -1.24266 0.64329 -0.00142 -0.00001 0.00002 0.00000 0.00070 -0.00033 0.43397 -0.00289 -0.07278 -0.11571 0.00768 -0.06432 0.03850 0.01793 -0.00562 -0.00494 -0.00898 -0.00164 0.00000 -0.00423 -0.01284 0.00145 0.00783 -0.01745 0.00155 -0.00234 -0.03010 0.05948 -0.00869 0.00899 0.03578 -0.07678 -0.02677 -0.01681 -0.00439 -0.00901 0.01033 0.02562 -0.00176 -0.00288 0.00354 -0.01144 -0.00344 0.00398 -0.01305 -0.01516 0.00626 -0.01040 0.00475 -0.01682 -0.01540 0.02008 -0.01415 0.04649 0.04752 -0.03060 0.00596 0.09128 -0.01860 -0.07385 0.07757 0.05470 0.19143 0.06632 -0.00965 -0.00118 0.01008 -0.02514 -0.00545 0.01990 -0.00694 0.05806 -0.00152 0.00044 0.02223 0.47118 -0.80087 -0.71827 1.37013 -0.71053 0.00263 0.00011 -0.00068 -0.00021 -0.00051 -0.00076 0.01991 0.00965 0.19745 0.31680 -0.02115 0.17737 -0.10941 -0.05191 0.01503 0.01106 0.02509 0.00521 0.00156 0.01300 0.03639 -0.00545 -0.02390 0.05171 0.00240 0.00240 0.07752 -0.11614 -0.01894 -0.04762 -0.05713 0.16562 0.07347 0.01311 0.01167 0.02578 -0.02662 -0.04179 0.03006 -0.00020 -0.01292 0.02069 0.01649 -0.02442 0.06096 0.05402 -0.01506 -0.02950 -0.03442 0.04805 0.04468 -0.09489 -0.03141 -0.18737 -0.24362 0.28906 -0.14357 -0.86596 0.21171 0.61067 -0.69401 -0.43768 -1.76536 -0.64158 0.08975 0.05768 -0.21291 0.23219 0.07320 -0.28455 -0.04385 -1.02279 0.00446 0.26558 -0.29987 -0.08907 0.20314 0.20957 -0.40731 0.20240 -0.01082 -0.00039 0.00166 0.00012 0.00560 0.00225 -0.02171 -0.00478 0.14744 0.29161 -0.02690 0.18214 -0.10352 -0.07223 0.02072 0.02850 0.05136 0.00630 -0.01672 0.01191 0.06332 0.01818 -0.03884 0.08708 -0.12195 0.06746 0.42533 -1.51864 0.45933 -0.03226 -1.13118 2.00539 0.47536 0.84520 0.10044 0.30484 -0.12034 -0.74904 -0.26225 0.32477 -0.39037 0.84116 0.28011 0.07422 -0.18384 0.59007 -0.12676 1.60319 0.05349 0.43847 0.32577 -0.15018 1.00784 -0.18045 0.65988 -2.22269 0.37330 1.51013 -0.63232 -1.29512 2.70170 1.43041 4.76410 0.55573 -0.36765 -0.45408 0.61417 -0.63669 0.24211 1.05648 0.25511 2.76449 -0.47825 -2.14175 0.74253 0.04467 -0.22452 -0.34075 0.68256 -0.50889 0.03442 0.00001 -0.00006 -0.00006 0.00019 -0.00003 -0.00004 0.00318 0.03125 0.00148 -0.01982 -0.06164 0.06250 0.05692 0.05856 0.12900 -0.15925 0.27919 -0.07836 0.24804 0.04562 0.20634 -0.10555 0.13075 0.00659 0.03683 0.04081 0.11588 0.10939 -0.01419 0.06133 -0.01957 0.09742 -0.23193 0.20938 -0.03552 -0.00802 0.19098 -0.28594 -0.05602 -0.50063 0.13596 -0.01175 -0.10782 0.14455 0.09034 -0.48239 -0.03366 -0.28349 0.08384 0.24368 -0.10442 0.28092 -0.09134 -0.04552 0.15565 0.00325 -0.07468 -0.20227 -0.01186 0.09489 0.11246 0.12991 -0.10310 0.01035 -0.24181 0.03271 0.25896 0.12746 -0.01402 -0.29459 -0.04878 0.02686 -0.17267 -0.02571 -0.00048 0.00399 -0.00012 -0.00117 -0.01097 -0.00085 -0.00002 -0.00003 0.00000 0.00024 0.00002 0.00005 0.00256 0.05670 -0.01872 0.00967 -0.03629 0.08570 0.13073 -0.07508 -0.23084 -0.11258 -0.01519 -0.02055 -0.07146 0.31954 -0.14868 0.01128 0.19557 0.00578 -0.04234 0.07181 0.06957 0.11776 0.01538 0.04464 -0.08335 0.00732 0.08957 -0.05757 -0.13424 0.12017 0.29173 0.30075 -0.05708 0.24887 -0.17563 0.24683 0.17652 0.36097 0.13021 -0.09631 0.19561 0.00222 0.45982 0.13208 0.01845 0.33225 -0.42854 -0.11323 -0.10747 -0.14292 -0.11980 0.10245 -0.12723 0.18543 0.10660 0.12464 -0.12437 -0.07959 -0.01331 -0.14631 -0.19805 0.11754 0.02699 0.16613 -0.17438 -0.11719 -0.20892 -0.02840 -0.00433 0.00532 0.00218 -0.00098 -0.01250 0.00111 0.00001 -0.00010 0.00002 0.00008 -0.00004 -0.00004 -0.00012 0.00739 0.00116 0.00271 0.00117 0.07194 -0.03725 -0.15242 0.12743 -0.09008 -0.06943 0.39065 0.05493 0.01273 -0.07477 -0.24030 -0.00114 -0.01298 0.01547 0.01799 0.05803 0.00925 -0.11568 -0.01602 -0.09981 0.19947 -0.04711 -0.21322 0.09774 0.30846 -0.22523 -0.14215 0.17395 0.08803 0.39469 0.46297 0.20416 -0.06744 -0.41150 0.00145 -0.13781 -0.06581 0.24861 0.05695 -0.02977 0.04833 0.05438 -0.09394 0.20203 0.02817 0.00491 -0.13483 -0.02640 0.01849 0.03925 0.08719 -0.15975 -0.24316 0.20569 0.07169 0.14298 -0.28871 -0.11396 0.07892 -0.02070 0.01645 -0.06173 -0.01178 0.00129 -0.00098 0.00305 -0.00090 -0.00580 -0.00096 -0.00023 0.00053 0.00118 0.00152 -0.00026 -0.00111 -0.01246 -0.00436 0.00749 0.00058 -0.01626 0.01413 0.03081 0.02576 0.06260 -0.04371 0.06210 -0.02654 0.06956 0.02168 0.06777 -0.03347 0.04095 -0.00176 -0.01677 0.06948 -0.02393 0.34068 0.23232 -0.21494 0.63305 0.43925 -0.57769 0.14558 -1.10459 0.05414 0.57480 -1.42828 0.56090 0.37186 -0.61828 -0.02158 0.03064 0.22926 -0.08650 1.53739 1.07084 0.27213 0.96149 -0.41377 1.41125 -0.53262 0.62136 0.53774 1.23628 -0.27256 0.24951 -0.40422 -0.17898 -0.09042 -0.00714 -0.27049 0.27083 -0.31172 0.25880 0.44683 -1.03799 -0.18080 0.11601 1.36215 0.48355 0.07001 -0.70436 0.19825 -0.06604 -0.03590 -0.01372 0.02258 -0.07193 0.01280 -0.00015 0.00095 0.00038 0.00170 0.00127 -0.00154 -0.00039 -0.00599 -0.00430 0.01129 0.00155 0.00578 0.02484 -0.01301 -0.05569 -0.03522 -0.01837 -0.00711 -0.03646 0.09327 -0.04190 0.02374 0.08662 -0.00716 -0.00022 0.24939 0.00214 0.95403 0.04239 -0.37972 0.31257 0.58147 0.96271 0.34844 -0.26810 0.87548 0.42208 0.61404 -0.06573 -0.14630 0.05988 -0.41000 -0.01120 -0.54564 -0.75664 -0.74935 -1.23548 -0.04754 -1.03260 -0.09931 -0.27579 -0.13753 0.35218 0.68092 -0.95381 -0.41118 -0.42052 0.16713 0.03208 0.29551 -0.03074 0.03601 -0.24892 0.22872 -0.04028 0.16565 0.75921 -0.18638 0.09085 -0.37611 1.44227 0.16805 -0.29930 0.34325 -0.05632 0.01980 -0.02264 0.07555 -0.06345 0.01191 0.00029 -0.00061 -0.00041 0.00090 0.00018 -0.00015 0.00276 -0.00402 0.00251 -0.00431 0.00710 0.01222 -0.01038 -0.04076 0.02732 -0.01625 -0.00945 0.11549 0.03033 0.00614 -0.01654 -0.06748 0.00666 -0.04376 0.10380 0.11738 0.09855 0.11844 0.18914 0.42088 0.36760 -0.03572 -0.10881 -0.99920 -0.24441 1.43830 -1.12273 -0.51768 -1.33396 -0.33196 -1.01849 0.08661 0.22781 0.02356 1.36437 0.22991 0.57930 -0.70216 -0.32210 -0.37567 -0.71563 0.57172 0.32483 0.77964 -0.37240 0.19250 0.13509 -0.10157 0.47013 0.43518 0.01745 -0.08864 -0.30557 0.63463 -0.49605 -0.16833 -0.38278 1.16473 0.53270 -0.16647 0.13195 -0.03348 -0.27815 -0.22529 0.01293 0.02638 0.01699 0.00556 -0.04514 -0.02664 -0.00018 -0.00011 -0.00032 -0.00047 -0.00013 -0.00012 0.02679 0.03573 -0.02356 -0.07214 -0.08562 -0.14821 0.09233 -0.01745 0.04389 -0.02921 -0.14147 0.03465 0.12814 0.03122 0.01560 0.08980 -0.03532 0.08874 0.00603 -0.01029 -0.01496 0.00994 -0.10241 -0.03677 0.00274 0.00334 0.06025 -0.04242 -0.01082 -0.02254 0.00620 -0.00395 -0.07876 -0.03907 0.01064 0.04819 -0.06883 0.04848 0.11007 -0.02355 -0.05263 0.08003 0.03032 0.15362 0.06646 -0.05159 0.06764 -0.01769 0.09488 -0.04473 -0.09649 -0.08265 -0.23586 0.08869 -0.03237 0.05702 -0.56764 0.46574 0.12776 -0.04873 0.13563 -0.04220 0.08118 0.20548 0.38981 -0.87360 0.87038 0.36484 0.02882 -0.00356 -0.00553 0.00101 0.01531 0.01472 0.00068 0.00108 0.00081 0.00280 -0.00049 -0.00088 -0.02466 0.00663 -0.00618 -0.02292 -0.02216 -0.04303 0.06108 0.00973 0.04363 -0.01804 -0.08626 0.02765 0.11010 0.02348 -0.00431 0.08685 -0.04624 0.14162 0.10924 -0.05159 -0.13815 0.22274 -0.70503 -0.38317 -0.13051 0.09748 0.06955 -0.78265 -0.52610 -0.79161 -0.21122 -0.21806 -0.98142 0.63701 -0.54546 -0.03831 -1.05033 -0.15518 0.89827 0.39840 -0.84979 0.27344 1.92046 2.02015 0.47818 -0.21662 2.46242 -0.58297 1.79275 0.14881 0.64457 -0.51251 0.41416 -0.84153 0.54988 -0.06394 1.95652 -1.78167 -0.86878 0.56810 -0.41230 0.12450 0.18967 0.10442 -0.62884 1.89850 -2.92501 -1.02194 -0.11001 0.00094 -0.04751 0.00202 -0.12173 -0.05685 -0.00001 -0.00015 -0.00020 -0.00012 -0.00021 -0.00015 0.00626 0.07766 0.00398 -0.00933 -0.02991 0.14690 -0.01988 -0.10947 0.08071 0.00090 -0.00824 0.01560 -0.00739 -0.01659 0.04320 0.22886 -0.03124 0.01284 0.02169 0.01129 0.00939 -0.01879 0.04616 0.05745 0.06940 -0.07138 0.06375 0.02204 -0.03944 -0.05290 0.01752 -0.00057 -0.02500 -0.00988 0.05744 -0.02656 0.05389 -0.09399 -0.03040 0.07132 -0.02276 -0.09157 0.06143 -0.04543 -0.08857 0.03470 -0.00266 0.01736 0.11466 -0.08129 -0.21268 -0.00869 0.06005 -0.11170 0.12975 0.09962 0.28064 0.46584 0.60577 -0.39226 -0.05427 -0.11835 -0.16555 -0.41239 0.17210 -0.67202 -0.90109 -0.06931 0.01576 -0.00500 -0.00533 -0.00243 -0.00278 -0.00043 0.00037 -0.00083 0.00056 0.00449 0.00056 0.00016 -0.00692 -0.00016 0.00077 -0.00714 -0.00727 0.07095 0.00124 -0.03756 0.06466 -0.00247 -0.00663 0.01127 0.01446 -0.00318 0.03214 0.20664 -0.04934 0.02589 0.14614 0.02758 -0.06101 0.38183 1.10409 0.80833 0.78211 -1.28712 -0.16627 -0.89497 -0.18259 -0.29216 -0.43125 -0.29115 -1.55445 0.45657 -0.15406 -0.18400 0.47350 -0.27344 -0.11248 0.37769 -0.35229 -0.72951 0.92062 -0.58475 -1.01723 0.71768 0.64137 -0.02512 2.52366 0.45734 0.72104 -0.85217 -0.62120 0.50532 -0.00304 0.00070 -1.86984 -1.45462 -1.56562 1.34636 0.19203 0.46971 0.44304 1.41945 -0.13422 1.55284 0.11494 -0.22792 -0.08341 0.06936 0.06007 -0.00446 -0.17892 -0.03778 -0.00010 -0.00033 -0.00037 -0.00001 -0.00001 -0.00006 0.02345 -0.00254 -0.04633 -0.08422 0.12060 -0.00106 0.16032 -0.06215 0.08603 0.00470 0.10312 -0.02792 -0.12695 -0.03988 -0.05535 -0.02920 -0.04681 0.08575 0.00438 0.00985 -0.02671 0.05923 0.00126 -0.01832 -0.00423 -0.00933 -0.01720 -0.09413 -0.04317 -0.03439 -0.01224 0.02855 0.06837 -0.06135 0.03923 0.04852 -0.03833 0.10943 0.10635 0.00485 -0.05214 -0.00582 -0.02329 -0.01838 -0.07044 -0.12308 -0.01597 0.02318 0.02458 -0.04932 -0.18220 -0.06413 -0.14522 -0.19820 0.37393 0.16688 0.02749 0.65185 0.21345 0.07608 0.48135 -0.16280 0.62338 0.67282 -0.31041 0.55931 -0.23400 0.09775 0.02411 0.01328 0.00032 0.00016 -0.00563 0.00687 -0.00024 0.00036 0.00281 -0.00059 -0.00010 0.00034 -0.00174 0.00175 -0.01497 -0.02316 0.02881 0.01343 0.07666 -0.01573 0.06487 0.00009 0.05259 -0.02166 -0.11737 -0.04107 -0.05052 -0.00007 -0.07103 0.19248 -0.00782 0.03298 -0.28854 0.82039 -0.01720 0.04916 -0.29961 -0.37793 -0.55491 -1.05172 -0.54253 -0.60860 -0.10735 0.11170 0.66309 -0.47745 0.45642 0.47843 0.54316 1.17945 0.39561 0.06375 -0.31045 -0.14806 -1.45995 -0.89855 -0.09542 -1.08635 -1.41510 0.28966 0.68332 -0.11375 0.14681 0.13487 -1.01709 0.26072 -1.31310 -0.55002 0.44638 -0.84898 -0.04469 -0.17958 -0.90244 0.40654 -2.18876 -1.36983 0.76102 -0.93290 0.59191 0.22688 -0.07548 -0.09665 0.05460 -0.00225 0.03700 0.02521 -0.00011 -0.00030 -0.00032 -0.00017 0.00003 -0.00014 0.02361 0.00280 -0.04665 -0.08444 0.11464 0.07714 -0.00756 0.15122 0.00811 -0.09533 -0.14380 0.01193 0.01796 0.07246 0.08658 0.00666 -0.03863 -0.08569 -0.00347 0.01094 -0.05966 0.01783 -0.00980 0.01428 -0.02843 -0.05782 -0.06208 0.01656 0.03194 0.07272 -0.00843 0.04919 0.08580 -0.06016 -0.05683 -0.03133 -0.06470 -0.05098 0.00464 0.06737 -0.02043 -0.01385 0.09341 -0.01004 -0.10595 -0.09382 -0.03573 -0.06824 -0.02141 -0.01786 -0.20784 -0.05381 0.03372 -0.07857 0.50920 0.09081 -0.06216 0.24322 0.09691 0.27699 -0.16408 0.45681 -1.12359 0.26846 0.29668 0.40360 0.07817 0.18278 0.02512 0.00793 -0.00056 0.00512 0.00148 0.00813 0.00003 -0.00020 0.00209 0.00126 0.00040 0.00044 -0.00169 -0.00364 -0.01322 -0.02704 0.04449 0.02196 0.00317 0.05968 0.01268 -0.07655 -0.09671 0.00977 0.01172 0.07180 0.08872 0.01847 -0.04898 -0.16593 0.04569 0.09202 -0.46074 0.66551 0.14751 0.06986 -0.20587 -0.63357 -0.72202 0.06191 0.40198 0.64921 -0.15785 0.49848 1.07662 -0.29840 -0.61750 -0.36429 -1.13374 -1.10480 0.27019 0.36264 -0.28846 0.03336 1.72170 0.65483 -0.41980 0.40842 0.94900 -0.41579 -0.63095 -0.05014 -0.04135 -0.33912 0.35095 1.19372 -1.35205 -0.04724 -0.14340 -0.15683 0.21413 -0.49728 0.39749 -0.79614 2.55753 -0.23704 -0.98331 -0.18550 -0.70770 -0.26784 -0.08095 -0.03047 0.07331 -0.00119 -0.04273 0.00192 -0.00007 -0.00009 -0.00006 -0.00025 -0.00037 -0.00013 0.00252 0.05217 -0.07292 0.07595 0.03914 -0.07426 -0.00217 0.07811 -0.05612 -0.05355 0.11630 0.17912 -0.04797 -0.03080 0.04550 0.13455 -0.01417 -0.00399 -0.00341 -0.02221 0.00740 0.00451 0.03843 -0.06192 0.04214 0.07032 -0.06431 -0.01370 0.09495 -0.03037 0.04246 0.02822 -0.01239 -0.01388 -0.10113 0.06933 -0.00193 0.03338 0.00903 0.01172 0.04004 0.01826 -0.04574 0.02621 0.02333 0.00492 0.02330 -0.08698 0.05765 -0.10757 -0.07796 0.08211 -0.18997 0.07258 0.35133 -0.20641 -0.20842 -0.21045 0.75600 0.51130 -0.24386 0.30235 0.52285 -0.70182 0.16463 0.34196 0.21144 0.14263 0.01541 -0.01476 -0.00589 -0.00718 0.00293 0.00593 0.00012 -0.00045 0.00053 0.00008 0.00369 -0.00031 -0.00744 0.00357 -0.01597 0.01654 0.01059 -0.03125 0.00773 0.04505 -0.02951 -0.03230 0.06901 0.12494 -0.03216 -0.02340 0.03600 0.15727 -0.02293 0.02431 0.12893 0.00131 0.50880 0.52941 0.45040 -0.59205 0.08257 0.44897 -0.89262 -0.39417 1.67474 -0.20635 -0.01380 0.47906 -0.94939 -0.06276 -0.60162 0.03698 0.33146 0.17881 -0.23172 0.12970 -0.33527 -0.06022 -0.43871 -0.31123 0.08228 -0.06937 0.15599 -0.82923 0.30435 -0.19030 -0.22858 0.32022 0.16359 -0.64385 -1.09457 1.11277 0.17753 0.55708 -1.09316 -1.25287 0.12755 -0.74562 -0.92688 0.89341 0.17564 0.04291 -0.18275 -0.10116 -0.03654 0.05924 0.07526 0.12388 0.03038 -0.00668 -0.00007 -0.00020 -0.00010 -0.00023 -0.00038 -0.00011 0.00143 0.05089 -0.06957 0.08376 0.05205 -0.04338 -0.04167 -0.05307 0.01802 -0.17257 -0.05438 -0.12361 0.04652 -0.12867 -0.10125 -0.02457 0.01251 -0.02932 0.03113 0.05481 0.00905 0.02355 -0.03466 0.03374 0.01918 0.00272 -0.01858 0.08226 -0.02768 -0.02177 -0.09785 0.02461 0.00671 0.05522 0.00474 0.02375 0.09015 0.03596 0.03853 0.05742 0.00257 -0.11581 0.04299 0.04735 -0.04503 -0.01868 0.03800 -0.01964 0.00943 -0.14893 -0.09691 0.00128 -0.06175 0.19222 0.24946 -0.17763 -0.05382 0.49042 -0.49004 -0.08310 -0.57374 -0.93490 -0.03639 -0.46361 0.10250 0.39025 0.15225 0.13655 0.01886 -0.01359 -0.00350 -0.00873 0.00149 0.00658 0.00053 0.00120 0.00071 0.00009 0.00360 -0.00055 -0.01140 -0.00085 -0.01052 0.02211 0.01708 -0.01972 -0.00483 -0.02393 0.02979 -0.10865 -0.06347 -0.07277 0.02713 -0.11484 -0.09550 -0.01302 0.03872 -0.04595 0.29428 0.36046 0.40410 0.35010 -0.04271 -0.03935 -0.35655 0.19750 -0.30059 1.45275 -0.61433 -0.71556 -1.25394 0.69600 0.27156 0.62765 -0.07623 0.13581 0.34195 0.20866 0.03099 0.13334 0.04462 -0.50492 -0.39416 0.80197 -0.48266 -0.05840 0.72401 -0.46116 0.59301 -0.65181 -0.14159 0.39570 0.59952 -0.42758 -0.69880 1.11948 -0.03281 -0.94475 0.85898 0.13752 0.93788 1.77385 0.38632 0.72731 0.39743 -0.07223 0.17700 -0.30508 -0.08530 0.05549 0.01745 0.13119 0.04278 -0.04503 -0.00003 -0.00017 -0.00003 -0.00023 -0.00039 -0.00020 0.00190 0.05022 -0.08327 0.07432 0.03437 -0.04225 -0.06019 0.03124 0.15122 0.11207 0.00537 -0.03677 0.00475 0.19448 -0.05631 -0.02630 0.03910 0.00897 -0.01687 -0.02243 0.02627 0.01471 0.02718 0.00458 -0.06794 -0.01958 0.10143 -0.02532 0.02552 -0.02878 -0.01828 -0.04208 0.00632 -0.06275 0.03416 -0.02064 -0.05979 -0.05029 0.02778 0.12580 0.08677 -0.03526 -0.00557 -0.00598 -0.01824 -0.04627 0.02464 -0.06647 0.08920 -0.10943 -0.10549 -0.00602 -0.07630 0.07158 0.29582 -0.11524 -0.01399 -0.40441 0.01024 -1.12755 0.31072 0.12446 0.11206 -0.00830 0.58748 0.43611 0.18382 0.09910 0.01679 -0.01736 -0.00488 -0.00581 0.00027 0.00307 -0.00019 -0.00002 0.00019 -0.00033 0.00357 0.00125 0.00199 -0.00009 -0.01535 0.01092 0.01467 -0.02406 -0.03807 0.01626 0.08875 0.07475 -0.00768 -0.02879 -0.00445 0.16054 -0.04759 -0.00206 0.05083 -0.00018 0.10851 -0.06030 0.42669 0.53394 0.32584 -0.27404 -0.93734 -0.15772 1.15539 0.16585 0.53125 -0.06707 -0.26142 -1.21848 0.23097 -0.67316 0.11842 0.06938 -0.03030 0.06796 0.30895 0.92902 1.40975 -0.07475 0.22987 -0.33808 0.52693 0.03606 -0.45166 -0.46850 -0.49439 -0.31904 -0.60640 0.55216 0.33923 -0.47086 -0.97009 0.76109 -0.39087 0.91130 0.24289 1.74199 -0.99312 -0.36400 -0.03214 -0.40091 -1.31373 -0.33645 0.35956 0.10064 -0.04150 0.08887 0.08013 0.07535 0.07377 0.01884 0.00000 -0.00008 -0.00014 -0.00026 -0.00016 -0.00036 0.00256 0.04743 0.09409 -0.00609 0.06289 -0.07470 -0.01208 0.06972 -0.06660 0.07706 0.00186 -0.19272 -0.05548 -0.00341 0.01771 0.15963 -0.00089 0.01115 -0.00470 0.01910 0.00871 -0.03753 -0.01050 0.05989 -0.02348 0.06872 -0.03450 -0.02248 -0.04369 0.09721 -0.07438 -0.02903 0.00772 -0.01262 -0.11030 -0.00647 -0.01513 0.03249 0.01194 -0.00939 -0.03265 0.01976 -0.05218 0.00782 0.05457 -0.00225 0.03028 0.06814 0.04246 -0.13336 -0.14398 -0.14360 -0.11321 0.04484 0.20970 0.41984 -0.20286 -0.54556 0.39391 -0.01577 0.46691 -0.71318 -0.46997 -0.18707 -0.66106 -0.04112 0.26649 -0.07500 0.01811 -0.01122 -0.00887 0.00740 0.00248 0.00007 0.00020 -0.00053 0.00044 0.00023 -0.00014 0.00369 -0.00255 0.00194 0.02053 0.00089 0.01512 -0.03301 0.00403 0.03723 -0.03513 0.04641 -0.00274 -0.12960 -0.03892 -0.01030 0.02515 0.17330 -0.00666 0.00365 0.04553 0.02788 0.62434 0.11170 -0.02060 0.53323 -0.49036 0.40160 -0.51441 -0.75179 -0.49130 1.66266 -0.56480 -0.74855 -0.57107 -0.12571 -0.63584 0.39453 0.30862 0.09010 0.21581 0.08869 0.20812 -0.35340 -0.12200 -0.16402 0.07364 0.06610 0.56613 0.72969 0.07547 -0.20182 -0.34069 0.08463 0.67354 -0.21527 -0.39912 -1.51511 -0.03535 1.16593 -0.41798 -0.34069 -0.76116 1.52569 0.61697 0.18558 0.34179 0.08423 -0.25362 -0.14979 -0.03769 0.05041 0.08467 -0.11780 0.04215 -0.01912 0.00003 -0.00018 -0.00015 -0.00023 -0.00009 -0.00035 0.00173 0.04609 0.09554 -0.00058 0.07616 -0.04562 -0.05353 -0.05311 -0.00945 0.05229 -0.14162 0.14891 -0.09493 -0.01087 -0.13663 -0.03855 -0.05533 -0.01806 -0.00689 -0.04667 0.02669 0.02901 -0.02020 0.00674 0.04776 -0.01406 -0.05024 0.05289 -0.02168 -0.01738 0.10650 -0.06551 0.00459 0.01235 -0.01934 -0.02618 0.06566 0.00601 -0.06759 0.07728 -0.08536 0.02622 0.06500 -0.04733 0.02105 -0.05729 0.05882 0.00167 0.05576 -0.12029 -0.09324 0.00982 -0.16689 0.12174 0.14050 0.27129 0.10463 0.41341 -0.54217 -0.17026 0.39468 0.68364 0.01307 -0.76180 -0.60239 -0.03131 0.23676 -0.09343 0.01975 -0.00876 -0.00512 0.00938 0.00055 -0.00177 -0.00022 0.00115 0.00123 -0.00023 -0.00062 0.00331 -0.00715 -0.00084 0.02049 0.01091 0.01642 -0.01690 -0.01064 -0.02153 0.01413 0.02224 -0.11494 0.10301 -0.07849 -0.02107 -0.12138 -0.02577 -0.06182 -0.00505 -0.05298 -0.20066 0.48122 0.37834 -0.00903 0.05777 -0.23976 -0.01226 -0.71176 0.89008 -0.79307 -0.42629 1.51137 -0.88252 0.38035 -0.06401 -0.30976 -0.33002 0.00895 0.33725 -0.52275 0.46965 -0.02835 0.14834 0.39631 -0.38361 1.05541 -0.32616 0.53732 0.24979 0.98458 -0.56105 -0.40603 -0.12354 0.22630 -0.67065 -0.30430 -1.39380 -0.01200 -0.75846 0.96078 0.36587 -0.65013 -1.24648 -0.33038 1.74943 0.38248 0.14480 0.07323 0.22209 -0.09206 0.00797 0.02849 -0.11742 0.06991 0.01483 0.00006 -0.00017 -0.00005 -0.00021 -0.00019 -0.00036 0.00168 0.04476 0.10019 -0.01241 0.05454 -0.04464 -0.05559 0.03316 0.14286 -0.00098 0.07751 0.03206 0.11508 -0.11803 0.13365 -0.08781 -0.02866 0.00618 0.00966 0.01252 0.01835 0.02160 0.03691 -0.02998 -0.04718 -0.01463 0.09509 -0.02638 -0.02081 0.02252 0.05588 0.08701 -0.01432 0.00445 0.01190 -0.00691 -0.05310 -0.05385 -0.02841 -0.04444 -0.09178 -0.09811 -0.03031 -0.00800 0.00736 -0.04984 0.02909 0.06788 0.12527 -0.13427 -0.02221 0.18265 -0.11708 0.11509 0.22220 0.15591 0.05243 -0.09826 0.19266 -0.44752 -0.98318 0.26042 0.12310 0.45500 -0.72241 -0.17241 0.22774 -0.11919 0.01687 -0.01432 -0.00553 0.00738 -0.00167 -0.00336 -0.00017 0.00015 0.00005 -0.00042 0.00123 0.00355 0.00790 -0.00411 0.01591 0.00704 0.01217 -0.02197 -0.02760 0.01879 0.08129 -0.01078 0.03525 0.02439 0.06013 -0.10452 0.11115 -0.05435 -0.01646 0.02715 -0.04550 0.07464 0.49479 0.41083 0.16400 -0.13169 -0.85035 -0.18042 0.91237 0.09365 -0.05529 0.48784 0.73974 1.48468 -0.23960 0.40677 -0.14403 -0.10988 0.06844 -0.22500 -0.62238 -0.76623 -1.24177 -0.05372 -0.67371 -0.01360 -0.35304 -0.13050 -0.09902 0.61359 -0.51749 -0.35547 -0.78610 0.17452 0.51768 -0.40959 -0.52529 -0.94239 -0.55612 0.30969 -0.14714 0.28874 1.98853 -0.44940 -0.38876 -1.28487 0.80348 0.57302 0.37254 0.24005 -0.04035 0.08128 0.07503 -0.07221 0.09003 0.01065</matrix>
                        <list dictRef="x:label">
                           <scalar dataType="xsd:string" dictRef="x:label">1   O  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2   C  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">3   C  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">4   C  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5   C  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6   C  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">3S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">4S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">5PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PX</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PY</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">6PZ</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">7   H  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">8   H  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">9   H  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">10  H  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">11  H  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">12  H  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">13  H  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">14  H  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">15  H  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">16  H  1S</scalar>
                           <scalar dataType="xsd:string" dictRef="x:label">2S</scalar>
                        </list>
                     </module>
                     <array dataType="xsd:integer" dictRef="cc:serial" size="1">1</array>
                     <module cmlx:templateRef="l601.grossorbpop">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="80">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</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="x:label" size="80">1   O  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|2   C  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|3   C  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|4   C  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|5   C  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|6   C  1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|7   H  1S|2S|8   H  1S|2S|9   H  1S|2S|10  H  1S|2S|11  H  1S|2S|12  H  1S|2S|13  H  1S|2S|14  H  1S|2S|15  H  1S|2S|16  H  1S|2S</array>
                        <matrix cols="1" dataType="xsd:double" dictRef="g:totaloccup" rows="80">1.13275 0.85894 0.97846 0.96370 1.06752 0.93207 1.30167 0.33015 0.28397 0.45728 1.17447 0.81403 0.76621 0.50939 0.84027 0.77622 0.93303 -0.02983 0.07840 0.14836 1.17434 0.81416 0.73078 0.53989 0.85646 0.85820 0.90268 0.01972 0.03410 0.15023 1.17440 0.81425 0.76301 0.61206 0.91626 0.71881 0.96095 0.13687 0.08410 0.20187 1.17426 0.81435 0.72484 0.69373 0.90293 0.88259 0.91570 0.20990 0.16385 0.21679 1.17426 0.81434 0.72547 0.69259 0.90591 0.88387 0.91355 0.21380 0.16243 0.21154 0.51644 0.25333 0.51441 0.27810 0.51417 0.26756 0.51368 0.27166 0.50983 0.28304 0.51016 0.26940 0.51095 0.26884 0.51002 0.28829 0.51078 0.27601 0.50924 0.24715</matrix>
                     </module>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l601.mullik">
                     <scalar dataType="xsd:string" dictRef="g:title">Mulliken charges:</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:serial">1</scalar>
                     <list cmlx:templateRef="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="16">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="16">O C C C C C H H H H H H H H H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="16">-0.306517 -0.010562 -0.080561 -0.382575 -0.698955 -0.697765 0.230233 0.207495 0.218269 0.214660 0.207131 0.220442 0.220208 0.201686 0.213206 0.243605</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">0.00000</scalar>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l716.dipole">
                     <array cmlx:templateRef="dipole"
                            dataType="xsd:double"
                            dictRef="x:d"
                            size="3">-4.77067057e-01 8.48353489e-01 -9.40767226e-02</array>
                  </module>
               </property>
               <property dictRef="cc:forces">
                  <scalar dictRef="cc:linkToAtoms">./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999']</scalar>
               </property>
               <property dictRef="cc:multipole">
                  <list cmlx:templateRef="multipole">
                     <array dataType="xsd:double" dictRef="cc:dipole" size="3">-1.2126 2.1563 -0.2391</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">2.4854</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-39.0174 -39.9458 -36.2997</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">4.6309 -0.4328 0.4223</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">-0.5965 -1.5248 2.1213 4.6309 -0.4328 0.4223</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">11.9947 -2.8940 1.3990 3.2177 7.8563 1.7230 4.8329 -0.0930 2.1168 0.1151</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-536.8868 -260.4618 -79.1836 18.0734 -6.6871 4.3818 0.0019 5.0039 0.4200 -140.9882 -100.6150 -58.4072 -1.7023 0.6593 2.5979</array>
                  </list>
               </property>
            </propertyList>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l9999.archive" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:string" dictRef="g:zmat">0</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:hfenergy" units="nonsi:hartree">-271.3420796</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsd" units="nonsi:unknown">4.005E-9</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsf" units="nonsi:unknown">1.322E-4</scalar>
                  <scalar dataType="xsd:string" dictRef="x:Quadrupole">-0.443457,-1.1336425,1.5770995,3.4429971,-0.3217848,0.3139766</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:pointgroup">C01 [X(C5H10O1)]</scalar>
                  <array dataType="xsd:double"
                         dictRef="cc:dipole"
                         size="3"
                         units="nonsi:debye">-0.4770671 0.8483535 -0.0940767</array>
                  <array dataType="xsd:double" dictRef="cc:forceConstants" size="1">@</array>
               </module>
            </module>
            <molecule formalCharge="0" id="mol9999" spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="1.61316487"
                        y3="-0.86577695"
                        z3="0.0143338">
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.0" size="3">0.000134480 0.000366171 0.000091720</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.1" size="3">-0.000295172 0.000100211 -0.000224188</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.2" size="3">0.000311549 -0.000141191 0.000039628</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.3" size="3">0.000062462 -0.000545521 0.000168883</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.4" size="3">-0.000157521 0.000035434 -0.000039338</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.5" size="3">-0.000063972 0.000031967 -0.000002005</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.6" size="3">0.000086762 0.000053563 0.000087358</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.7" size="3">-0.000084145 0.000021402 -0.000028341</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.8" size="3">-0.000063049 -0.000002474 -0.000062932</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.9" size="3">-0.000058354 0.000048726 -0.000059768</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.10" size="3">0.000012142 0.000013986 0.000028135</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.11" size="3">0.000019276 0.000004452 0.000009527</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.12" size="3">0.000013801 -0.000003353 0.000005234</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.13" size="3">0.000027078 -0.000009238 0.000017957</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.14" size="3">0.000031547 0.000018059 -0.000014427</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.15" size="3">0.000023117 0.000007806 -0.000017444</array>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a2"
                        x3="0.52865449"
                        y3="0.06907715"
                        z3="-0.48061053"/>
                  <atom elementType="C"
                        id="a3"
                        x3="-0.78320299"
                        y3="0.05532438"
                        z3="0.29158671"/>
                  <atom elementType="C"
                        id="a4"
                        x3="1.78949854"
                        y3="0.63473249"
                        z3="0.09536972"/>
                  <atom elementType="C"
                        id="a5"
                        x3="-1.60443311"
                        y3="1.32359846"
                        z3="-0.04719764"/>
                  <atom elementType="C"
                        id="a6"
                        x3="-1.57093536"
                        y3="-1.23967965"
                        z3="-0.01519874"/>
                  <atom elementType="H"
                        id="a7"
                        x3="0.42701193"
                        y3="0.05543681"
                        z3="-1.57764079"/>
                  <atom elementType="H"
                        id="a8"
                        x3="-0.53351796"
                        y3="0.06552012"
                        z3="1.37190423"/>
                  <atom elementType="H"
                        id="a9"
                        x3="2.5621776"
                        y3="1.0451128"
                        z3="-0.56676055"/>
                  <atom elementType="H"
                        id="a10"
                        x3="1.77361946"
                        y3="1.03949752"
                        z3="1.11623206"/>
                  <atom elementType="H"
                        id="a11"
                        x3="-1.84722899"
                        y3="1.35950172"
                        z3="-1.1267743"/>
                  <atom elementType="H"
                        id="a12"
                        x3="-2.55898202"
                        y3="1.32951507"
                        z3="0.50972513"/>
                  <atom elementType="H"
                        id="a13"
                        x3="-1.05255121"
                        y3="2.24681629"
                        z3="0.20891799"/>
                  <atom elementType="H"
                        id="a14"
                        x3="-1.84509815"
                        y3="-1.2902884"
                        z3="-1.08677541"/>
                  <atom elementType="H"
                        id="a15"
                        x3="-2.50511892"
                        y3="-1.28271916"
                        z3="0.57415848"/>
                  <atom elementType="H"
                        id="a16"
                        x3="-0.96495818"
                        y3="-2.13036867"
                        z3="0.22722984"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a1 a4" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a2 a4" order="S"/>
                  <bond atomRefs2="a2 a7" order="S"/>
                  <bond atomRefs2="a3 a5" order="S"/>
                  <bond atomRefs2="a3 a6" order="S"/>
                  <bond atomRefs2="a3 a8" order="S"/>
                  <bond atomRefs2="a4 a10" order="S"/>
                  <bond atomRefs2="a4 a9" order="S"/>
                  <bond atomRefs2="a5 a11" order="S"/>
                  <bond atomRefs2="a5 a13" order="S"/>
                  <bond atomRefs2="a5 a12" order="S"/>
                  <bond atomRefs2="a6 a14" order="S"/>
                  <bond atomRefs2="a6 a15" order="S"/>
                  <bond atomRefs2="a6 a16" order="S"/>
               </bondArray>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">76.05290000000001</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1S/C5H10O/c1-4(2)5-3-6-5/h4-5H,3H2,1-2H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:5,6,4,3,2,1/E:(1,2)/rA:16OCCCCCHHHHHHHHHH/rB:s1;s2;s1s2;s3;s3;s2;s3;s4;s4;s5;s5;s5;s6;s6;s6;/rC:;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
         </module>
      </module>
      <module cmlx:templateRef="job" dictRef="cc:job" id="job">
         <module dictRef="cc:environment" id="environment">
            <parameterList>
               <parameter dictRef="cc:program">
                  <scalar dataType="xsd:string">Gaussian 09</scalar>
               </parameter>
               <parameter dictRef="cc:hostname">
                  <scalar dataType="xsd:string">GINC-KIMIK2027</scalar>
               </parameter>
               <parameter dictRef="cc:jobname">
                  <scalar dataType="xsd:string">CBGUSER</scalar>
               </parameter>
               <parameter dictRef="cc:title">
                  <scalar dataType="xsd:string">000102618</scalar>
               </parameter>
               <parameter dictRef="cc:version">
                  <scalar dataType="xsd:string">EM64L-G09RevD.01</scalar>
               </parameter>
               <parameter dictRef="cc:run.date">
                  <scalar dataType="xsd:string">26-Jul-2017</scalar>
               </parameter>
               <parameter dictRef="cc:program">
                  <scalar dataType="xsd:string">Gaussian 09</scalar>
               </parameter>
               <parameter dictRef="cc:program.date">
                  <scalar dataType="xsd:string">24-Apr-2013</scalar>
               </parameter>
               <parameter dictRef="cc:version">
                  <scalar dataType="xsd:string">EM64L-G09RevD.01</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:degfreedom">
                  <scalar cmlx:templateRef="degfreedom" dataType="xsd:integer">42</scalar>
               </parameter>
               <parameter dictRef="cc:frameworkgroup">
                  <scalar cmlx:templateRef="framework" dataType="xsd:string">C1[X(C5H10O)]</scalar>
               </parameter>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string">RPBEPBE</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">SDD</scalar>
               </parameter>
               <parameter dictRef="g:operation">
                  <scalar dataType="xsd:string">Freq</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">#pfreq=noraman</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">PBEPBE/SDD</scalar>
               </parameter>
            </parameterList>
            <molecule cmlx:templateRef="mol"
                      formalCharge="0"
                      id="zmat"
                      spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="1.61317"
                        y3="-0.86578"
                        z3="0.01433"/>
                  <atom elementType="C"
                        id="a2"
                        x3="0.52865"
                        y3="0.06908"
                        z3="-0.48061"/>
                  <atom elementType="C"
                        id="a3"
                        x3="-0.7832"
                        y3="0.05532"
                        z3="0.29159"/>
                  <atom elementType="C"
                        id="a4"
                        x3="1.7895"
                        y3="0.63473"
                        z3="0.09537"/>
                  <atom elementType="C"
                        id="a5"
                        x3="-1.60443"
                        y3="1.3236"
                        z3="-0.0472"/>
                  <atom elementType="C"
                        id="a6"
                        x3="-1.57094"
                        y3="-1.23968"
                        z3="-0.0152"/>
                  <atom elementType="H"
                        id="a7"
                        x3="0.42701"
                        y3="0.05544"
                        z3="-1.57764"/>
                  <atom elementType="H"
                        id="a8"
                        x3="-0.53352"
                        y3="0.06552"
                        z3="1.3719"/>
                  <atom elementType="H"
                        id="a9"
                        x3="2.56218"
                        y3="1.04511"
                        z3="-0.56676"/>
                  <atom elementType="H"
                        id="a10"
                        x3="1.77362"
                        y3="1.0395"
                        z3="1.11623"/>
                  <atom elementType="H"
                        id="a11"
                        x3="-1.84723"
                        y3="1.3595"
                        z3="-1.12677"/>
                  <atom elementType="H"
                        id="a12"
                        x3="-2.55898"
                        y3="1.32952"
                        z3="0.50973"/>
                  <atom elementType="H"
                        id="a13"
                        x3="-1.05255"
                        y3="2.24682"
                        z3="0.20892"/>
                  <atom elementType="H"
                        id="a14"
                        x3="-1.8451"
                        y3="-1.29029"
                        z3="-1.08678"/>
                  <atom elementType="H"
                        id="a15"
                        x3="-2.50512"
                        y3="-1.28272"
                        z3="0.57416"/>
                  <atom elementType="H"
                        id="a16"
                        x3="-0.96496"
                        y3="-2.13037"
                        z3="0.22723"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a1 a4" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a2 a4" order="S"/>
                  <bond atomRefs2="a2 a7" order="S"/>
                  <bond atomRefs2="a3 a5" order="S"/>
                  <bond atomRefs2="a3 a6" order="S"/>
                  <bond atomRefs2="a3 a8" order="S"/>
                  <bond atomRefs2="a4 a10" order="S"/>
                  <bond atomRefs2="a4 a9" order="S"/>
                  <bond atomRefs2="a5 a11" order="S"/>
                  <bond atomRefs2="a5 a13" order="S"/>
                  <bond atomRefs2="a5 a12" order="S"/>
                  <bond atomRefs2="a6 a14" order="S"/>
                  <bond atomRefs2="a6 a15" order="S"/>
                  <bond atomRefs2="a6 a16" order="S"/>
               </bondArray>
               <formula concise="C 5 H 10 O 1"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">76.05290000000001</scalar>
               </property>
               <list cmlx:templateRef="charge">
                  <list>
                     <scalar dataType="xsd:integer" dictRef="g:charge">0</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:mult">1</scalar>
                  </list>
               </list>
               <formula convention="iupac:inchi"
                        inline="InChI=1S/C5H10O/c1-4(2)5-3-6-5/h4-5H,3H2,1-2H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:5,6,4,3,2,1/E:(1,2)/rA:16OCCCCCHHHHHHHHHH/rB:s1;s2;s1s2;s3;s3;s2;s3;s4;s4;s5;s5;s5;s6;s6;s6;/rC:;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="entering" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:string" dictRef="g:link0">g09</scalar>
                  <array dataType="xsd:string" dictRef="g:command" size="3">/mnt/data/applications/G09/g09/l1.exe "/scratch/Gau-16930.inp" -scrdir="/scratch/"</array>
               </module>
               <module cmlx:templateRef="l1" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l1.end">
                     <array dataType="xsd:string" dictRef="g:kk" size="1">chk=000102618-Freq.chk</array>
                     <array dataType="xsd:string" dictRef="g:kk" size="1">nprocshared=4</array>
                     <array dataType="xsd:string" dictRef="g:kk" size="1">mem=7GB</array>
                     <scalar cmlx:templateRef="title" dataType="xsd:string" dictRef="cc:title">#p freq=noraman PBEPBE/SDD</scalar>
                     <list cmlx:templateRef="control">
                        <scalar dataType="xsd:string" dictRef="g:control">1/10=4,30=1,38=1/1,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">2/12=2,17=6,18=5,40=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">3/5=17,6=7,11=2,16=1,25=1,30=1,71=2,74=1009,140=1/1,2,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">4//1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">5/5=2,38=5,98=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">8/6=4,10=90,11=11/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">11/6=1,8=1,9=11,15=111,16=1/1,2,10</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">10/6=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">6/7=2,8=2,9=2,10=2,18=1,28=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">7/8=1,10=1,25=1/1,2,3,16</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">1/10=4,30=1/3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">99//99</scalar>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l101" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l101.title">
                     <scalar cmlx:templateRef="title" dataType="xsd:string" dictRef="cc:title">000102618</scalar>
                  </module>
                  <module cmlx:templateRef="l101.isotope2">
                     <array cmlx:templateRef="atom"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="16">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16</array>
                     <array cmlx:templateRef="iatwgt"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="16">16 12 12 12 12 12 1 1 1 1 1 1 1 1 1 1</array>
                     <array cmlx:templateRef="atmwgt"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="16">15.9949146 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250</array>
                     <array cmlx:templateRef="nucspn"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="16">0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1</array>
                     <array cmlx:templateRef="atzeff"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="16">0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000</array>
                  </module>
                  <list cmlx:templateRef="rest">
                     <scalar dataType="xsd:string" dictRef="x:l101">(Enter /mnt/data/applications/G09/g09/l101.exe)</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l103" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="berny">
                     <scalar dataType="xsd:string" dictRef="g:optimization">Initialization pass.</scalar>
                  </list>
                  <module cmlx:templateRef="l103.trust">
                     <scalar dataType="xsd:double" dictRef="g:trustrad">3.00e-01</scalar>
                     <scalar dataType="xsd:double" dictRef="g:fncerr">1.00e-07</scalar>
                     <scalar dataType="xsd:double" dictRef="g:grderr">1.00e-07</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:nstep">2</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:allowedstep">2</scalar>
                  </module>
                  <module cmlx:templateRef="l103.catchall">
                     <list cmlx:templateRef="l103.discard">
                        <scalar dataType="xsd:string" dictRef="x:discard"/>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l103" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="berny">
                     <scalar dataType="xsd:string" dictRef="g:optimization">Search for a local minimum.</scalar>
                  </list>
                  <module cmlx:templateRef="l103.itemconverge">
                     <list cmlx:templateRef="row">
                        <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">0.000551 0.000134 0.004185 0.001418</array>
                        <array dataType="xsd:double" dictRef="g:threshold" size="4">0.000450 0.000300 0.001800 0.001200</array>
                        <array dataType="xsd:string" dictRef="g:converged" size="4">NO YES NO NO</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="preddelta">
                     <list cmlx:templateRef="predicted">
                        <scalar dataType="xsd:double" dictRef="g:predchange">-1.718899e-06</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="l103.catchall">
                     <list cmlx:templateRef="l103.discard">
                        <scalar dataType="xsd:string" dictRef="x:discard"/>
                     </list>
                  </module>
               </module>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation">
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l301">
                  <module cmlx:templateRef="l301.basis">
                     <scalar dataType="xsd:string" dictRef="cc:basis">SDD</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:diffuse">(6D, 10F)</scalar>
                     <module cmlx:templateRef="ernie">
                        <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                        <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                        <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                     </module>
                     <scalar dataType="xsd:double" dictRef="cc:nucrepener">243.1565207793</scalar>
                     <module cmlx:templateRef="symaddnuc">
                        <scalar dataType="xsd:integer" dictRef="cc:basiscount">80</scalar>
                        <scalar dataType="xsd:integer" dictRef="g:primbasis">184</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:cartesianbasis">80</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:alphae">24</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:betae">24</scalar>
                     </module>
                     <scalar dataType="xsd:string" dictRef="g:misc">IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX=  0.000000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  1.000000  1.000000  1.000000  1.000000 ScalE2=  1.000000  1.000000</scalar>
                     <module cmlx:templateRef="natoms">
                        <scalar dataType="xsd:integer" dictRef="cc:natoms">16</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">16</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">16</scalar>
                        <scalar dataType="xsd:double" dictRef="g:sfac">1.00e+00</scalar>
                        <scalar dataType="xsd:integer" dictRef="g:natfmm">60</scalar>
                        <scalar dataType="xsd:string" dictRef="g:big">F</scalar>
                     </module>
                  </module>
               </module>
               <module cmlx:templateRef="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.orient">
                     <molecule cmlx:templateRef="atom"
                               formalCharge="0"
                               id="mol.l202.orient"
                               spinMultiplicity="1">
                        <atomArray>
                           <atom elementType="O"
                                 id="a1"
                                 x3="1.613165"
                                 y3="-0.865777"
                                 z3="0.014334">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a2"
                                 x3="0.528654"
                                 y3="0.069077"
                                 z3="-0.480611">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a3"
                                 x3="-0.783203"
                                 y3="0.055324"
                                 z3="0.291587">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a4"
                                 x3="1.789499"
                                 y3="0.634732"
                                 z3="0.09537">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a5"
                                 x3="-1.604433"
                                 y3="1.323598"
                                 z3="-0.047198">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a6"
                                 x3="-1.570935"
                                 y3="-1.23968"
                                 z3="-0.015199">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a7"
                                 x3="0.427012"
                                 y3="0.055437"
                                 z3="-1.577641">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a8"
                                 x3="-0.533518"
                                 y3="0.06552"
                                 z3="1.371904">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a9"
                                 x3="2.562178"
                                 y3="1.045113"
                                 z3="-0.566761">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a10"
                                 x3="1.773619"
                                 y3="1.039498"
                                 z3="1.116232">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a11"
                                 x3="-1.847229"
                                 y3="1.359502"
                                 z3="-1.126774">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a12"
                                 x3="-2.558982"
                                 y3="1.329515"
                                 z3="0.509725">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a13"
                                 x3="-1.052551"
                                 y3="2.246816"
                                 z3="0.208918">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a14"
                                 x3="-1.845098"
                                 y3="-1.290288"
                                 z3="-1.086775">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a15"
                                 x3="-2.505119"
                                 y3="-1.282719"
                                 z3="0.574158">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a16"
                                 x3="-0.964958"
                                 y3="-2.130369"
                                 z3="0.22723">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a2" order="S"/>
                           <bond atomRefs2="a1 a4" order="S"/>
                           <bond atomRefs2="a2 a3" order="S"/>
                           <bond atomRefs2="a2 a4" order="S"/>
                           <bond atomRefs2="a2 a7" order="S"/>
                           <bond atomRefs2="a3 a5" order="S"/>
                           <bond atomRefs2="a3 a6" order="S"/>
                           <bond atomRefs2="a3 a8" order="S"/>
                           <bond atomRefs2="a4 a10" order="S"/>
                           <bond atomRefs2="a4 a9" order="S"/>
                           <bond atomRefs2="a5 a11" order="S"/>
                           <bond atomRefs2="a5 a13" order="S"/>
                           <bond atomRefs2="a5 a12" order="S"/>
                           <bond atomRefs2="a6 a14" order="S"/>
                           <bond atomRefs2="a6 a15" order="S"/>
                           <bond atomRefs2="a6 a16" order="S"/>
                        </bondArray>
                        <formula concise="C 5 H 10 O 1"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">76.05290000000001</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1S/C5H10O/c1-4(2)5-3-6-5/h4-5H,3H2,1-2H3">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:5,6,4,3,2,1/E:(1,2)/rA:16OCCCCCHHHHHHHHHH/rB:s1;s2;s1s2;s3;s3;s2;s3;s4;s4;s5;s5;s5;s6;s6;s6;/rC:;;;;;;;;;;;;;;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
                  <module cmlx:templateRef="l202.distmat">
                     <array dataType="xsd:double" dictRef="cc:distance" size="136">0.000000 1.514954 0.000000 2.582223 1.522317 0.000000 1.513006 1.497147 2.644430 0.000000 3.892311 2.512316 1.548455 3.466069 0.000000 3.206114 2.517484 1.546504 3.849437 2.563697 0.000000 2.188602 1.101813 2.226799 2.234037 2.842052 2.847867 0.000000 2.705283 2.135424 1.108842 2.711079 2.177951 2.168833 3.102021 0.000000 2.211289 2.257274 3.592773 1.097207 4.208105 4.754695 2.561303 3.781714 0.000000 2.206807 2.245342 2.861115 1.098293 3.584064 4.202479 3.168387 2.517317 1.858581 0.000000 4.269464 2.779846 2.201086 3.904448 1.107124 2.840367 2.660082 3.105417 4.455931 4.271302 0.000000 4.740415 3.478932 2.196483 4.423087 1.105152 2.802239 3.859603 2.538413 5.240800 4.384449 1.784831 0.000000 4.102699 2.778166 2.209529 3.269397 1.105668 3.531941 3.191088 2.525863 3.887420 3.204383 1.789668 1.789207 0.000000 3.654071 2.801786 2.199585 4.279423 2.823303 1.107250 2.685965 3.098961 5.014837 4.834900 2.650093 3.149891 3.849423 0.000000 4.177021 3.484777 2.198909 4.727536 2.826695 1.105393 3.875344 2.518205 5.691924 4.898381 3.210502 2.613584 3.834185 1.787284 0.000000 2.879451 2.751269 2.194181 3.905151 3.523369 1.104222 3.157988 2.513632 4.811943 4.282311 3.845898 3.819884 4.378100 1.790808 1.791917 0.000000</array>
                  </module>
                  <module cmlx:templateRef="l202.stoich">
                     <scalar cmlx:templateRef="stoich"
                             dataType="xsd:string"
                             dictRef="g:stoichiometry">C5H10O</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:pointgroup">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestconciseabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                  </module>
                  <module cmlx:templateRef="l202.orient">
                     <molecule cmlx:templateRef="atom"
                               formalCharge="0"
                               id="mol.l202.orient"
                               spinMultiplicity="1">
                        <atomArray>
                           <atom elementType="O"
                                 id="a1"
                                 x3="1.706882"
                                 y3="0.834084"
                                 z3="-0.065043">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a2"
                                 x3="0.604964"
                                 y3="-0.069308"
                                 z3="0.449492">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a3"
                                 x3="-0.715272"
                                 y3="-0.027526"
                                 z3="-0.307263">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a4"
                                 x3="1.844036"
                                 y3="-0.670966"
                                 z3="-0.137157">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a5"
                                 x3="-1.564359"
                                 y3="-1.272033"
                                 z3="0.050466">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a6"
                                 x3="-1.466103"
                                 y3="1.289269"
                                 z3="-0.000705">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a7"
                                 x3="0.516845"
                                 y3="-0.045375"
                                 z3="1.547515">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a8"
                                 x3="-0.478882"
                                 y3="-0.051675"
                                 z3="-1.390345">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a9"
                                 x3="2.613908"
                                 y3="-1.096259"
                                 z3="0.518806">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a10"
                                 x3="1.805649"
                                 y3="-1.082356"
                                 z3="-1.154768">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a11"
                                 x3="-1.795044"
                                 y3="-1.294149"
                                 z3="1.133064">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a12"
                                 x3="-2.52535"
                                 y3="-1.257515"
                                 z3="-0.495104">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a13"
                                 x3="-1.039228"
                                 y3="-2.210802"
                                 z3="-0.205369">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a14"
                                 x3="-1.72604"
                                 y3="1.354378"
                                 z3="1.07363">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a15"
                                 x3="-2.405882"
                                 y3="1.351978"
                                 z3="-0.579305">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a16"
                                 x3="-0.840629"
                                 y3="2.162489"
                                 z3="-0.256782">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a2" order="S"/>
                           <bond atomRefs2="a1 a4" order="S"/>
                           <bond atomRefs2="a2 a3" order="S"/>
                           <bond atomRefs2="a2 a4" order="S"/>
                           <bond atomRefs2="a2 a7" order="S"/>
                           <bond atomRefs2="a3 a5" order="S"/>
                           <bond atomRefs2="a3 a6" order="S"/>
                           <bond atomRefs2="a3 a8" order="S"/>
                           <bond atomRefs2="a4 a10" order="S"/>
                           <bond atomRefs2="a4 a9" order="S"/>
                           <bond atomRefs2="a5 a11" order="S"/>
                           <bond atomRefs2="a5 a13" order="S"/>
                           <bond atomRefs2="a5 a12" order="S"/>
                           <bond atomRefs2="a6 a14" order="S"/>
                           <bond atomRefs2="a6 a15" order="S"/>
                           <bond atomRefs2="a6 a16" order="S"/>
                        </bondArray>
                        <formula concise="C 5 H 10 O 1"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">76.05290000000001</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1S/C5H10O/c1-4(2)5-3-6-5/h4-5H,3H2,1-2H3">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:5,6,4,3,2,1/E:(1,2)/rA:16OCCCCCHHHHHHHHHH/rB:s1;s2;s1s2;s3;s3;s2;s3;s4;s4;s5;s5;s5;s6;s6;s6;/rC:;;;;;;;;;;;;;;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">5.7588579 2.5672303 1.9542554</array>
                  </module>
               </module>
               <module cmlx:templateRef="l302">
                  <module cmlx:templateRef="l302.basis">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="11">NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="5">One-electron integrals computed using PRISM.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="6">1 Symmetry operations used in ECPInt.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">ECPInt: NShTT= 1596 NPrTT= 7906 LenC2= 1579 LenP2D= 6058.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="6">LDataN: DoStor=T MaxTD1= 2 Len= 12</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NBasis= 80 RedAO= T EigKep= 3.60D-03 NBF= 80</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="7">NBsUse= 80 1.00D-06 EigRej= -1.00D+00 NBFU= 80</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l302.basis2">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="5">Precomputing XC quadrature grid using</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">IXCGrd= 4 IRadAn= 0 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">NSgBfM= 80 80 80 80 80 MxSgAt= 16 MxSgA2= 16.</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l303.basis">
                  <list cmlx:templateRef="l303">
                     <scalar dataType="xsd:integer" dictRef="g:dipdrv">1</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l401"/>
               <module cmlx:templateRef="l502">
                  <scalar dataType="xsd:string" dictRef="g:l502.type">Closed</scalar>
                  <module cmlx:templateRef="l502.cycle">
                     <list cmlx:templateRef="cycle">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="cc:cycle">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:pass">0</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:idiag">1</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="l502.e">
                        <list cmlx:templateRef="l502.e">
                           <scalar dataType="xsd:double" dictRef="g:l502.e">-271.203381293496</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.245066749893</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.041685456397</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.331859394876</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.086792644983</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.335044011933</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.003184617057</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.341963395511</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.006919383578</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342089760735</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000126365224</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342092828065</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000003067330</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342093636854</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000808789</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342086753066</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000006883789</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342086812552</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000059486</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342086809892</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000000002659</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342086816385</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000006493</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342086817058</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000673</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342086817082</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000024</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-271.342086817086</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000003</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <module cmlx:templateRef="l502.footer">
                     <list cmlx:templateRef="scfdone">
                        <list>
                           <scalar dataType="xsd:double" dictRef="g:rbhflyp" units="nonsi:hartree">-271.342086817</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:ncycle">15</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="scfdone">
                        <list cmlx:templateRef="scfdone">
                           <list>
                              <scalar dataType="xsd:double" dictRef="cc:kinener">2.699634833512e+02</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:potener">-1.118425344205e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:eener">3.339632532575e+02</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <list cmlx:templateRef="l502">
                     <scalar dataType="xsd:string" dictRef="g:l502">Using DIIS extrapolation, IDIIS=  1040.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Integral symmetry usage will be decided dynamically.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Keep J ints in memory in canonical form, NReq=6192324.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">IVT=       38878 IEndB=       38878 NGot=   939524096 MDV=   934234799</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">LenX=   934234799 LenY=   934227958</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on RMS density matrix=1.00D-08 within 128 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on MAX density matrix=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on             energy=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">No special actions if energy rises.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">FoFCou: FMM=F IPFlag=           0 FMFlag=           0 FMFlg1=           0</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NFxFlg=           0 DoJE=F BraDBF=F KetDBF=F FulRan=T</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">wScrn=  0.000000 ICntrl=     600 IOpCl=  0 I1Cent=           0 NGrid=           0</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NMat0=    1 NMatS0=   3240 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Symmetry not used in FoFCou.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Integral accuracy reduced to 1.0D-05 until final iterations.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502"/>
                  </list>
               </module>
               <module cmlx:templateRef="l1101">
                  <list cmlx:templateRef="l1101">
                     <scalar dataType="xsd:string" dictRef="g:l1101">Using compressed storage, NAtomX=    16.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l1101">Will process     17 centers per pass.</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l1002.minotr">
                  <list cmlx:templateRef="l1002">
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="4">Minotr: Closed shell wavefunction.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="1">IDoAtm=1111111111111111</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="3">Direct CPHF calculation.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="7">Differentiating once with respect to electric field.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="5">with respect to dipole field.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="7">Differentiating once with respect to nuclear coordinates.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="8">Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="8">Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="7">NewPWx=T KeepS1=F KeepF1=F KeepIn=T MapXYZ=F SortEE=F KeepMc=T.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="5">MDV= 939523852 using IRadAn= 2.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="5">Generate precomputed XC quadrature information.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="9">Keep J ints in memory in canonical form, NReq=6185704.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="8">FoFCou: FMM=F IPFlag= 0 FMFlag= 0 FMFlg1= 0</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="6">NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="10">wScrn= 0.000000 ICntrl= 600 IOpCl= 0 I1Cent= 0 NGrid= 0</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">NMat0= 1 NMatS0= 3240 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="5">Symmetry not used in FoFCou.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="6">Solving linear equations simultaneously, MaxMat= 0.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="14">There are 51 degrees of freedom in the 1st order CPHF. IDoFFX=6 NUNeed= 3.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">48 vectors produced by pass 0 Test12= 2.64D-15 1.96D-09 XBig12= 5.32D+01 3.77D+00.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="10">AX will form 48 AO Fock derivatives at one time.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">48 vectors produced by pass 1 Test12= 2.64D-15 1.96D-09 XBig12= 1.11D+01 5.96D-01.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">48 vectors produced by pass 2 Test12= 2.64D-15 1.96D-09 XBig12= 2.69D-02 2.50D-02.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">48 vectors produced by pass 3 Test12= 2.64D-15 1.96D-09 XBig12= 2.65D-06 1.83D-04.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">16 vectors produced by pass 4 Test12= 2.64D-15 1.96D-09 XBig12= 1.29D-10 1.76D-06.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">2 vectors produced by pass 5 Test12= 2.64D-15 1.96D-09 XBig12= 3.55D-15 7.66D-09.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="6">InvSVY: IOpt=1 It= 1 EMax= 5.33D-15</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="9">Solved reduced A of dimension 210 with 51 vectors.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="6">FullF1: Do perturbations 1 to 3.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="7">Isotropic polarizability for W= 0.000000 55.59 Bohr**3.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="10">End of Minotr F.D. properties file 721 does not exist.</array>
                  </list>
               </module>
               <module cmlx:templateRef="l601.polariz">
                  <array dataType="xsd:double" dictRef="g:l601.pol.exact" size="6">63.649 -3.023 54.804 -2.023 0.889 48.321</array>
                  <array dataType="xsd:double" dictRef="g:l601.pol.approx" size="6">92.703 -1.082 89.314 -6.115 0.806 79.112</array>
               </module>
               <module cmlx:templateRef="l716">
                  <list cmlx:templateRef="l716">
                     <scalar dataType="xsd:string" dictRef="g:l716">(Enter /mnt/data/applications/G09/g09/l716.exe)</scalar>
                  </list>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:jobtime">
                  <scalar dataType="xsd:string">PT215.800S</scalar>
               </property>
               <property dictRef="cc:jobdatetime.end">
                  <scalar dataType="xsd:date">2017-07-26T19:41:46.000+02:00</scalar>
               </property>
               <property dictRef="cc:popanal">
                  <module cmlx:templateRef="l601.popanal">
                     <array dataType="xsd:double" dictRef="g:alphaocc" size="24">-18.76498 -9.94930 -9.94431 -9.91040 -9.88978 -9.88186 -0.95205 -0.72572 -0.61875 -0.60710 -0.56914 -0.51105 -0.43681 -0.42296 -0.38869 -0.37000 -0.36083 -0.33930 -0.32385 -0.30652 -0.29743 -0.29145 -0.26106 -0.20650</array>
                     <array dataType="xsd:double" dictRef="g:alphavirt" size="56">0.03277 0.04795 0.08663 0.10324 0.11716 0.11808 0.12934 0.13961 0.16160 0.17118 0.18748 0.19362 0.19773 0.21512 0.22940 0.23932 0.26260 0.27856 0.29735 0.31510 0.31838 0.33031 0.33416 0.37609 0.38553 0.41442 0.43897 0.44311 0.46223 0.48298 0.52893 0.63709 0.77191 0.81151 0.83505 0.84022 0.92964 0.95517 0.98830 1.03582 1.05175 1.07427 1.09891 1.12754 1.14227 1.15574 1.23002 1.27595 1.36361 1.62037 22.40814 22.53421 22.61675 22.62817 22.66661 41.49284</array>
                     <module cmlx:templateRef="l601.state">
                        <scalar dataType="xsd:string" dictRef="g:l601.state">1-A.</scalar>
                     </module>
                     <module cmlx:templateRef="mulliken">
                        <module cmlx:templateRef="l601.mullik">
                           <scalar dataType="xsd:string" dictRef="g:title">Mulliken charges:</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:serial">1</scalar>
                           <list cmlx:templateRef="row">
                              <array dataType="xsd:integer" dictRef="cc:serial" size="16">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16</array>
                              <array dataType="xsd:string" dictRef="cc:elementType" size="16">O C C C C C H H H H H H H H H H</array>
                              <array dataType="xsd:double" dictRef="x:charge" size="16">-0.306504 -0.010614 -0.080537 -0.382582 -0.698991 -0.697743 0.230252 0.207486 0.218269 0.214666 0.207140 0.220450 0.220220 0.201687 0.213200 0.243600</array>
                           </list>
                           <scalar dataType="xsd:double" dictRef="x:chargesum">0.00000</scalar>
                        </module>
                     </module>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l601.mullik">
                     <scalar dataType="xsd:string" dictRef="g:title">Mulliken charges with hydrogens summed into heavy atoms:</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:serial">1</scalar>
                     <list cmlx:templateRef="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="6">1 2 3 4 5 6</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="6">O C C C C C</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="6">-0.306504 0.219638 0.126949 0.050353 -0.051181 -0.039255</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">0.00000</scalar>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l716.dipole">
                     <array cmlx:templateRef="dipole"
                            dataType="xsd:double"
                            dictRef="x:d"
                            size="3">-4.97338246e-01 -8.35241710e-01 1.05875495e-01</array>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l716.polarizability">
                     <array cmlx:templateRef="polariz"
                            dataType="xsd:double"
                            dictRef="cc:polarizability"
                            size="6">6.36490789e+01 -3.02260365e+00 5.48040237e+01 -2.02320934e+00 8.89226421e-01 4.83206497e+01</array>
                  </module>
               </property>
               <property dictRef="cc:frequencies">
                  <module cmlx:templateRef="l716.forcematrix">
                     <module cmlx:templateRef="lowfreq">
                        <array cmlx:templateRef="lowfreq"
                               dataType="xsd:double"
                               dictRef="g:1716.lowfreq"
                               size="9">-11.6092 -3.9836 -0.0005 -0.0005 -0.0004 13.5842 84.1443 193.0881 205.1380</array>
                     </module>
                     <module cmlx:templateRef="l716.freq.chunkx" dictRef="cc:vibrations">
                        <array dataType="xsd:integer" dictRef="x:serial" size="42">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</array>
                        <array dataType="xsd:string"
                               delimiter="|"
                               dictRef="cc:irrep"
                               size="42">A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A</array>
                        <array dataType="xsd:double" dictRef="cc:frequency" size="42">84.1325 193.0784 205.1329 224.3397 291.8542 319.8871 454.2757 465.8136 724.9461 778.9629 838.6561 913.3557 919.7600 956.8385 959.6323 1012.4783 1096.8779 1107.1604 1128.1822 1161.6966 1196.4234 1238.3106 1277.5352 1305.0625 1378.0997 1387.8522 1406.9516 1468.1600 1468.5210 1478.0632 1481.6721 1490.2544 2972.6259 2975.5934 2988.6671 3055.2976 3060.9131 3064.2852 3072.2069 3077.1312 3087.7072 3162.5803</array>
                        <array dataType="xsd:double" dictRef="cc:redmass" size="42">3.1187 2.2295 1.1833 1.1104 2.4496 2.0869 3.0520 2.9908 3.8512 2.5788 3.8394 1.8027 1.2198 1.3205 1.3611 1.1962 1.3018 1.3546 2.2073 1.9420 2.0865 1.5448 1.4117 1.3842 1.2042 1.4743 1.5220 1.0485 1.0471 1.1739 1.0606 1.0903 1.0357 1.0368 1.0837 1.0638 1.0796 1.0990 1.0980 1.0994 1.0999 1.1185</array>
                        <array dataType="xsd:double" dictRef="cc:forceconst" size="42">0.0130 0.0490 0.0293 0.0329 0.1229 0.1258 0.3711 0.3824 1.1925 0.9219 1.5910 0.8861 0.6080 0.7123 0.7385 0.7225 0.9228 0.9783 1.6553 1.5441 1.7597 1.3957 1.3575 1.3891 1.3474 1.6731 1.7751 1.3316 1.3304 1.5110 1.3719 1.4267 5.3919 5.4087 5.7033 5.8510 5.9594 6.0803 6.1060 6.1331 6.1783 6.5913</array>
                        <array dataType="xsd:double" dictRef="cc:irintensity" size="42">4.2957 5.0520 0.7067 0.0772 1.4434 0.0843 3.0429 6.3374 5.8584 21.3432 23.9839 1.9096 6.6616 12.8938 5.6680 0.4858 2.4685 6.5257 2.0996 3.5401 6.7072 3.5131 5.6584 0.7511 19.7562 4.6943 10.4515 0.5845 6.3097 1.8793 16.7746 20.9946 31.2946 24.8768 11.6941 24.6801 15.1982 10.3650 80.4938 51.1140 30.4265 35.0213</array>
                        <array dataType="xsd:integer" dictRef="cc:atomicNumber" size="16">8 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:double" dictRef="cc:displacement" size="2016">-0.09 0.08 0.17 0.00 -0.15 -0.02 0.00 -0.10 -0.01 0.07 0.11 -0.15 -0.12 0.02 0.12 0.14 0.01 -0.11 0.00 -0.39 -0.02 -0.03 -0.21 -0.02 0.12 0.05 -0.24 0.12 0.32 -0.24 -0.13 0.16 0.12 -0.11 0.05 0.11 -0.21 -0.06 0.22 0.18 0.14 -0.11 0.13 0.05 -0.09 0.23 -0.09 -0.22 0.11 -0.04 0.14 -0.01 0.03 -0.02 -0.01 0.07 -0.01 -0.08 -0.05 -0.11 0.11 0.01 0.06 -0.13 0.01 -0.07 -0.01 -0.13 -0.02 -0.03 0.04 -0.02 -0.13 -0.26 -0.19 -0.15 0.13 -0.18 -0.04 0.16 0.03 0.19 -0.23 -0.08 0.29 0.04 0.30 0.08 0.15 -0.02 -0.26 -0.23 0.12 -0.32 0.07 -0.34 0.03 -0.01 0.05 0.00 0.01 -0.01 0.00 0.02 -0.01 -0.02 -0.01 -0.03 0.04 0.00 0.05 -0.05 0.00 -0.05 -0.01 -0.04 -0.01 -0.01 0.00 -0.01 -0.04 -0.08 -0.06 -0.04 0.05 -0.06 0.42 -0.18 0.13 -0.15 0.15 0.39 -0.10 0.02 -0.30 -0.40 -0.14 -0.13 0.15 0.12 -0.36 0.07 0.02 0.27 0.01 0.00 0.02 -0.02 0.00 -0.05 -0.02 0.00 -0.05 0.02 0.00 0.05 0.00 0.00 0.00 0.01 0.00 0.01 -0.08 0.00 -0.05 -0.07 0.00 -0.06 -0.03 0.01 0.12 0.11 -0.01 0.05 0.35 -0.18 0.07 -0.17 0.16 0.31 -0.15 0.01 -0.34 0.39 0.16 0.09 -0.20 -0.14 0.33 -0.13 0.00 -0.34 0.12 0.00 0.02 0.02 -0.01 -0.15 -0.02 -0.01 -0.11 0.14 0.01 0.05 -0.12 0.10 0.06 -0.12 -0.09 0.06 -0.06 -0.03 -0.15 -0.15 -0.01 -0.13 0.01 0.01 0.22 0.38 0.01 0.04 -0.18 0.36 0.05 -0.09 0.09 0.01 -0.21 -0.01 0.29 -0.20 -0.36 0.06 -0.09 -0.07 0.02 -0.20 0.03 0.29 0.06 0.00 -0.03 0.10 0.00 0.13 0.07 -0.01 0.13 0.04 0.02 -0.05 -0.12 0.06 -0.06 -0.10 -0.07 -0.06 0.22 0.02 0.13 0.17 -0.02 0.15 0.14 0.01 -0.18 -0.13 0.01 -0.04 -0.13 -0.10 -0.06 -0.12 0.39 -0.05 -0.34 -0.01 -0.25 -0.10 0.08 -0.07 -0.13 -0.38 -0.05 -0.29 0.01 -0.24 0.20 0.02 0.01 0.01 0.05 -0.06 -0.18 -0.04 0.12 0.07 0.05 0.00 -0.12 -0.20 -0.01 -0.02 0.13 -0.01 0.10 0.09 -0.05 -0.29 -0.07 0.08 -0.05 -0.06 0.07 0.16 0.08 -0.02 -0.24 -0.45 -0.04 -0.05 -0.24 -0.14 0.04 -0.08 -0.14 -0.08 0.37 -0.04 0.04 0.29 -0.11 0.22 -0.07 -0.10 0.14 0.09 0.04 -0.03 0.18 0.02 0.04 -0.11 -0.09 -0.20 0.03 -0.01 -0.07 -0.04 0.00 0.13 -0.15 0.02 -0.10 0.31 0.00 0.06 -0.18 -0.08 -0.20 -0.17 -0.15 -0.44 0.08 -0.03 -0.07 0.08 0.00 -0.08 0.12 0.02 -0.25 -0.14 0.04 0.25 -0.30 0.06 0.07 0.04 0.14 0.19 -0.17 0.12 -0.14 0.12 0.08 0.14 0.19 -0.21 0.05 -0.01 0.13 -0.03 -0.27 -0.01 0.01 0.01 0.02 0.03 -0.05 0.01 0.13 -0.08 -0.19 -0.19 -0.04 0.07 -0.22 -0.21 0.24 0.35 -0.01 -0.11 -0.23 -0.21 -0.04 0.13 0.26 -0.20 -0.08 0.00 -0.13 -0.12 0.15 -0.04 0.12 -0.19 -0.14 0.01 -0.06 -0.09 -0.09 -0.08 0.08 0.11 0.19 0.06 -0.02 -0.01 -0.11 0.14 -0.09 -0.03 -0.06 -0.08 -0.01 -0.05 0.08 -0.01 -0.01 0.33 0.06 0.05 -0.04 -0.10 0.53 0.10 -0.38 -0.23 -0.04 -0.04 0.05 0.06 0.02 -0.13 -0.17 0.10 -0.08 -0.12 0.09 0.10 -0.12 0.04 -0.13 0.27 0.14 -0.02 0.10 0.11 0.05 0.27 -0.04 0.12 -0.18 0.04 0.07 0.00 -0.10 -0.09 -0.17 0.07 -0.06 -0.12 -0.02 -0.07 0.15 0.01 0.11 -0.34 0.04 0.20 0.12 -0.08 0.04 -0.05 -0.01 -0.26 -0.26 0.12 0.13 0.19 0.04 -0.18 -0.22 0.19 -0.16 -0.24 0.19 -0.04 0.00 0.03 -0.11 0.08 0.06 -0.19 0.27 0.08 -0.03 -0.08 -0.01 -0.03 0.05 0.00 0.14 0.01 -0.01 -0.03 0.08 -0.03 -0.02 -0.12 0.05 0.01 0.12 -0.02 0.04 -0.10 0.00 0.25 -0.15 0.02 -0.36 -0.10 0.24 0.30 0.16 -0.07 -0.17 -0.12 0.02 0.04 0.16 -0.06 -0.24 -0.24 0.02 0.03 -0.23 0.01 -0.08 -0.06 0.10 -0.28 0.38 0.18 -0.01 -0.03 0.00 -0.01 0.03 -0.01 0.03 -0.04 0.00 0.00 0.02 -0.01 0.05 -0.05 -0.05 -0.05 0.00 0.06 0.01 0.00 0.00 0.08 0.34 0.01 -0.09 -0.03 0.06 0.08 0.05 -0.02 0.12 0.42 -0.02 -0.05 0.17 0.13 -0.32 -0.32 0.23 -0.12 0.42 0.01 0.07 0.09 -0.12 0.19 -0.23 -0.18 0.00 -0.02 0.02 -0.03 -0.02 -0.08 0.06 0.03 -0.01 0.01 0.03 0.03 -0.03 -0.05 0.02 0.08 0.03 0.06 -0.27 0.26 -0.11 -0.19 0.15 -0.07 0.21 0.08 -0.18 -0.31 -0.08 0.07 -0.05 -0.06 0.01 -0.01 -0.03 -0.01 -0.04 -0.05 0.02 -0.28 0.17 -0.04 0.20 -0.51 -0.20 -0.24 0.20 -0.10 0.01 0.01 0.01 -0.02 -0.04 -0.04 0.02 -0.06 -0.01 0.00 0.01 0.02 0.11 0.01 0.05 -0.08 0.05 0.00 -0.18 -0.01 -0.06 -0.18 -0.24 -0.05 0.19 0.14 -0.13 -0.26 -0.17 0.10 -0.26 -0.12 -0.04 0.27 0.52 -0.23 -0.22 -0.12 -0.11 0.05 0.03 0.03 -0.11 0.27 0.07 0.08 -0.04 0.04 0.02 -0.03 0.02 0.01 0.07 0.00 0.00 0.04 0.00 -0.04 0.02 -0.05 -0.02 -0.02 0.00 0.02 -0.03 0.00 0.00 -0.57 0.01 -0.02 0.08 -0.01 0.07 0.55 0.15 -0.02 -0.53 0.17 -0.01 -0.02 0.01 -0.03 -0.04 0.02 -0.01 -0.02 0.01 0.01 -0.01 -0.01 0.03 -0.04 -0.02 0.02 -0.03 -0.02 0.02 0.02 0.05 -0.05 -0.06 0.01 0.00 -0.01 0.03 -0.05 -0.05 -0.09 0.01 0.00 -0.02 0.00 0.02 -0.01 0.03 0.67 -0.01 0.15 -0.04 0.07 0.08 0.47 0.08 0.44 -0.22 -0.05 0.05 0.07 -0.01 -0.01 0.02 0.02 -0.01 -0.02 0.04 0.01 -0.05 0.00 -0.03 0.00 0.04 -0.02 0.04 0.03 0.04 0.01 -0.05 -0.06 0.03 0.05 -0.01 0.06 -0.03 -0.05 -0.08 0.06 0.01 -0.03 0.03 0.02 -0.03 0.00 -0.21 -0.26 0.05 -0.01 0.12 -0.02 0.42 0.25 -0.28 0.42 0.51 -0.20 -0.11 -0.06 0.01 0.05 0.11 -0.04 -0.08 -0.06 -0.03 0.00 -0.01 -0.01 0.03 -0.05 -0.03 0.02 -0.03 -0.02 -0.03 0.02 0.01 0.00 -0.07 0.00 0.02 0.25 -0.01 0.06 0.00 -0.02 -0.02 -0.10 0.09 -0.01 -0.12 -0.07 -0.01 0.30 -0.02 0.07 0.55 -0.01 -0.11 -0.18 0.06 -0.14 -0.18 0.06 -0.25 -0.20 0.04 0.05 0.12 -0.06 -0.16 -0.14 -0.04 0.23 -0.13 -0.01 -0.03 0.20 0.03 0.21 -0.25 0.00 0.00 0.00 0.00 -0.03 0.00 -0.07 -0.13 0.03 0.16 0.02 0.00 0.05 0.08 -0.04 -0.09 0.08 0.01 -0.10 0.17 -0.09 -0.05 -0.09 0.06 0.17 0.15 -0.03 -0.12 -0.18 0.03 0.04 0.11 0.40 -0.06 -0.05 0.19 0.14 -0.20 -0.25 0.19 0.13 -0.46 -0.05 -0.09 -0.14 0.16 -0.13 0.23 0.19 0.00 0.04 -0.01 0.02 0.01 0.19 -0.15 0.01 -0.11 0.06 -0.03 -0.09 0.08 -0.01 0.01 0.08 0.01 0.02 -0.01 0.04 0.21 -0.54 -0.04 -0.19 -0.25 -0.21 0.19 0.20 -0.20 -0.03 -0.14 0.08 -0.04 0.10 0.24 -0.05 -0.17 -0.12 -0.05 -0.16 -0.04 -0.04 0.10 -0.28 -0.06 -0.15 0.13 -0.07 -0.02 -0.05 0.02 0.12 -0.05 -0.03 -0.01 0.02 -0.06 -0.12 0.05 0.07 0.01 -0.01 0.01 0.00 -0.01 0.00 0.79 0.14 0.01 -0.37 0.05 -0.15 0.03 0.27 0.01 -0.02 0.24 0.01 -0.04 -0.02 0.00 0.03 0.02 -0.03 -0.04 -0.02 -0.04 -0.01 0.00 -0.01 0.01 0.00 -0.03 -0.01 -0.01 -0.03 0.01 0.01 0.01 -0.08 0.02 -0.03 -0.10 -0.05 -0.07 0.04 -0.02 0.01 0.02 0.01 0.07 0.03 0.02 0.04 0.50 -0.05 0.01 0.70 0.21 0.09 0.08 -0.07 -0.07 -0.07 -0.09 0.04 -0.12 -0.09 0.02 0.12 0.11 -0.11 -0.02 0.05 -0.14 -0.11 0.02 0.00 0.06 -0.13 -0.04 -0.06 0.04 -0.09 0.00 -0.01 0.00 0.04 0.00 0.01 0.00 -0.15 0.02 -0.02 0.01 -0.01 -0.01 0.04 0.04 0.01 0.04 -0.06 -0.19 0.01 0.00 -0.15 0.88 -0.04 -0.06 0.05 0.06 0.03 0.04 -0.02 -0.02 -0.12 0.03 0.06 -0.03 -0.08 0.05 0.09 -0.06 0.03 -0.16 -0.04 -0.11 0.03 0.12 -0.04 0.11 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.07 -0.02 -0.05 0.08 0.02 -0.02 0.00 0.00 0.02 -0.01 0.00 -0.01 0.01 0.01 0.00 0.01 0.00 -0.19 -0.33 -0.06 -0.08 -0.34 0.16 -0.31 -0.19 0.13 0.16 -0.38 0.08 0.05 -0.38 -0.17 0.33 -0.25 -0.14 0.00 -0.02 0.00 0.12 -0.02 -0.02 -0.09 0.02 -0.01 -0.04 0.03 0.01 0.07 0.06 -0.01 0.05 -0.07 0.00 -0.32 0.04 -0.05 0.32 -0.08 0.08 -0.07 0.11 0.08 -0.05 0.11 -0.02 -0.28 -0.24 -0.08 -0.07 -0.26 0.19 -0.30 -0.17 0.05 -0.22 0.27 -0.08 -0.05 0.26 0.17 -0.27 0.18 0.05 -0.01 -0.02 0.00 0.16 -0.03 -0.01 -0.09 0.02 -0.01 -0.04 0.03 0.00 -0.02 -0.07 0.03 -0.01 0.05 0.02 -0.41 0.05 -0.05 0.33 -0.07 0.07 -0.11 0.15 0.14 -0.09 0.15 -0.03 0.06 0.33 0.04 0.07 0.29 -0.12 0.22 0.15 -0.20 0.00 -0.27 0.04 0.03 -0.25 -0.09 0.19 -0.17 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.03 -0.01 0.03 -0.03 -0.01 -0.03 0.00 0.00 0.00 -0.01 -0.01 0.00 0.00 -0.02 -0.02 0.02 -0.02 0.01 -0.26 0.37 -0.04 -0.02 -0.27 0.08 -0.12 0.06 -0.48 0.34 0.29 0.06 0.04 -0.22 -0.13 0.06 0.07 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.02 0.00 0.00 0.00 0.00 -0.02 0.01 0.03 0.03 0.01 -0.03 0.01 0.00 0.00 -0.01 -0.07 0.00 0.01 -0.01 -0.01 0.01 -0.01 0.00 0.30 0.08 0.08 0.19 -0.25 -0.35 -0.27 -0.10 -0.15 -0.38 0.08 -0.11 -0.26 -0.20 0.42 0.28 -0.14 0.12 0.01 0.01 -0.01 -0.05 0.00 0.01 0.00 0.00 0.00 0.07 -0.08 -0.03 -0.01 0.01 0.00 -0.01 -0.01 0.00 0.04 0.00 0.02 -0.01 -0.02 -0.01 -0.14 0.41 0.50 -0.49 0.42 -0.19 0.13 -0.08 0.03 0.06 0.00 -0.10 -0.05 -0.04 0.08 0.12 0.10 0.02 0.04 -0.03 -0.08 -0.03 0.05 0.12 0.00 0.00 0.00 0.02 0.00 0.00 -0.03 0.00 0.02 -0.02 0.02 0.01 -0.02 0.03 0.02 -0.01 -0.02 0.02 -0.07 0.00 0.00 0.01 0.00 0.03 0.02 -0.07 -0.08 0.09 -0.07 0.03 0.41 0.00 0.10 0.23 -0.21 -0.42 -0.30 -0.14 -0.04 0.31 -0.08 0.09 0.23 0.18 -0.34 -0.25 0.13 -0.11 0.00 0.00 0.00 0.04 0.00 0.00 -0.05 0.00 -0.03 -0.02 0.02 0.01 -0.02 0.01 -0.02 -0.02 0.00 -0.03 -0.04 0.00 0.00 0.10 -0.01 0.00 0.01 -0.07 -0.09 0.10 -0.07 0.04 0.21 -0.33 0.03 0.03 0.28 -0.08 0.10 -0.05 0.42 0.23 0.33 0.02 -0.02 -0.33 -0.03 0.14 0.04 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.03 -0.02 -0.01 0.02 0.01 0.00 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 -0.11 0.00 0.57 -0.40 0.02 -0.24 0.25 -0.42 -0.13 0.07 -0.01 -0.29 0.20 -0.01 0.13 -0.13 -0.16 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 -0.01 -0.02 0.01 -0.02 0.03 0.02 0.00 0.00 0.02 -0.01 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 -0.28 0.19 -0.01 0.11 -0.12 0.20 0.06 0.14 -0.02 -0.60 0.41 -0.02 0.26 -0.26 -0.34 0.11 0.00 0.00 0.00 0.00 0.00 0.01 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.01 0.00 -0.01 0.01 0.01 0.00 -0.11 -0.20 0.02 0.95 0.00 0.00 0.00 0.00 0.00 -0.01 0.02 0.00 -0.11 -0.06 0.01 -0.03 0.04 -0.07 -0.02 0.01 0.00 -0.05 -0.10 0.00 -0.06 0.06 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 0.00 0.03 -0.03 -0.01 0.00 0.01 0.01 0.00 0.00 0.01 -0.04 0.02 0.61 0.00 0.00 0.03 -0.38 0.20 -0.34 0.02 0.19 0.50 0.02 0.00 -0.11 -0.05 0.00 -0.02 0.05 -0.08 -0.02 0.01 0.00 -0.06 -0.06 0.00 -0.04 0.02 0.02 0.00 0.00 0.00 0.00 0.01 0.00 -0.06 0.00 0.00 0.00 -0.02 0.03 0.02 0.00 0.01 0.02 0.00 0.00 0.01 -0.04 0.02 0.70 0.00 0.00 0.01 0.27 -0.14 0.24 -0.03 -0.19 -0.49 0.03 0.00 -0.17 -0.09 0.00 -0.04 0.07 -0.11 -0.03 0.02 0.00 -0.09 -0.08 0.00 -0.04 0.04 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.03 -0.06 0.01 -0.01 0.06 -0.01 0.00 0.10 -0.01 0.00 0.03 0.00 0.00 0.00 0.00 -0.01 -0.02 -0.11 -0.01 0.54 0.23 -0.02 0.11 -0.20 0.34 0.08 0.11 -0.02 -0.45 -0.38 0.02 -0.22 0.12 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.02 0.00 0.00 0.00 -0.03 0.03 0.04 0.02 -0.01 0.06 0.01 -0.01 -0.29 0.04 -0.01 -0.20 0.01 0.00 0.00 0.01 0.02 0.05 0.08 0.02 -0.40 0.02 0.01 0.03 0.23 -0.41 -0.11 0.12 -0.03 -0.45 -0.41 0.02 -0.24 0.06 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 0.00 -0.07 0.03 -0.04 0.00 0.01 -0.02 0.00 0.00 0.09 -0.02 0.00 0.08 0.01 0.00 0.00 0.00 -0.01 -0.02 -0.07 0.01 0.21 0.69 -0.01 0.40 0.22 -0.41 -0.13 -0.04 0.01 0.16 0.08 -0.01 0.04 -0.08 -0.11 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.01 0.00 0.08 0.05 -0.01 0.00 0.00 0.03 -0.01 0.00 0.04 0.01 0.00 0.01 0.00 -0.01 -0.02 0.00 0.00 0.02 -0.07 0.00 -0.04 -0.04 0.08 0.02 -0.02 0.02 0.19 -0.42 0.04 -0.28 -0.47 -0.65 0.20 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.05 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.01 -0.09 0.00 0.00 -0.02 -0.53 0.28 -0.44 -0.01 -0.24 -0.61 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00</array>
                     </module>
                  </module>
                  <table id="l716.forcematrix"/>
               </property>
               <property dictRef="cc:thermochemistry">
                  <list id="l716.thermochemistry">
                     <scalar dataType="xsd:double" dictRef="cc:temp" units="si:k">298.150</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:press" units="nonsi:atm">1.00000</scalar>
                     <list cmlx:templateRef="mass">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="16">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16</array>
                        <array dataType="xsd:integer" dictRef="x:elementType" size="16">8 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:double" dictRef="cc:atomicmass" size="16">15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783</array>
                     </list>
                     <scalar cmlx:templateRef="molmass"
                             dataType="xsd:double"
                             dictRef="cc:molmass">86.07317</scalar>
                     <array dataType="xsd:double" dictRef="cc:moi.eigenvalues" size="3">313.38526 702.99155 923.49301</array>
                     <matrix cols="3"
                             dataType="xsd:double"
                             dictRef="cc:moi.eigenvectors"
                             rows="3">0.99924 -0.03892 -6.9E-4 0.03892 0.99922 0.00652 4.3E-4 -0.00654 0.99998</matrix>
                     <scalar dataType="xsd:string" dictRef="g:top">asymmetric</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:symmnumber">1</scalar>
                     <array cmlx:templateRef="rottemp"
                            dataType="xsd:double"
                            dictRef="cc:rottemp"
                            size="3">0.27638 0.12321 0.09379</array>
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">5.75886 2.56723 1.95426</array>
                     <scalar dataType="xsd:double" dictRef="cc:zpe" units="u:jmol-1">364448.2</scalar>
                     <array dataType="xsd:double" dictRef="cc:vibtemp" size="42">121.05 277.80 295.14 322.77 419.91 460.25 653.60 670.20 1043.03 1120.75 1206.64 1314.11 1323.33 1376.68 1380.70 1456.73 1578.16 1592.95 1623.20 1671.42 1721.38 1781.65 1838.09 1877.69 1982.78 1996.81 2024.29 2112.35 2112.87 2126.60 2131.79 2144.14 4276.94 4281.21 4300.02 4395.89 4403.97 4408.82 4420.21 4427.30 4442.52 4550.24</array>
                  </list>
               </property>
               <property dictRef="cc:zeropoint">
                  <list id="l716.zeropoint">
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.correction"
                             units="nonsi:hartree">0.138811</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.thermalcorrener"
                             units="nonsi:hartree">0.146069</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.thermalcorrenthalpy"
                             units="nonsi:hartree">0.147013</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.thermalcorrgfe"
                             units="nonsi:hartree">0.107993</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectzpe"
                             units="nonsi:hartree">-271.203276</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectthermal"
                             units="nonsi:hartree">-271.196018</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectthermalent"
                             units="nonsi:hartree">-271.195074</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectthermalfe"
                             units="nonsi:hartree">-271.234094</scalar>
                  </list>
               </property>
               <property>
                  <module cmlx:templateRef="l716.thermoprops">
                     <list cmlx:templateRef="total">
                        <scalar dataType="xsd:double" dictRef="cc:ethermo.total">91.660</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:cv.total">26.110</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:s.total">82.125</scalar>
                     </list>
                     <list cmlx:templateRef="elect">
                        <scalar dataType="xsd:double" dictRef="cc:ethermo.elect">0.000</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:cv.elect">0.000</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:s.elect">0.000</scalar>
                     </list>
                     <list cmlx:templateRef="trans">
                        <scalar dataType="xsd:double" dictRef="cc:ethermo.trans">0.889</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:cv.trans">2.981</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:s.trans">39.271</scalar>
                     </list>
                     <list cmlx:templateRef="rot">
                        <scalar dataType="xsd:double" dictRef="cc:ethermo.rot">0.889</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:cv.rot">2.981</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:s.rot">26.811</scalar>
                     </list>
                     <list cmlx:templateRef="vib">
                        <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">89.882</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:cv.vib">20.148</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:s.vob">16.042</scalar>
                     </list>
                     <list cmlx:templateRef="vibn">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">1</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.601</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.960</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">3.792</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">2</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.635</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.849</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.198</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">3</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.640</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.833</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.087</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">4</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.649</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.804</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.924</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">5</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.687</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.689</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.463</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">6</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.706</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.636</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.311</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">7</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.813</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.351</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.783</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">8</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.823</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.326</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.749</scalar>
                        </list>
                     </list>
                     <list cmlx:templateRef="totalbot">
                        <scalar dataType="xsd:double" dictRef="cc:q.total">0.212184e-49</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.total">-49.673287</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.total">-114.376971</scalar>
                     </list>
                     <list cmlx:templateRef="totalv0">
                        <scalar dataType="xsd:double" dictRef="cc:q.v0">0.149690e+15</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.v0">14.175193</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.v0">32.639587</scalar>
                     </list>
                     <list cmlx:templateRef="vibbot">
                        <scalar dataType="xsd:double" dictRef="cc:q.vibbot">0.418676e-62</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.vibbot">-62.378122</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.vibbot">-143.630933</scalar>
                     </list>
                     <list cmlx:templateRef="vibbot">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">1</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibbot">0.244624e+01</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibbot">0.388499</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibbot">0.894553</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">2</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibbot">0.103541e+01</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibbot">0.015111</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibbot">0.034794</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">3</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibbot">0.970101e+00</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibbot">-0.013183</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibbot">-0.030355</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">4</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibbot">0.880098e+00</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibbot">-0.055469</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibbot">-0.127722</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">5</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibbot">0.654572e+00</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibbot">-0.184043</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibbot">-0.423774</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">6</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibbot">0.587692e+00</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibbot">-0.230850</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibbot">-0.531552</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">7</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibbot">0.376183e+00</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibbot">-0.424601</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibbot">-0.977679</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">8</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibbot">0.363381e+00</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibbot">-0.439638</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibbot">-1.012303</scalar>
                        </list>
                     </list>
                     <list cmlx:templateRef="vibv0">
                        <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.295364e+02</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">1.470358</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">3.385625</scalar>
                     </list>
                     <list cmlx:templateRef="vibv0">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">1</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.299682e+01</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">0.476660</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">1.097551</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">2</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.164981e+01</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">0.217434</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">0.500661</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">3</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.159137e+01</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">0.201772</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">0.464598</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">4</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.151221e+01</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">0.179613</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">0.413573</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">5</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.132369e+01</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">0.121786</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">0.280423</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">6</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.127161e+01</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">0.104354</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">0.240284</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">7</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.112571e+01</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">0.051427</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">0.118415</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">8</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.111810e+01</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">0.048480</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">0.111630</scalar>
                        </list>
                     </list>
                     <list cmlx:templateRef="elect">
                        <scalar dataType="xsd:double" dictRef="cc:q.elect">0.100000e+01</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.elect">0.000000</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.elect">0.000000</scalar>
                     </list>
                     <list cmlx:templateRef="trans">
                        <scalar dataType="xsd:double" dictRef="cc:q.trans">0.313875e+08</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.trans">7.496757</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.trans">17.261921</scalar>
                     </list>
                     <list cmlx:templateRef="rot">
                        <scalar dataType="xsd:double" dictRef="cc:q.rot">0.161465e+06</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.rot">5.208078</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.rot">11.992042</scalar>
                     </list>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l716.irspectrum">
                     <scalar cmlx:templateRef="discard"
                             dataType="xsd:string"
                             dictRef="g:irspectrum">000102618</scalar>
                  </module>
               </property>
               <property dictRef="cc:forces">
                  <scalar dictRef="cc:linkToAtoms">./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999']</scalar>
               </property>
               <property dictRef="cc:multipole">
                  <list cmlx:templateRef="multipole">
                     <array dataType="xsd:double" dictRef="cc:dipole" size="3">-1.2641 -2.1230 0.2691</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">2.4854</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-39.4255 -39.7449 -36.3311</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-4.8061 0.5628 0.5470</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">-0.9250 -1.2444 2.1694 -4.8061 0.5628 0.5470</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">2.7708 1.4105 1.1892 0.6940 -9.0590 -0.6066 2.1929 -0.3982 -1.1682 0.3710</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-536.1476 -260.1369 -79.0154 -16.9108 9.0522 -0.0552 0.5513 -2.5659 1.2879 -140.1377 -100.4060 -58.2114 -1.2335 0.2243 -1.4880</array>
                  </list>
               </property>
               <property dictRef="cc:virtualorbs">
                  <array dataType="xsd:string" delimiter="|" size="56">(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)</array>
               </property>
               <property dictRef="cc:occupiedorbs">
                  <array dataType="xsd:string" delimiter="|" size="24">(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)</array>
               </property>
            </propertyList>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l9999.archive" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:string" dictRef="g:zmat">0</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:electronicstate">1-A</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:hfenergy" units="nonsi:hartree">-271.3420868</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsd" units="nonsi:unknown">7.613E-9</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsf" units="nonsi:unknown">1.339E-4</scalar>
                  <scalar dataType="xsd:string" dictRef="x:ZeroPoint">0.138811</scalar>
                  <scalar dataType="xsd:string" dictRef="x:Thermal">0.146069</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:pointgroup">C01 [X(C5H10O1)]</scalar>
                  <array dataType="xsd:double"
                         dictRef="cc:dipole"
                         size="3"
                         units="nonsi:debye">-0.4770888 0.8483666 -0.0940432</array>
                  <array dataType="xsd:double"
                         dictRef="cc:dipolederiv"
                         size="144"
                         units="nonsi:unknown">-0.5061485 0.1658389 0.0292588 0.1987458 -0.5960857 0.0485025 0.0245705 0.0496481 -0.343824 0.3913951 -0.0368708 -0.0246894 -0.1362295 0.1605655 -0.0273456 -0.0994532 0.0198291 0.3197579 0.059916 0.0232883 0.0214921 0.0058867 0.1154635 0.0055338 0.0085747 -0.0069532 0.0796533 0.0767439 -0.0371792 -0.0867822 0.0855626 0.2053211 0.0439198 -0.0819355 -0.005442 0.2592409 -0.0247539 0.0454416 -0.0036317 0.0208282 -0.0404047 0.0243142 0.0473768 0.0047773 0.0924338 -0.0120774 -0.0252972 -0.0057468 -0.0163676 -0.0700867 -0.0142711 0.0317743 -0.0049656 0.1023387 -0.012177 0.0124622 -0.0504726 0.0204985 0.0912728 -0.0079879 -0.0127132 0.0170443 -0.1503503 0.0148223 -0.0034353 -0.0812386 -0.007088 0.0301476 -0.0135758 -0.0510352 -0.010498 -0.1518167 -0.0462755 -0.1024734 0.0898093 -0.1038814 0.01021 0.0157622 0.106689 0.0449847 0.0089429 0.0961526 -0.0170562 0.0456407 -0.0528012 0.0055402 -0.0718462 0.0035709 -0.102834 -0.097095 0.0836733 0.0179835 -0.0300358 0.0021846 0.0712087 -0.0316537 -0.074138 0.0345979 -0.1638091 -0.1406125 0.0386968 0.102459 0.0126651 0.0824049 0.0197204 0.1156192 -0.0025431 0.0281622 0.0321206 -0.1257697 -0.0411731 -0.0848406 -0.129792 -0.0347183 -0.035944 -0.0472023 0.0780622 0.0746979 -0.0261524 -0.0393985 -0.0035903 0.071329 0.0327262 -0.0796617 -0.0330341 -0.1652662 -0.1351196 -0.0497948 0.1101351 -0.0199571 0.079523 -0.0204975 0.1269151 0.0051712 0.0163784 0.0476428 0.120318 -0.0356262 0.0783843 -0.0866174 0.0314171 -0.0302098 0.0374195 0.087191</array>
                  <array dataType="xsd:double"
                         delimiter="|"
                         dictRef="cc:polarizability"
                         size="6"
                         units="nonsi:unknown">63.8435385|2.7891095|54.6435142|1.8826594|0.8510065|48.2866997</array>
                  <array dataType="xsd:double" dictRef="cc:forceConstants" size="1176">0.13563971 -0.05179449 0.28114937 0.02910362 -0.02456013 0.08730715 -0.09165434 0.08358778 -0.02520255 0.54957882 0.03698706 -0.07240736 0.02184478 0.05096065 0.22593748 -0.02369428 0.04066715 -0.06260738 0.03796221 0.02526956 0.60536081 -0.02023765 0.00376376 0.00177886 -0.15617059 -0.00885810 0.06292431 0.46964031 0.03117187 -0.00384499 -0.01025524 -0.01378385 -0.06030499 0.00030821 0.00368374 0.44559945 -0.01143547 0.00189350 0.00478468 0.06795358 0.00075015 -0.12372168 0.02111281 -0.00006728 0.57871990 -0.02098545 -0.04060191 0.01291532 -0.20532659 -0.06040898 -0.06980662 -0.01569695 -0.01912857 -0.00997868 0.47691425 0.00695195 -0.17068180 0.00244919 -0.11601389 -0.02962180 -0.05453049 0.00318125 -0.00452767 -0.00007473 0.18230094 0.34673147 0.01264186 -0.01782969 -0.04294195 -0.06965314 -0.03293724 -0.09249987 0.00814920 0.01557607 0.00414124 -0.07059733 0.08247480 0.58734509 -0.00567029 -0.00011987 0.00291870 -0.02031155 0.02564943 -0.00643991 -0.10130475 0.04921444 -0.01449502 0.00160714 0.00192046 -0.00099398 0.52200506 -0.00398022 0.00204951 -0.00066375 0.00854141 -0.00510655 -0.00042229 0.04476519 -0.14030858 0.02154071 -0.00022314 0.00071749 0.00048557 0.04615414 0.48128738 0.00490622 -0.00164438 0.00003382 0.00681930 -0.01177707 0.00348689 -0.01365752 0.02073422 -0.08093504 -0.00099528 -0.00056494 0.00004517 -0.01388359 0.02019434 0.53595105 0.00342250 0.00008563 -0.00079076 -0.02458453 -0.02635857 -0.00521648 -0.09856109 -0.04884208 -0.01326747 -0.00243675 -0.00151248 0.00417112 0.00779065 0.01505150 0.00268635 0.52919631 0.00095000 -0.00014337 0.00019289 -0.00778344 -0.00308515 0.00039736 -0.04589314 -0.14623339 -0.02110808 0.00259311 0.00008444 0.00002795 -0.01378253 -0.02997678 -0.00572648 -0.04629548 0.47958888 -0.00151407 -0.00065759 0.00071786 0.01066019 0.01390777 0.00369914 -0.01314508 -0.02115899 -0.08087142 0.00240437 0.00052811 -0.00231445 0.00246026 0.00620125 0.00164979 -0.01179775 -0.01862032 0.53934223 -0.00869241 0.00223029 -0.01740013 -0.04344713 -0.00275995 -0.01239285 0.00110511 -0.00003389 0.02619842 -0.00486708 0.00108696 -0.01989005 0.00173209 -0.00091008 0.00051395 0.00159335 0.00088665 0.00062772 0.05804235 0.00991787 -0.00225809 0.02725740 -0.00744815 -0.03645565 -0.01272107 -0.00080644 0.00191099 0.00013155 0.00131952 -0.00252909 -0.02140557 -0.00069222 0.00025712 -0.00013376 0.00052961 0.00057039 0.00090696 -0.00090566 0.03670377 -0.00543091 0.00083904 -0.00171657 -0.01668397 -0.00984461 -0.31221791 -0.00613168 -0.00127959 -0.01314322 0.00320429 0.00356726 -0.00445831 -0.00007264 0.00039605 0.00004727 -0.00061968 -0.00040283 0.00059152 0.02223438 0.00604752 0.32804931 0.00222757 0.00010305 -0.00156556 -0.00034519 -0.00029327 0.03198980 -0.05563596 -0.00074644 -0.05498606 0.00094873 -0.00039270 0.00163927 -0.00437853 0.00155241 -0.01753838 -0.00442879 -0.00222242 -0.01684992 -0.00424600 0.00017093 0.00203250 0.06683191 -0.00039138 -0.00038364 -0.00027062 0.00021645 -0.00002304 -0.00026924 -0.00094701 -0.04069964 -0.00231822 -0.00008592 0.00050894 0.00108606 0.00784006 -0.00346597 0.02629175 -0.00833523 -0.00404219 -0.02702244 0.00001576 0.00049776 0.00019851 0.00213355 0.05289029 -0.00051066 -0.00083151 0.00238340 -0.00486866 0.00071338 -0.02132804 -0.05137092 -0.00296577 -0.28010246 -0.00087010 0.00014001 0.00021961 -0.00039363 -0.00140691 -0.00551616 -0.00061659 0.00122827 -0.00588898 0.00239056 0.00001731 0.00004784 0.05598106 0.00247709 0.30464517 0.00605835 0.00147086 -0.00696327 -0.01173312 -0.00562348 0.01999500 0.00003802 -0.00339338 -0.00190253 -0.18430143 -0.07327275 0.12189142 0.00010296 -0.00028245 0.00004942 -0.00127949 0.00044340 0.00072120 0.00084181 0.00074010 -0.00058296 0.00023059 -0.00004508 -0.00031814 0.18919322 -0.02430013 -0.01789066 0.01238685 0.00239928 -0.00576358 -0.00338482 0.00096627 0.00154316 0.00024258 -0.06664735 -0.07099417 0.05664439 -0.00031230 0.00007352 0.00018405 0.00044136 -0.00005722 0.00005732 -0.00077052 0.00026489 0.00017829 -0.00009454 -0.00008823 0.00027987 0.08157286 0.08504383 -0.00113969 -0.00067793 0.00343676 -0.01351961 -0.00521039 0.00752043 -0.00017512 -0.00203979 -0.00149763 0.12589111 0.05642409 -0.15733179 0.00012691 -0.00000659 0.00011238 -0.00066335 0.00000681 0.00073302 0.00032149 0.00103722 0.00049040 -0.00015867 -0.00011284 0.00046204 -0.12909887 -0.05911138 0.15747900 0.00020695 0.00085226 0.00391989 0.00123230 -0.00930767 -0.02721379 0.00139838 0.00140505 -0.00139434 -0.04586544 -0.00374108 0.01189312 -0.00022560 -0.00011344 0.00013453 0.00015697 -0.00015317 0.00029056 -0.00175332 -0.00298329 0.00041783 -0.00015524 -0.00024578 0.00111762 0.00125759 0.00667405 0.01853603 0.04360379 -0.00647902 -0.01872654 -0.02714110 0.00024395 -0.00431782 0.00403970 -0.00014046 0.00007502 -0.00144325 0.00008727 -0.06937546 -0.08483473 -0.00035994 0.00004565 0.00040938 0.00002272 0.00008801 0.00028322 0.00117169 0.00116236 0.00034208 -0.00025934 -0.00013846 0.00029803 -0.00147220 0.00731266 0.00974746 0.00709680 0.08383486 -0.00258833 0.00222541 0.00841870 0.00590358 -0.00271104 -0.00881353 0.00115977 0.00047791 0.00067257 0.00776770 -0.09029908 -0.29294411 -0.00031088 -0.00021886 0.00004982 0.00008395 -0.00003057 0.00025234 0.00001716 -0.00096718 0.00082037 -0.00060616 -0.00012510 0.00062383 -0.00354458 -0.00736286 -0.01134032 -0.00794850 0.09839465 0.30220274 0.00014260 -0.00031411 0.00069961 0.00042671 -0.00019799 -0.00234994 -0.00528384 0.00114046 -0.01819034 -0.00016233 0.00003190 -0.00008601 -0.05517962 0.00033838 -0.05205547 0.00035136 -0.00090639 0.00054026 -0.00018737 0.00028294 0.00076535 -0.00127426 0.00292456 -0.00005648 -0.00011061 0.00005315 0.00003076 0.00018100 0.00002205 0.00013569 0.05938015 -0.00018978 0.00013737 -0.00037291 -0.00069282 0.00052762 0.00101799 0.00690103 -0.00285097 0.02749577 0.00000795 -0.00006319 -0.00016781 -0.00007745 -0.04401907 0.00454460 0.00023466 0.00184406 0.00129062 0.00021973 0.00012629 -0.00056304 0.00286995 -0.00394640 0.00052977 0.00001080 -0.00002928 -0.00002343 -0.00005898 -0.00005074 0.00002909 -0.00364592 0.04860257 -0.00018009 0.00002961 0.00031492 0.00094582 -0.00037192 0.00019910 -0.00100430 -0.00159999 -0.00774214 0.00015012 0.00005274 -0.00011681 -0.05213798 0.00464154 -0.28577641 0.00035363 -0.00054958 0.00062538 -0.00082993 0.00020949 0.00054927 -0.00040031 0.00091783 0.00149860 -0.00010421 0.00001704 0.00004680 0.00013979 0.00002541 0.00007187 0.05863268 -0.00660164 0.31221113 -0.00139077 0.00079536 0.00044983 0.00043654 0.00234963 -0.00256522 -0.01491061 -0.00179357 0.00977528 0.00071881 0.00021392 0.00005127 -0.23470323 -0.00160123 0.11434414 0.00091129 -0.00109541 0.00008872 0.00008334 -0.00015397 0.00008611 -0.00006222 -0.00035194 -0.00046488 -0.00005924 -0.00005874 -0.00001598 -0.00001036 -0.00010156 -0.00001113 0.00511997 -0.00012604 -0.00632493 0.25622101 0.00217468 -0.00027233 -0.00034647 0.00004939 -0.00383233 0.00223697 0.02453244 -0.00266720 -0.01434561 0.00009631 -0.00027246 0.00026856 -0.00221970 -0.04279296 0.00034762 0.00079644 0.00159517 -0.00071147 -0.00013593 0.00005989 -0.00021473 -0.00070780 0.00096396 0.00002301 0.00006216 0.00007669 -0.00000887 0.00010726 0.00005532 0.00009307 -0.00042998 -0.00057738 -0.00014911 -0.00058960 0.04834332 -0.00069967 0.00043248 0.00034331 -0.00034417 0.00120015 -0.00015488 -0.00857362 0.00234597 0.00309835 0.00021701 0.00002174 -0.00009065 0.11441286 -0.00003421 -0.11088196 -0.00010713 -0.00027462 0.00004457 -0.00034369 0.00008896 0.00037582 -0.00013203 -0.00045471 0.00052048 -0.00001254 -0.00002199 -0.00000525 0.00000693 -0.00003347 0.00001881 0.02783234 0.00046198 -0.01542530 -0.12421513 -0.00176745 0.11904648 0.00044541 -0.00046334 -0.00003817 0.00091419 0.00098721 0.00053677 0.00723275 0.01670411 0.00434270 -0.00017976 -0.00022514 -0.00014376 -0.11083202 -0.10863288 -0.03124676 -0.00181128 0.00234030 -0.00059654 -0.00005608 -0.00000467 0.00003681 0.00069584 -0.00078489 0.00031774 0.00006350 -0.00001063 -0.00003935 -0.00016418 0.00009020 -0.00016160 -0.00368962 -0.00512259 0.00047514 -0.01314240 -0.02289132 -0.00807562 0.11986724 -0.00012197 0.00102896 0.00024411 -0.00188937 -0.00024989 -0.00053184 -0.01485775 -0.01991402 -0.00730030 0.00114965 0.00008956 -0.00014348 -0.10793224 -0.21880568 -0.05048089 0.00458056 -0.00308054 0.00187009 0.00008758 -0.00015486 -0.00003094 -0.00019022 0.00064058 0.00065465 0.00010324 0.00002438 0.00009766 0.00025834 -0.00005270 0.00028905 0.00066432 0.00028578 0.00247744 0.00184363 -0.00047620 -0.00143074 0.11690170 0.24134951 0.00015243 0.00029833 -0.00023826 -0.00012549 -0.00081788 0.00012287 0.00370769 0.00741671 0.00057745 0.00021996 -0.00001348 0.00036960 -0.03078875 -0.05051708 -0.05905750 -0.00091262 0.00111007 0.00003834 -0.00010467 -0.00013464 -0.00010394 0.00052537 0.00001814 0.00021310 0.00009300 -0.00005976 -0.00005993 -0.00011541 -0.00000214 -0.00009273 -0.01645076 -0.02631151 -0.00708115 0.00920187 0.01398977 0.00311563 0.03466291 0.05451539 0.06134550 -0.00039882 -0.00009887 0.00029933 0.00081206 0.00038052 -0.00215319 -0.00549311 -0.00130005 -0.01712264 -0.00004344 0.00009535 0.00026163 0.00035434 0.00094618 0.00048511 -0.05870951 -0.00127294 -0.05858013 -0.00022674 -0.00017453 0.00078232 -0.00101808 -0.00283442 -0.00010131 -0.00002906 0.00000945 0.00008511 0.00016062 0.00006477 0.00014151 0.00043293 -0.00025757 0.00028185 -0.00003559 -0.00006519 0.00016403 -0.00012856 0.00013985 0.00013022 0.06266372 0.00008934 -0.00011758 0.00012409 0.00108205 0.00097178 -0.00078575 -0.00793172 -0.00390163 -0.02811100 0.00005636 0.00000812 -0.00003620 -0.00021161 0.00177356 -0.00121875 -0.00122455 -0.04369536 -0.00750337 -0.00014251 0.00012764 0.00064702 -0.00283912 -0.00422304 -0.00058687 -0.00005069 0.00006331 0.00008316 0.00015284 0.00001621 0.00012277 0.00014652 -0.00024410 0.00089918 0.00007546 -0.00003840 -0.00000888 0.00006830 0.00039577 0.00034674 0.00489994 0.04854151 -0.00012376 -0.00014296 0.00007030 0.00079395 0.00042310 0.00029565 -0.00069308 0.00178635 -0.00720678 -0.00011092 0.00006875 0.00035893 0.00032172 0.00049591 0.00068789 -0.05889965 -0.00794774 -0.28177062 -0.00086626 -0.00027798 0.00050529 -0.00034545 -0.00081355 0.00151170 -0.00012667 -0.00001648 0.00001407 0.00018279 0.00002378 0.00002585 0.00029836 -0.00098095 0.00039661 -0.00008919 -0.00003550 -0.00014794 0.00014517 0.00002949 0.00033446 0.06595231 0.01017079 0.30771852 0.00080138 0.00001963 -0.00000841 -0.00069287 -0.00262671 -0.00231665 -0.01355779 0.00192867 0.00966679 -0.00060392 -0.00043317 0.00092338 0.00078640 0.00093818 -0.00001424 -0.22610085 -0.00594786 0.11743288 0.00011763 0.00016186 -0.00003779 -0.00008858 0.00028757 -0.00047988 -0.00033574 -0.00004829 -0.00017129 -0.00000655 -0.00009155 -0.00006538 -0.00002344 -0.00003360 -0.00011130 0.00065932 -0.00056764 0.00009573 0.00017095 0.00012498 -0.00026577 0.00573231 0.00045830 -0.00696550 0.24702669 0.00013340 0.00081914 -0.00036840 -0.00159500 -0.00512855 -0.00213154 -0.02384011 -0.00309717 0.01564940 -0.00105487 -0.00023699 0.00103422 -0.00084658 0.00158872 0.00064863 -0.00504516 -0.04344155 0.00380671 0.00010471 -0.00007307 0.00008520 0.00063481 0.00098281 -0.00001163 -0.00036540 0.00015043 -0.00020011 0.00002057 -0.00000060 -0.00000325 0.00003391 -0.00005122 0.00001850 0.00079602 -0.00057994 -0.00043704 0.00025002 0.00042391 -0.00022576 0.00079381 -0.00060454 -0.00010831 0.00853026 0.04846687 0.00015249 0.00006469 -0.00011455 -0.00053214 -0.00137002 0.00028419 -0.00770619 -0.00267717 0.00276840 -0.00040161 -0.00008408 0.00044103 -0.00002177 0.00033628 -0.00005217 0.11779280 0.00461733 -0.11881619 -0.00040947 -0.00017923 0.00030360 -0.00007288 0.00043327 0.00056093 -0.00011172 -0.00000753 -0.00006276 0.00008198 -0.00001393 0.00004492 0.00013867 -0.00000835 -0.00008366 -0.00001450 0.00043765 0.00019357 -0.00024674 0.00006816 -0.00000959 0.02706932 0.00058923 -0.01592900 -0.12829051 -0.00320887 0.12741102 0.00008527 0.00048397 -0.00011633 0.00086529 -0.00087977 0.00074083 0.00743777 -0.01622650 0.00372297 0.00028020 -0.00019150 -0.00025799 -0.00177305 -0.00254396 -0.00054779 -0.12551013 0.11813931 -0.03274266 -0.00003956 0.00004610 0.00000003 0.00069820 0.00060370 0.00024428 0.00006266 0.00012606 -0.00000949 -0.00001693 0.00010462 0.00002721 -0.00012363 -0.00003936 0.00011400 0.00016413 -0.00021150 -0.00022529 0.00061403 -0.00086229 0.00007001 -0.00407308 0.00537109 0.00052617 -0.01388495 0.02144960 -0.00742772 0.13521379 -0.00111917 0.00154200 -0.00052069 0.00212556 -0.00114019 0.00084009 0.01548105 -0.02077838 0.00706481 0.00053962 0.00016262 -0.00024291 -0.00422408 -0.00331736 -0.00180832 0.11587110 -0.21001540 0.04682211 -0.00014482 -0.00021033 0.00003477 0.00028116 0.00052627 -0.00055870 0.00010201 0.00027027 -0.00000508 0.00003624 0.00007224 0.00008598 -0.00014381 0.00030866 -0.00001653 -0.00020196 0.00041483 -0.00008817 0.00079363 -0.00150457 0.00038710 -0.00132629 0.00092674 -0.00267470 -0.00270065 0.00078173 0.00100258 -0.12536958 0.23196088 0.00036031 -0.00010602 -0.00019219 -0.00010890 0.00093128 0.00037420 0.00362486 -0.00660162 0.00045776 -0.00000934 -0.00015991 -0.00022273 -0.00070231 -0.00102194 0.00015515 -0.03219639 0.04707954 -0.05803253 -0.00006662 0.00012302 -0.00014074 0.00048742 -0.00003594 0.00014893 0.00001546 -0.00002557 0.00000278 -0.00004903 -0.00009508 -0.00001111 0.00011528 -0.00034017 0.00031179 -0.00029625 0.00018253 -0.00005104 0.00003129 -0.00032785 0.00052615 -0.01769549 0.02526784 -0.00686494 0.01060795 -0.01454775 0.00306026 0.03588177 -0.05032236 0.06047824</array>
                  <array dataType="xsd:double" dictRef="cc:forces" size="48">-0.00012960 -0.00036425 -0.00010324 0.00026853 -0.00010547 0.00025463 -0.00030043 0.00016869 -0.00006398 -0.00007771 0.00055122 -0.00017943 0.00013874 -0.00003116 0.00004491 0.00006896 -0.00000830 0.00001855 -0.00007586 -0.00005459 -0.00009953 0.00008822 -0.00002404 0.00002662 0.00006283 0.00000064 0.00006182 0.00008246 -0.00005466 0.00007573 -0.00000593 -0.00001919 -0.00003215 -0.00000733 -0.00000779 -0.00000794 -0.00000724 -0.00000413 -0.00000766 -0.00003422 0.00000787 -0.00002404 -0.00004403 -0.00004059 0.00001286 -0.00002739 -0.00001424 0.00002285</array>
               </module>
            </module>
            <molecule formalCharge="0" id="mol9999" spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="1.613165"
                        y3="-0.865777"
                        z3="0.014334">
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.16" size="3">0.000129599 0.000364249 0.000103238</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.17" size="3">-0.000268532 0.000105469 -0.000254635</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.18" size="3">0.000300428 -0.000168687 0.000063984</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.19" size="3">0.000077708 -0.000551224 0.000179430</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.20" size="3">-0.000138736 0.000031165 -0.000044910</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.21" size="3">-0.000068958 0.000008296 -0.000018555</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.22" size="3">0.000075858 0.000054591 0.000099530</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.23" size="3">-0.000088225 0.000024044 -0.000026616</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.24" size="3">-0.000062827 -0.000000637 -0.000061818</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.25" size="3">-0.000082464 0.000054663 -0.000075730</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.26" size="3">0.000005931 0.000019194 0.000032151</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.27" size="3">0.000007335 0.000007785 0.000007940</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.28" size="3">0.000007244 0.000004133 0.000007661</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.29" size="3">0.000034216 -0.000007872 0.000024038</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.30" size="3">0.000044034 0.000040593 -0.000012858</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.31" size="3">0.000027390 0.000014239 -0.000022851</array>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a2"
                        x3="0.528654"
                        y3="0.069077"
                        z3="-0.480611"/>
                  <atom elementType="C"
                        id="a3"
                        x3="-0.783203"
                        y3="0.055324"
                        z3="0.291587"/>
                  <atom elementType="C"
                        id="a4"
                        x3="1.789499"
                        y3="0.634732"
                        z3="0.09537"/>
                  <atom elementType="C"
                        id="a5"
                        x3="-1.604433"
                        y3="1.323598"
                        z3="-0.047198"/>
                  <atom elementType="C"
                        id="a6"
                        x3="-1.570935"
                        y3="-1.23968"
                        z3="-0.015199"/>
                  <atom elementType="H"
                        id="a7"
                        x3="0.427012"
                        y3="0.055437"
                        z3="-1.577641"/>
                  <atom elementType="H"
                        id="a8"
                        x3="-0.533518"
                        y3="0.06552"
                        z3="1.371904"/>
                  <atom elementType="H"
                        id="a9"
                        x3="2.562178"
                        y3="1.045113"
                        z3="-0.566761"/>
                  <atom elementType="H"
                        id="a10"
                        x3="1.773619"
                        y3="1.039498"
                        z3="1.116232"/>
                  <atom elementType="H"
                        id="a11"
                        x3="-1.847229"
                        y3="1.359502"
                        z3="-1.126774"/>
                  <atom elementType="H"
                        id="a12"
                        x3="-2.558982"
                        y3="1.329515"
                        z3="0.509725"/>
                  <atom elementType="H"
                        id="a13"
                        x3="-1.052551"
                        y3="2.246816"
                        z3="0.208918"/>
                  <atom elementType="H"
                        id="a14"
                        x3="-1.845098"
                        y3="-1.290288"
                        z3="-1.086775"/>
                  <atom elementType="H"
                        id="a15"
                        x3="-2.505119"
                        y3="-1.282719"
                        z3="0.574158"/>
                  <atom elementType="H"
                        id="a16"
                        x3="-0.964958"
                        y3="-2.130369"
                        z3="0.22723"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a1 a4" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a2 a4" order="S"/>
                  <bond atomRefs2="a2 a7" order="S"/>
                  <bond atomRefs2="a3 a5" order="S"/>
                  <bond atomRefs2="a3 a6" order="S"/>
                  <bond atomRefs2="a3 a8" order="S"/>
                  <bond atomRefs2="a4 a10" order="S"/>
                  <bond atomRefs2="a4 a9" order="S"/>
                  <bond atomRefs2="a5 a11" order="S"/>
                  <bond atomRefs2="a5 a13" order="S"/>
                  <bond atomRefs2="a5 a12" order="S"/>
                  <bond atomRefs2="a6 a14" order="S"/>
                  <bond atomRefs2="a6 a15" order="S"/>
                  <bond atomRefs2="a6 a16" order="S"/>
               </bondArray>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">76.05290000000001</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1S/C5H10O/c1-4(2)5-3-6-5/h4-5H,3H2,1-2H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:5,6,4,3,2,1/E:(1,2)/rA:16OCCCCCHHHHHHHHHH/rB:s1;s2;s1s2;s3;s3;s2;s3;s4;s4;s5;s5;s5;s6;s6;s6;/rC:;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
         </module>
      </module>
   </module>
</module>
