<?xml version="1.0" encoding="UTF-8"?>
<module xmlns="http://www.xml-cml.org/schema"
        xmlns:cc="http://www.xml-cml.org/dictionary/compchem/"
        xmlns:cml="http://www.xml-cml.org/schema"
        xmlns:cmlx="http://www.xml-cml.org/schema/cmlx"
        xmlns:compchem="http://www.xml-cml.org/dictionary/compchem/"
        xmlns:convention="http://www.xml-cml.org/convention/"
        xmlns:g="http://www.iochem-bd.org/dictionary/gaussian/"
        xmlns:nonsi="http://www.xml-cml.org/unit/nonSi/"
        xmlns:nonsi2="http://www.iochem-bd.org/unit/nonSi2/"
        xmlns:si="http://www.xml-cml.org/unit/si/"
        xmlns:xi="http://www.w3.org/2001/XInclude"
        xmlns:xsd="http://www.w3.org/2001/XMLSchema"
        convention="convention:compchem"
        id="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 16</scalar>
               </parameter>
               <parameter dictRef="cc:hostname">
                  <scalar dataType="xsd:string">GINC-EXP-1-17</scalar>
               </parameter>
               <parameter dictRef="cc:jobname">
                  <scalar dataType="xsd:string">WTGUO</scalar>
               </parameter>
               <parameter dictRef="cc:title">
                  <scalar dataType="xsd:string">Title Card Required</scalar>
               </parameter>
               <parameter dictRef="cc:version">
                  <scalar dataType="xsd:string">ES64L-G16RevC.01</scalar>
               </parameter>
               <parameter dictRef="cc:run.date">
                  <scalar dataType="xsd:string">29-Jan-2023</scalar>
               </parameter>
               <parameter dictRef="cc:program">
                  <scalar dataType="xsd:string">Gaussian 16</scalar>
               </parameter>
               <parameter dictRef="cc:program.date">
                  <scalar dataType="xsd:string">3-Jul-2019</scalar>
               </parameter>
               <parameter dictRef="cc:version">
                  <scalar dataType="xsd:string">ES64L-G16RevC.01</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:nactiveatoms">
                  <scalar dataType="xsd:integer">41</scalar>
               </parameter>
               <parameter dictRef="cc:natoms">
                  <scalar dataType="xsd:integer">41</scalar>
               </parameter>
               <parameter dictRef="cc:diffuse">
                  <scalar dataType="xsd:string">(5D, 7F)</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">def2SVP</scalar>
               </parameter>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string">RPBE1PBE</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">def2SVP</scalar>
               </parameter>
               <parameter dictRef="g:operation">
                  <scalar dataType="xsd:string">FOpt</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">#</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">opt=(gdiis,maxstep=10,notrust)</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">freq</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">scrf=(smd,solvent=thf)</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">nosymm</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">def2svp</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">em=gd3bj</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">pbe1pbe</scalar>
               </parameter>
            </parameterList>
            <molecule cmlx:templateRef="mol"
                      formalCharge="-1"
                      id="zmat"
                      spinMultiplicity="1">
               <atomArray>
                  <atom elementType="C"
                        id="a1"
                        x3="-0.48379"
                        y3="0.71596"
                        z3="-0.97709"/>
                  <atom elementType="C"
                        id="a2"
                        x3="-1.08605"
                        y3="1.19099"
                        z3="0.36629"/>
                  <atom elementType="C"
                        id="a3"
                        x3="-0.60813"
                        y3="-0.16643"
                        z3="1.03439"/>
                  <atom elementType="C"
                        id="a4"
                        x3="0.08928"
                        y3="-0.51098"
                        z3="-0.30417"/>
                  <atom elementType="C"
                        id="a5"
                        x3="-1.14726"
                        y3="-0.6044"
                        z3="-1.19772"/>
                  <atom elementType="C"
                        id="a6"
                        x3="-2.41015"
                        y3="-0.91393"
                        z3="-0.37969"/>
                  <atom elementType="C"
                        id="a7"
                        x3="-1.83117"
                        y3="-1.07366"
                        z3="1.00848"/>
                  <atom elementType="O"
                        id="a8"
                        x3="-2.21799"
                        y3="-1.7931"
                        z3="1.89968"/>
                  <atom elementType="H"
                        id="a9"
                        x3="-0.51393"
                        y3="2.02838"
                        z3="0.80094"/>
                  <atom elementType="C"
                        id="a10"
                        x3="-2.55682"
                        y3="1.43962"
                        z3="0.30508"/>
                  <atom elementType="C"
                        id="a11"
                        x3="-3.31319"
                        y3="0.38802"
                        z3="-0.21266"/>
                  <atom elementType="O"
                        id="a12"
                        x3="-4.51797"
                        y3="0.32532"
                        z3="-0.52106"/>
                  <atom elementType="H"
                        id="a13"
                        x3="-1.02411"
                        y3="-1.06626"
                        z3="-2.18136"/>
                  <atom elementType="C"
                        id="a14"
                        x3="-3.2269"
                        y3="-2.09005"
                        z3="-0.85343"/>
                  <atom elementType="S"
                        id="a15"
                        x3="1.49728"
                        y3="-1.51261"
                        z3="-0.61244"/>
                  <atom elementType="C"
                        id="a16"
                        x3="2.88205"
                        y3="-0.49198"
                        z3="-0.21849"/>
                  <atom elementType="C"
                        id="a17"
                        x3="2.7845"
                        y3="0.85864"
                        z3="0.13988"/>
                  <atom elementType="C"
                        id="a18"
                        x3="3.93408"
                        y3="1.59406"
                        z3="0.41855"/>
                  <atom elementType="C"
                        id="a19"
                        x3="5.19623"
                        y3="1.00585"
                        z3="0.34419"/>
                  <atom elementType="C"
                        id="a20"
                        x3="5.29615"
                        y3="-0.33949"
                        z3="-0.01411"/>
                  <atom elementType="C"
                        id="a21"
                        x3="4.1536"
                        y3="-1.08304"
                        z3="-0.2911"/>
                  <atom elementType="C"
                        id="a22"
                        x3="0.13438"
                        y3="-0.13538"
                        z3="2.33797"/>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.14527"
                        y3="2.79731"
                        z3="0.50413"/>
                  <atom elementType="C"
                        id="a24"
                        x3="0.02737"
                        y3="1.58286"
                        z3="-2.07764"/>
                  <atom elementType="H"
                        id="a25"
                        x3="-3.85026"
                        y3="-2.45053"
                        z3="-0.02291"/>
                  <atom elementType="H"
                        id="a26"
                        x3="-2.58849"
                        y3="-2.92198"
                        z3="-1.1944"/>
                  <atom elementType="H"
                        id="a27"
                        x3="-3.90406"
                        y3="-1.7688"
                        z3="-1.6577"/>
                  <atom elementType="H"
                        id="a28"
                        x3="1.80229"
                        y3="1.32763"
                        z3="0.19825"/>
                  <atom elementType="H"
                        id="a29"
                        x3="3.83612"
                        y3="2.64642"
                        z3="0.69884"/>
                  <atom elementType="H"
                        id="a30"
                        x3="6.09357"
                        y3="1.58865"
                        z3="0.56539"/>
                  <atom elementType="H"
                        id="a31"
                        x3="6.27692"
                        y3="-0.81935"
                        z3="-0.07556"/>
                  <atom elementType="H"
                        id="a32"
                        x3="4.23786"
                        y3="-2.13844"
                        z3="-0.5652"/>
                  <atom elementType="H"
                        id="a33"
                        x3="0.51083"
                        y3="-1.13826"
                        z3="2.59337"/>
                  <atom elementType="H"
                        id="a34"
                        x3="-0.55244"
                        y3="0.17297"
                        z3="3.14129"/>
                  <atom elementType="H"
                        id="a35"
                        x3="0.98796"
                        y3="0.5584"
                        z3="2.31618"/>
                  <atom elementType="H"
                        id="a36"
                        x3="-2.7620"
                        y3="3.56766"
                        z3="-0.20084"/>
                  <atom elementType="H"
                        id="a37"
                        x3="-4.23285"
                        y3="2.72456"
                        z3="0.34429"/>
                  <atom elementType="H"
                        id="a38"
                        x3="-2.9806"
                        y3="3.20797"
                        z3="1.52152"/>
                  <atom elementType="H"
                        id="a39"
                        x3="0.76989"
                        y3="2.3120"
                        z3="-1.71362"/>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.81016"
                        y3="2.14413"
                        z3="-2.5230"/>
                  <atom elementType="H"
                        id="a41"
                        x3="0.50134"
                        y3="0.98502"
                        z3="-2.87235"/>
               </atomArray>
               <bondArray/>
               <formula concise="C19H19O2S"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">292.26709999999986</scalar>
               </property>
               <list cmlx:templateRef="charge">
                  <list>
                     <scalar dataType="xsd:integer" dictRef="g:charge">-1</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:mult">1</scalar>
                  </list>
               </list>
               <formula convention="iupac:inchi"
                        inline="InChI=1S/C19H19O2S/c1-10-12-17(3)14-16(2,13(10)20)15(21)18(12,4)19(14,17)22-11-8-6-5-7-9-11/h5-9,12,14H,1-4H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:23,14,24,22,19,18,20,17,21,10,16,2,11,5,7,6,1,3,4,12,8,15/E:(6,7)(8,9)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,13.3,15.3,20.1,21.1/rA:41CCCCCCC3O1HC3C3O1HCSC3C3C3C3C3C3CCCHHHHHHHHHHHHHHHHH/rB:s1;s2;s1s3;s1s4;s5;s3s6;s7;s2;s2;s6s10;s11;s5;s6;s4;s15;s16;s17;s18;s19;s16s20;s3;s10;s1;s14;s14;s14;s17;s18;s19;s20;s21;s22;s22;s22;s23;s23;s23;s24;s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="entering" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:string" dictRef="g:link0">g16</scalar>
                  <array dataType="xsd:string" dictRef="g:command" size="1">Output=21_dep_a.log</array>
               </module>
               <module cmlx:templateRef="l1" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l1.end">
                     <array dataType="xsd:string" dictRef="g:kk" size="1">nprocshared=16</array>
                     <array dataType="xsd:string" dictRef="g:kk" size="1">mem=32GB</array>
                     <scalar cmlx:templateRef="title" dataType="xsd:string" dictRef="cc:title"># opt=(gdiis,maxstep=10,notrust) freq scrf=(smd,solvent=thf) nosymm de</scalar>
                     <list cmlx:templateRef="control">
                        <scalar dataType="xsd:string" dictRef="g:control">1/8=10,9=1,18=20,19=11,26=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=43,7=101,11=2,25=1,30=1,70=32201,71=1,72=20,74=-13,124=41/1,2,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">4//1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">5/5=2,38=5,53=20/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">6/7=2,8=2,9=2,10=2,28=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">7/30=1/1,2,3,16</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">1/8=10,9=1,18=20,19=11,26=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=43,7=101,11=2,25=1,30=1,70=32205,71=1,72=20,74=-13,124=41/1,2,3</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=5,53=20/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">7/30=1/1,2,3,16</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">1/8=10,9=1,18=20,19=11,26=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=2,8=2,9=2,10=2,19=2,28=1/1</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">Title Card Required</scalar>
                  </module>
                  <list cmlx:templateRef="rest">
                     <scalar dataType="xsd:string" dictRef="x:l101"/>
                     <scalar dataType="xsd:string" dictRef="x:l101"/>
                  </list>
               </module>
               <module cmlx:templateRef="l103" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="berny">
                     <scalar dataType="xsd:string" dictRef="g:optimization">Berny optimization.</scalar>
                  </list>
                  <module cmlx:templateRef="l103.init">
                     <list cmlx:templateRef="length">
                        <array dataType="xsd:string" dictRef="g:symbol" size="45">R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="45">1 1 1 1 2 2 2 3 3 3 4 4 5 5 6 6 6 7 10 10 11 14 14 14 15 16 16 17 17 18 18 19 19 20 20 21 22 22 22 23 23 23 24 24 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="45">2 4 5 24 3 9 10 4 7 22 5 15 6 13 7 11 14 8 11 23 12 25 26 27 16 17 21 18 28 19 29 20 30 21 31 32 33 34 35 36 37 38 39 40 41</array>
                        <array dataType="xsd:double" dictRef="cc:distance" size="45">1.5469 1.5122 1.4941 1.4913 1.5866 1.1034 1.4929 1.5482 1.523 1.5005 1.5285 1.7552 1.5362 1.0936 1.5125 1.5933 1.5082 1.2089 1.395 1.4931 1.2452 1.0992 1.1027 1.0994 1.7648 1.4008 1.4041 1.3928 1.09 1.3945 1.0934 1.3958 1.0926 1.3911 1.0936 1.0937 1.1012 1.101 1.1002 1.1123 1.1017 1.1094 1.1025 1.1022 1.1016</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="45">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|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="85">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 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="85">2 2 2 4 5 1 1 1 3 3 9 2 2 2 4 4 7 1 1 3 3 5 1 1 4 4 6 5 5 5 7 7 11 3 3 6 2 2 11 6 6 10 6 6 6 25 25 26 4 15 15 17 16 16 18 17 17 19 18 18 20 19 19 21 16 16 20 3 3 3 33 33 34 10 10 10 36 36 37 1 1 1 39 39 40</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="85">1 1 1 1 1 2 2 2 2 2 2 3 3 3 3 3 3 4 4 4 4 4 5 5 5 5 5 6 6 6 6 6 6 7 7 7 10 10 10 11 11 11 14 14 14 14 14 14 15 16 16 16 17 17 17 18 18 18 19 19 19 20 20 20 21 21 21 22 22 22 22 22 22 23 23 23 23 23 23 24 24 24 24 24 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="85">4 5 24 24 24 3 9 10 9 10 10 4 7 22 7 22 22 3 15 5 15 15 6 13 6 13 13 7 11 14 11 14 14 6 8 8 11 23 23 10 12 12 25 26 27 26 27 27 16 17 21 21 18 28 28 19 29 29 20 30 30 21 31 31 20 32 32 33 34 35 34 35 35 36 37 38 37 38 38 39 40 41 40 41 41</array>
                        <array dataType="xsd:double" dictRef="cc:angle" size="85">90.5871 103.1041 126.5702 132.0796 123.8454 89.1802 111.9174 113.5214 109.1004 117.1617 113.6148 87.8234 105.1041 119.813 102.3843 122.1959 115.1174 91.9176 133.5412 98.8946 129.8082 120.7584 117.6784 117.131 111.475 117.4203 119.1062 101.2629 110.9234 115.7886 101.9486 114.4074 111.2985 105.0764 126.7917 128.0933 115.0771 122.2935 121.4181 110.3411 118.7682 130.8805 108.9962 111.8346 109.6019 108.3322 107.4135 110.5401 105.0826 124.0623 117.1039 118.8283 120.186 119.4276 120.3864 120.9066 119.0455 120.0479 119.0155 120.5013 120.4831 120.4979 120.1025 119.3992 120.5654 119.2727 120.1616 110.5976 109.3283 112.3191 107.4027 108.2791 108.774 114.1715 108.0402 113.6004 107.0934 105.8846 107.6997 111.8157 109.4966 111.3688 107.9632 107.8984 108.1674</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="85">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|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|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="138">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 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 D137 D138</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="138">4 4 4 5 5 5 24 24 24 2 2 24 24 2 2 24 24 2 2 2 4 4 4 5 5 5 1 1 1 9 9 9 10 10 10 1 1 3 3 9 9 2 2 2 7 7 7 22 22 22 2 2 4 4 22 22 2 2 2 4 4 4 7 7 7 3 3 15 15 1 3 5 1 1 1 4 4 4 13 13 13 5 5 11 11 14 14 5 5 7 7 14 14 5 5 5 7 7 7 11 11 11 2 2 23 23 2 2 2 11 11 11 4 4 15 15 21 21 15 15 17 17 16 16 28 28 17 17 29 29 18 18 30 30 19 19 31 31</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="138">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 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 3 3 3 3 3 3 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 10 10 10 10 10 10 10 10 10 10 15 15 16 16 16 16 16 16 16 16 17 17 17 17 18 18 18 18 19 19 19 19 20 20 20 20</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="138">2 2 2 2 2 2 2 2 2 4 4 4 4 5 5 5 5 24 24 24 24 24 24 24 24 24 3 3 3 3 3 3 3 3 3 10 10 10 10 10 10 4 4 4 4 4 4 4 4 4 7 7 7 7 7 7 22 22 22 22 22 22 22 22 22 5 5 5 5 15 15 15 6 6 6 6 6 6 6 6 6 7 7 7 7 7 7 11 11 11 11 11 11 14 14 14 14 14 14 14 14 14 11 11 11 11 23 23 23 23 23 23 16 16 17 17 17 17 21 21 21 21 18 18 18 18 19 19 19 19 20 20 20 20 21 21 21 21</array>
                        <array dataType="xsd:integer" dictRef="g:atom4" size="138">3 9 10 3 9 10 3 9 10 3 15 3 15 6 13 6 13 39 40 41 39 40 41 39 40 41 4 7 22 4 7 22 4 7 22 11 23 11 23 11 23 1 5 15 1 5 15 1 5 15 6 8 6 8 6 8 33 34 35 33 34 35 33 34 35 6 13 6 13 16 16 16 7 11 14 7 11 14 7 11 14 3 8 3 8 3 8 10 12 10 12 10 12 25 26 27 25 26 27 25 26 27 6 12 6 12 36 37 38 36 37 38 17 21 18 28 18 28 20 32 20 32 19 29 19 29 20 30 20 30 21 31 21 31 16 32 16 32</array>
                        <array dataType="xsd:double" dictRef="cc:dihed" size="138">-5.3008 105.0029 -124.7528 55.1218 165.4255 -64.3302 -152.6619 -42.3582 87.8862 5.4353 -150.8447 149.7307 -6.5493 16.7465 169.1179 -136.4618 15.9095 52.9701 -66.6419 173.7737 -80.4253 159.9626 40.3782 -160.1657 80.2222 -39.3622 5.1807 -97.0615 131.5333 -107.7801 149.9777 18.5725 121.3651 19.1229 -112.2823 51.9516 -115.6266 -49.9239 142.4978 -178.6586 13.7631 -5.3026 -64.0702 152.3894 99.6861 40.9184 -102.6219 -129.6358 171.5965 28.0561 44.9381 -137.1832 -46.1498 131.7289 178.9869 -3.1344 -172.2966 69.642 -51.1998 -64.2942 177.6444 56.8026 60.8111 -57.2503 -178.0921 -23.5991 -166.0635 124.3123 -18.1521 68.9156 -79.5264 143.5691 -69.5878 37.9985 166.0679 -3.1592 104.4271 -127.5035 138.5999 -113.8138 14.2556 29.7775 -148.064 -84.7002 97.4583 155.0523 -22.7892 -53.2402 127.7969 53.8957 -125.0672 176.2964 -2.6665 158.6616 38.9073 -84.0435 41.4386 -78.3158 158.7334 -73.4545 166.7911 43.8403 9.5401 -171.6623 177.2376 -3.9648 57.2776 176.2908 -64.288 -109.5253 9.4879 128.9091 -5.0562 175.8054 -179.1756 0.8131 -0.051 179.9377 179.0801 -1.126 -0.1052 179.6886 0.1384 -179.8507 -179.8502 0.1607 -0.068 -179.9243 179.921 0.0647 -0.0892 -179.8535 179.7671 0.0027 0.1767 -179.6153 179.9427 0.1507</array>
                        <array dataType="xsd:string"
                               delimiter="|"
                               dictRef="g:deriv"
                               size="138">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|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|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|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|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>
               <module cmlx:templateRef="l301.basis" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">41</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 cmlx:templateRef="l103" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="berny">
                     <scalar dataType="xsd:string" dictRef="g:optimization">Berny optimization.</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 12 out of a maximum of 246</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="117">0.00123 0.00275 0.00720 0.00794 0.00854 0.01095 0.01129 0.01431 0.01507 0.01762 0.01915 0.01965 0.02076 0.02105 0.02123 0.02150 0.02156 0.02167 0.02174 0.02181 0.02265 0.03037 0.03472 0.03678 0.04271 0.04492 0.04544 0.05390 0.05590 0.05651 0.05716 0.05802 0.05892 0.05916 0.05930 0.06767 0.06786 0.07304 0.07332 0.08245 0.08473 0.09710 0.10822 0.10966 0.12638 0.14442 0.14611 0.15460 0.15686 0.15876 0.15918 0.16000 0.16000 0.16000 0.16000 0.16000 0.16002 0.16006 0.16011 0.16027 0.16046 0.16062 0.16137 0.16580 0.17624 0.18448 0.20906 0.22000 0.22034 0.22518 0.23349 0.23809 0.24376 0.24668 0.25198 0.25904 0.26101 0.26312 0.28056 0.28243 0.28851 0.29896 0.30115 0.31496 0.31982 0.32380 0.32452 0.32685 0.33238 0.33304 0.33400 0.33435 0.33445 0.33493 0.33504 0.33547 0.33587 0.33737 0.33773 0.33832 0.34172 0.34392 0.34398 0.34413 0.34429 0.34512 0.35817 0.39691 0.42063 0.42222 0.43970 0.45501 0.46390 0.46826 0.47064 0.81432 0.99347</array>
                     <list cmlx:templateRef="iterationList">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="2">1 2</array>
                        <array dataType="xsd:double" dictRef="g:rmscart" size="2">0.00025705 0.00000006</array>
                        <array dataType="xsd:double" dictRef="g:rmsint" size="2">0.00000010 0.00000009</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l103.deltas">
                     <list cmlx:templateRef="delta">
                        <array dataType="xsd:string" dictRef="cc:variable" size="268">R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 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 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 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 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 D137 D138</array>
                        <array dataType="xsd:double" dictRef="g:lastval" size="268">2.92053 2.85592 2.82689 2.81890 2.99437 2.08247 2.83218 2.92709 2.87071 2.83562 2.88503 3.31810 2.90698 2.06647 2.86180 2.99247 2.84980 2.28816 2.63546 2.82648 2.36623 2.07690 2.08319 2.07793 3.34718 2.64486 2.65171 2.63487 2.06015 2.63546 2.06628 2.63810 2.06486 2.63116 2.06617 2.06720 2.08166 2.08198 2.07806 2.10063 2.08283 2.09455 2.08248 2.08383 2.08164 1.58006 1.79877 2.21091 2.29916 2.16563 1.55920 1.95369 1.98401 1.90320 2.03797 1.98493 1.53122 1.83875 2.08471 1.78227 2.12916 2.01899 1.60482 2.33836 1.72982 2.25897 2.10474 2.05306 2.04848 1.94132 2.05299 2.07703 1.76551 1.94259 2.00854 1.77817 1.99307 1.95498 1.83529 2.22021 2.22699 2.00674 2.12444 2.12656 1.92891 2.07772 2.27635 1.91655 1.94715 1.92729 1.88860 1.87532 1.90712 1.83743 2.16441 2.03757 2.08098 2.09511 2.09347 2.09460 2.10753 2.07948 2.09618 2.08059 2.10141 2.10118 2.10279 2.09719 2.08319 2.09935 2.09087 2.09296 1.93631 1.91806 1.95659 1.87500 1.88615 1.88919 1.99114 1.89989 1.98320 1.86421 1.84341 1.87507 1.94951 1.92386 1.94340 1.88013 1.88466 1.87962 -0.08878 1.83654 -2.16789 0.96382 2.88914 -1.11529 -2.65117 -0.72584 1.55291 0.09088 -2.63782 2.60356 -0.12514 0.28836 2.95061 -2.39598 0.26626 0.89405 -1.19552 3.00269 -1.42418 2.76944 0.68447 -2.81349 1.38013 -0.70484 0.08668 -1.69258 2.28423 -1.88612 2.61780 0.31142 2.11746 0.33819 -1.96818 0.90908 -1.99613 -0.87021 2.50777 -3.11096 0.26701 -0.08870 -1.11670 2.66975 1.74772 0.71972 -1.77702 -2.24826 3.00693 0.51019 0.77705 -2.40232 -0.81072 2.29310 3.11997 -0.05940 -3.00947 1.20272 -0.89898 -1.13497 3.07722 0.97552 1.04839 -1.02260 -3.12430 -0.41401 -2.89636 2.15791 -0.32444 1.23349 -1.36219 2.54016 -1.21284 0.66490 2.91296 -0.05608 1.82167 -2.21346 2.41613 -1.98931 0.25875 0.52528 -2.57834 -1.47884 1.70072 2.69322 -0.41041 -0.92320 2.23839 0.94629 -2.17531 3.08372 -0.03788 2.90702 0.81321 -1.31127 0.87562 -1.21819 2.94051 -1.13425 3.05512 0.93063 0.16023 -3.00433 3.06513 -0.09943 1.02457 3.10449 -1.09011 -1.86445 0.21546 2.30406 -0.15707 3.00724 -3.11991 0.02226 -0.00157 3.14060 3.11732 -0.02743 -0.00270 3.13574 0.00398 -3.13895 -3.13820 0.00207 -0.00207 -3.14154 3.14086 0.00139 -0.00223 -3.13878 3.13724 0.00069 0.00463 -3.13381 3.14121 0.00278</array>
                        <array dataType="xsd:double" dictRef="cc:deriv" size="268">-0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00001 -0.00001 0.00001 0.00001 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00001 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00002 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00001 -0.00000 -0.00001 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000</array>
                        <array dataType="xsd:double" dictRef="cc:delta.linear" size="268">-0.00001 0.00003 -0.00002 -0.00000 0.00002 0.00001 0.00003 0.00003 -0.00001 0.00001 -0.00001 0.00000 -0.00000 0.00001 0.00005 -0.00003 0.00001 -0.00002 0.00001 -0.00001 0.00000 0.00000 -0.00000 -0.00000 0.00003 -0.00001 0.00001 0.00001 -0.00000 -0.00001 0.00000 0.00002 -0.00000 -0.00002 -0.00000 0.00000 -0.00000 0.00001 -0.00001 0.00000 0.00001 -0.00000 -0.00000 0.00001 0.00000 0.00002 0.00000 -0.00001 -0.00004 0.00003 -0.00001 0.00003 -0.00001 0.00003 0.00000 -0.00004 0.00001 -0.00001 -0.00002 0.00001 -0.00003 0.00004 -0.00002 0.00003 -0.00002 0.00001 -0.00001 0.00001 -0.00001 0.00003 0.00001 -0.00003 -0.00002 0.00001 0.00002 -0.00002 -0.00001 0.00001 0.00000 -0.00000 -0.00000 -0.00000 -0.00004 0.00008 0.00001 -0.00001 -0.00001 0.00001 -0.00002 0.00000 0.00000 0.00002 -0.00000 0.00003 0.00000 -0.00000 0.00000 -0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00001 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00001 0.00000 -0.00002 0.00002 0.00000 0.00001 -0.00001 0.00000 -0.00000 0.00000 0.00001 0.00002 -0.00004 -0.00001 0.00001 0.00001 -0.00000 0.00001 0.00001 -0.00001 -0.00001 -0.00001 0.00000 0.00003 0.00001 0.00000 0.00004 0.00001 0.00005 0.00008 0.00005 -0.00000 -0.00005 -0.00004 -0.00008 0.00001 -0.00005 -0.00002 -0.00008 0.00022 0.00023 0.00022 0.00026 0.00027 0.00026 0.00027 0.00027 0.00027 -0.00000 -0.00001 -0.00004 -0.00004 -0.00005 -0.00007 -0.00002 -0.00003 -0.00005 0.00001 -0.00017 0.00002 -0.00016 0.00002 -0.00017 0.00000 0.00002 0.00005 -0.00000 0.00001 0.00004 0.00003 0.00005 0.00008 0.00002 -0.00000 0.00001 -0.00001 0.00001 -0.00001 -0.00014 -0.00015 -0.00015 -0.00017 -0.00018 -0.00018 -0.00015 -0.00016 -0.00016 -0.00002 -0.00003 -0.00004 -0.00005 -0.00002 -0.00007 -0.00003 0.00001 -0.00002 0.00002 0.00004 0.00001 0.00005 0.00006 0.00004 0.00007 -0.00003 -0.00000 -0.00002 -0.00000 -0.00002 0.00000 0.00003 0.00006 0.00001 0.00004 -0.00001 0.00002 -0.00009 -0.00008 -0.00006 -0.00007 -0.00006 -0.00005 -0.00005 -0.00004 -0.00003 -0.00003 -0.00006 0.00014 0.00011 0.00033 0.00035 0.00035 0.00015 0.00016 0.00016 0.00015 0.00009 -0.00001 0.00003 0.00005 0.00009 0.00002 -0.00002 -0.00004 -0.00007 -0.00002 -0.00001 -0.00005 -0.00005 -0.00003 -0.00003 -0.00003 -0.00003 0.00004 0.00003 0.00004 0.00003 -0.00000 0.00003 0.00001 0.00004</array>
                        <array dataType="xsd:double" dictRef="cc:delta.quad" size="268">-0.00002 0.00001 -0.00001 -0.00000 -0.00000 -0.00001 -0.00001 -0.00001 -0.00001 -0.00001 0.00002 -0.00002 -0.00001 -0.00000 -0.00000 -0.00001 -0.00001 0.00000 -0.00001 -0.00000 -0.00000 -0.00001 0.00000 0.00000 -0.00003 -0.00001 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00001 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00001 0.00000 0.00001 -0.00001 -0.00001 0.00000 -0.00000 -0.00000 -0.00001 -0.00000 0.00000 0.00002 -0.00001 0.00001 0.00001 -0.00000 0.00001 -0.00001 -0.00001 -0.00001 0.00003 -0.00001 -0.00001 0.00002 -0.00001 0.00000 0.00003 -0.00001 -0.00001 -0.00001 -0.00000 0.00001 0.00000 -0.00000 -0.00000 -0.00001 0.00003 -0.00002 0.00003 -0.00003 0.00001 -0.00002 0.00002 -0.00001 0.00001 0.00001 0.00001 -0.00002 0.00002 -0.00001 -0.00002 0.00000 -0.00001 0.00000 0.00000 0.00002 0.00003 0.00001 -0.00000 -0.00001 0.00000 -0.00001 0.00001 0.00000 -0.00000 -0.00000 -0.00000 0.00001 -0.00001 -0.00000 -0.00001 0.00001 0.00001 -0.00001 0.00001 0.00000 -0.00001 -0.00001 -0.00000 0.00001 0.00000 0.00004 0.00004 -0.00005 -0.00003 0.00001 -0.00001 0.00001 -0.00004 0.00001 0.00000 0.00001 0.00001 -0.00001 -0.00000 -0.00001 -0.00001 0.00001 -0.00000 -0.00004 -0.00002 -0.00003 0.00002 -0.00003 0.00003 -0.00002 0.00001 0.00001 0.00003 0.00003 0.00032 0.00033 0.00034 0.00030 0.00031 0.00032 0.00029 0.00030 0.00031 0.00001 0.00003 0.00003 0.00000 0.00002 0.00001 0.00002 0.00003 0.00003 0.00003 -0.00011 0.00003 -0.00012 0.00003 -0.00011 -0.00001 -0.00000 0.00004 0.00002 0.00003 0.00008 0.00000 0.00001 0.00006 -0.00007 -0.00009 -0.00006 -0.00009 -0.00007 -0.00009 -0.00022 -0.00021 -0.00021 -0.00023 -0.00022 -0.00022 -0.00024 -0.00024 -0.00023 0.00001 0.00002 -0.00003 -0.00002 0.00013 0.00006 0.00012 -0.00005 -0.00001 0.00001 -0.00005 -0.00001 0.00001 -0.00006 -0.00002 0.00000 0.00006 0.00009 0.00003 0.00005 0.00001 0.00004 0.00005 0.00005 0.00006 0.00006 0.00004 0.00004 -0.00005 -0.00004 -0.00007 0.00000 0.00001 -0.00001 -0.00002 -0.00001 -0.00003 -0.00005 -0.00005 0.00009 0.00009 0.00048 0.00050 0.00049 0.00033 0.00034 0.00033 -0.00020 -0.00013 0.00001 -0.00002 -0.00006 -0.00010 -0.00001 0.00001 0.00006 0.00008 0.00001 0.00002 0.00005 0.00005 0.00004 0.00002 0.00003 0.00001 -0.00004 -0.00002 -0.00002 -0.00000 -0.00001 -0.00003 -0.00003 -0.00005</array>
                        <array dataType="xsd:double" dictRef="cc:delta.total" size="268">-0.00003 0.00004 -0.00004 -0.00000 0.00002 -0.00000 0.00002 0.00002 -0.00002 0.00000 0.00001 -0.00001 -0.00001 0.00000 0.00005 -0.00004 0.00000 -0.00002 -0.00001 -0.00001 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00001 0.00001 0.00001 -0.00000 -0.00001 -0.00000 0.00001 -0.00000 -0.00002 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00001 0.00000 -0.00001 -0.00000 0.00000 -0.00000 0.00001 -0.00000 -0.00001 -0.00002 0.00002 0.00000 0.00004 -0.00001 0.00003 -0.00000 -0.00005 0.00000 0.00002 -0.00004 -0.00000 -0.00001 0.00002 -0.00002 0.00006 -0.00003 0.00000 -0.00002 0.00001 -0.00000 0.00003 0.00001 -0.00003 -0.00003 0.00004 -0.00000 0.00001 -0.00004 0.00002 -0.00001 0.00002 -0.00001 0.00001 -0.00003 0.00009 -0.00000 0.00001 -0.00001 -0.00001 -0.00001 -0.00001 0.00000 0.00002 0.00002 0.00006 0.00001 -0.00000 -0.00001 -0.00000 -0.00001 0.00001 0.00001 -0.00002 0.00001 -0.00000 0.00001 -0.00001 -0.00000 -0.00002 0.00002 0.00001 -0.00004 0.00003 0.00001 0.00000 -0.00002 0.00000 0.00001 0.00001 0.00004 0.00006 -0.00008 -0.00004 0.00001 -0.00000 0.00001 -0.00002 0.00002 -0.00001 0.00000 0.00000 -0.00001 0.00003 -0.00001 -0.00000 0.00004 0.00000 0.00002 0.00006 0.00002 0.00001 -0.00008 -0.00001 -0.00010 0.00002 -0.00003 0.00001 -0.00004 0.00054 0.00055 0.00055 0.00056 0.00058 0.00058 0.00055 0.00057 0.00057 0.00001 0.00001 -0.00001 -0.00004 -0.00003 -0.00006 -0.00000 0.00000 -0.00002 0.00005 -0.00028 0.00005 -0.00028 0.00005 -0.00028 -0.00001 0.00002 0.00009 0.00001 0.00004 0.00012 0.00004 0.00006 0.00014 -0.00005 -0.00009 -0.00005 -0.00010 -0.00006 -0.00010 -0.00036 -0.00037 -0.00036 -0.00040 -0.00040 -0.00040 -0.00039 -0.00039 -0.00039 -0.00001 -0.00001 -0.00007 -0.00007 0.00011 -0.00001 0.00008 -0.00004 -0.00003 0.00003 -0.00001 0.00000 0.00006 0.00000 0.00001 0.00007 0.00004 0.00008 0.00000 0.00005 -0.00001 0.00004 0.00008 0.00011 0.00007 0.00010 0.00003 0.00006 -0.00014 -0.00012 -0.00013 -0.00007 -0.00005 -0.00006 -0.00007 -0.00005 -0.00006 -0.00008 -0.00011 0.00023 0.00020 0.00082 0.00084 0.00083 0.00048 0.00051 0.00049 -0.00005 -0.00003 0.00001 0.00000 -0.00001 -0.00001 0.00001 -0.00001 0.00002 0.00001 -0.00001 0.00000 -0.00001 0.00001 0.00001 -0.00001 0.00000 -0.00002 -0.00000 0.00000 0.00002 0.00003 -0.00002 -0.00000 -0.00002 -0.00001</array>
                        <array dataType="xsd:double" dictRef="cc:newval" size="268">2.92051 2.85596 2.82686 2.81890 2.99439 2.08246 2.83220 2.92711 2.87069 2.83562 2.88504 3.31809 2.90697 2.06648 2.86185 2.99242 2.84980 2.28814 2.63545 2.82647 2.36623 2.07690 2.08319 2.07792 3.34718 2.64485 2.65172 2.63489 2.06015 2.63545 2.06628 2.63811 2.06486 2.63114 2.06617 2.06720 2.08166 2.08198 2.07806 2.10064 2.08284 2.09454 2.08248 2.08383 2.08164 1.58008 1.79877 2.21090 2.29914 2.16565 1.55920 1.95373 1.98400 1.90324 2.03797 1.98489 1.53122 1.83877 2.08467 1.78227 2.12915 2.01901 1.60480 2.33841 1.72979 2.25898 2.10472 2.05307 2.04848 1.94135 2.05300 2.07700 1.76549 1.94263 2.00854 1.77818 1.99303 1.95500 1.83527 2.22024 2.22698 2.00675 2.12441 2.12666 1.92890 2.07773 2.27633 1.91654 1.94714 1.92728 1.88860 1.87534 1.90714 1.83749 2.16442 2.03757 2.08098 2.09511 2.09347 2.09461 2.10753 2.07947 2.09619 2.08059 2.10142 2.10117 2.10279 2.09718 2.08320 2.09936 2.09083 2.09299 1.93632 1.91806 1.95657 1.87500 1.88616 1.88919 1.99118 1.89995 1.98312 1.86417 1.84342 1.87507 1.94951 1.92383 1.94342 1.88012 1.88466 1.87963 -0.08880 1.83657 -2.16790 0.96382 2.88919 -1.11528 -2.65115 -0.72578 1.55293 0.09089 -2.63790 2.60355 -0.12524 0.28838 2.95057 -2.39597 0.26622 0.89458 -1.19496 3.00325 -1.42362 2.77002 0.68505 -2.81294 1.38070 -0.70427 0.08670 -1.69257 2.28421 -1.88616 2.61776 0.31136 2.11746 0.33820 -1.96821 0.90913 -1.99642 -0.87016 2.50749 -3.11091 0.26673 -0.08871 -1.11668 2.66985 1.74773 0.71976 -1.77690 -2.24822 3.00699 0.51033 0.77700 -2.40241 -0.81078 2.29300 3.11991 -0.05950 -3.00983 1.20235 -0.89935 -1.13537 3.07682 0.97512 1.04801 -1.02299 -3.12469 -0.41402 -2.89637 2.15784 -0.32451 1.23360 -1.36220 2.54024 -1.21289 0.66487 2.91299 -0.05608 1.82167 -2.21339 2.41613 -1.98930 0.25883 0.52532 -2.57826 -1.47884 1.70077 2.69321 -0.41037 -0.92312 2.23849 0.94635 -2.17522 3.08375 -0.03782 2.90689 0.81309 -1.31140 0.87555 -1.21824 2.94045 -1.13432 3.05507 0.93058 0.16015 -3.00444 3.06536 -0.09923 1.02539 3.10533 -1.08928 -1.86397 0.21597 2.30455 -0.15712 3.00721 -3.11991 0.02226 -0.00158 3.14059 3.11732 -0.02744 -0.00268 3.13575 0.00397 -3.13894 -3.13820 0.00207 -0.00206 -3.14155 3.14086 0.00137 -0.00223 -3.13878 3.13726 0.00072 0.00461 -3.13381 3.14120 0.00278</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">0.000020 0.000003 0.001774 0.000257</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">YES YES YES YES</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="preddelta">
                     <list cmlx:templateRef="predicted">
                        <scalar dataType="xsd:double" dictRef="g:predchange">-1.552710e-08</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="45">R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="45">1 1 1 1 2 2 2 3 3 3 4 4 5 5 6 6 6 7 10 10 11 14 14 14 15 16 16 17 17 18 18 19 19 20 20 21 22 22 22 23 23 23 24 24 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="45">2 4 5 24 3 9 10 4 7 22 5 15 6 13 7 11 14 8 11 23 12 25 26 27 16 17 21 18 28 19 29 20 30 21 31 32 33 34 35 36 37 38 39 40 41</array>
                        <array dataType="xsd:double" dictRef="cc:distance" size="45">1.5455 1.5113 1.4959 1.4917 1.5846 1.102 1.4987 1.549 1.5191 1.5005 1.5267 1.7559 1.5383 1.0935 1.5144 1.5835 1.508 1.2108 1.3946 1.4957 1.2522 1.099 1.1024 1.0996 1.7713 1.3996 1.4032 1.3943 1.0902 1.3946 1.0934 1.396 1.0927 1.3924 1.0934 1.0939 1.1016 1.1017 1.0997 1.1116 1.1022 1.1084 1.102 1.1027 1.1016</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="45">-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|-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|-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="85">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 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="85">2 2 2 4 5 1 1 1 3 3 9 2 2 2 4 4 7 1 1 3 3 5 1 1 4 4 6 5 5 5 7 7 11 3 3 6 2 2 11 6 6 10 6 6 6 25 25 26 4 15 15 17 16 16 18 17 17 19 18 18 20 19 19 21 16 16 20 3 3 3 33 33 34 10 10 10 36 36 37 1 1 1 39 39 40</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="85">1 1 1 1 1 2 2 2 2 2 2 3 3 3 3 3 3 4 4 4 4 4 5 5 5 5 5 6 6 6 6 6 6 7 7 7 10 10 10 11 11 11 14 14 14 14 14 14 15 16 16 16 17 17 17 18 18 18 19 19 19 20 20 20 21 21 21 22 22 22 22 22 22 23 23 23 23 23 23 24 24 24 24 24 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="85">4 5 24 24 24 3 9 10 9 10 10 4 7 22 7 22 22 3 15 5 15 15 6 13 6 13 13 7 11 14 11 14 14 6 8 8 11 23 23 10 12 12 25 26 27 26 27 27 16 17 21 21 18 28 28 19 29 29 20 30 30 21 31 31 20 32 32 33 34 35 34 35 35 36 37 38 37 38 38 39 40 41 40 41 41</array>
                        <array dataType="xsd:double" dictRef="cc:angle" size="85">90.5311 103.0619 126.6757 131.7321 124.0813 89.3355 111.9384 113.6756 109.0456 116.7671 113.7283 87.7322 105.3527 119.4449 102.1165 121.9922 115.6795 91.9494 133.9781 99.1112 129.4295 120.5928 117.6319 117.3691 111.2295 117.6277 119.0051 101.1565 111.3024 115.0808 101.8816 114.1946 112.012 105.1542 127.2089 127.5972 114.9775 121.7215 121.8432 110.5182 119.0444 130.425 109.8103 111.5635 110.4255 108.209 107.448 109.2698 105.2773 124.0117 116.7441 119.2316 120.0411 119.947 120.0118 120.7523 119.1455 120.1021 119.2092 120.4017 120.389 120.4811 120.1604 119.3578 120.2839 119.7978 119.9181 110.9426 109.8968 112.1045 107.4295 108.0682 108.2423 114.0837 108.8555 113.6288 106.8112 105.6197 107.4336 111.6985 110.2289 111.3485 107.7235 107.9832 107.6945</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="85">-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|-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|-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|-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|-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>
                     <list cmlx:templateRef="dihed">
                        <array dataType="xsd:string" dictRef="g:symbol" size="137">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 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 D137</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="137">4 4 4 5 5 5 24 24 24 2 2 24 24 2 2 24 24 2 2 2 4 4 4 5 5 5 1 1 1 9 9 9 10 10 10 1 1 3 3 9 9 2 2 2 7 7 7 22 22 22 2 2 4 4 22 22 2 2 2 4 4 4 7 7 7 3 3 15 15 1 3 5 1 1 1 4 4 4 13 13 13 5 5 11 11 14 14 5 5 7 7 14 14 5 5 5 7 7 7 11 11 11 2 2 23 23 2 2 2 11 11 11 4 4 15 15 21 21 15 15 17 17 16 16 28 28 17 17 29 29 18 18 30 30 19 19 31</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="137">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 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 3 3 3 3 3 3 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 10 10 10 10 10 10 10 10 10 10 15 15 16 16 16 16 16 16 16 16 17 17 17 17 18 18 18 18 19 19 19 19 20 20 20</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="137">2 2 2 2 2 2 2 2 2 4 4 4 4 5 5 5 5 24 24 24 24 24 24 24 24 24 3 3 3 3 3 3 3 3 3 10 10 10 10 10 10 4 4 4 4 4 4 4 4 4 7 7 7 7 7 7 22 22 22 22 22 22 22 22 22 5 5 5 5 15 15 15 6 6 6 6 6 6 6 6 6 7 7 7 7 7 7 11 11 11 11 11 11 14 14 14 14 14 14 14 14 14 11 11 11 11 23 23 23 23 23 23 16 16 17 17 17 17 21 21 21 21 18 18 18 18 19 19 19 19 20 20 20 20 21 21 21</array>
                        <array dataType="xsd:integer" dictRef="g:atom4" size="137">3 9 10 3 9 10 3 9 10 3 15 3 15 6 13 6 13 39 40 41 39 40 41 39 40 41 4 7 22 4 7 22 4 7 22 11 23 11 23 11 23 1 5 15 1 5 15 1 5 15 6 8 6 8 6 8 33 34 35 33 34 35 33 34 35 6 13 6 13 16 16 16 7 11 14 7 11 14 7 11 14 3 8 3 8 3 8 10 12 10 12 10 12 25 26 27 25 26 27 25 26 27 6 12 6 12 36 37 38 36 37 38 17 21 18 28 18 28 20 32 20 32 19 29 19 29 20 30 20 30 21 31 21 31 16 32 16</array>
                        <array dataType="xsd:double" dictRef="cc:dihed" size="137">-5.087 105.2259 -124.211 55.2229 165.5358 -63.9012 -151.9007 -41.5877 88.9753 5.2069 -151.1358 149.1729 -7.1697 16.5221 169.0573 -137.2796 15.2556 51.2251 -68.4981 172.0417 -81.5994 158.6774 39.2172 -161.2011 79.0757 -40.3845 4.9667 -96.9779 130.8765 -108.0668 149.9886 17.843 121.3216 19.377 -112.7686 52.0865 -114.37 -49.8592 143.6844 -178.245 15.2985 -5.0819 -63.982 152.9657 100.1367 41.2367 -101.8157 -128.8156 172.2843 29.232 44.5215 -137.6426 -46.451 131.3848 178.761 -3.4031 -172.4301 68.9109 -51.508 -65.0292 176.3118 55.8929 60.0686 -58.5904 -179.0093 -23.7211 -165.9494 123.6391 -18.5892 70.6737 -78.0477 145.5406 -69.4908 38.0958 166.9003 -3.2129 104.3738 -126.8218 138.4342 -113.9791 14.8253 30.0963 -147.7283 -84.7313 97.4441 154.3099 -23.5148 -52.8955 128.2502 54.2182 -124.6362 176.684 -2.1704 166.5602 46.5937 -75.1305 50.1693 -69.7972 168.4787 -64.988 175.0455 53.3214 9.1806 -172.1351 175.6188 -5.6969 58.7036 177.874 -62.4585 -106.8252 12.3451 132.0127 -8.9996 172.3021 -178.7578 1.2755 -0.0899 179.9434 178.6091 -1.5718 -0.1545 179.6647 0.2278 -179.8483 -179.8055 0.1184 -0.1186 -179.997 179.9582 0.0798 -0.1279 -179.8389 179.7505 0.0395 0.2651 -179.5539 179.9783</array>
                        <array dataType="xsd:string"
                               delimiter="|"
                               dictRef="g:deriv"
                               size="137">-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|-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|-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|-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|-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|-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|-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|-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>
                  <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="-1"
                               id="mol.l202.orient"
                               spinMultiplicity="1">
                        <atomArray>
                           <atom elementType="C"
                                 id="a1"
                                 x3="-0.483794"
                                 y3="0.715963"
                                 z3="-0.977094">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a2"
                                 x3="-1.086051"
                                 y3="1.190987"
                                 z3="0.366286">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a3"
                                 x3="-0.608131"
                                 y3="-0.166425"
                                 z3="1.034391">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a4"
                                 x3="0.089281"
                                 y3="-0.510976"
                                 z3="-0.304168">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a5"
                                 x3="-1.147265"
                                 y3="-0.604395"
                                 z3="-1.197717">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a6"
                                 x3="-2.410154"
                                 y3="-0.913934"
                                 z3="-0.379692">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a7"
                                 x3="-1.831174"
                                 y3="-1.073657"
                                 z3="1.008478">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="O"
                                 id="a8"
                                 x3="-2.21799"
                                 y3="-1.793104"
                                 z3="1.899679">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a9"
                                 x3="-0.51393"
                                 y3="2.028375"
                                 z3="0.800943">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a10"
                                 x3="-2.556823"
                                 y3="1.439616"
                                 z3="0.305084">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a11"
                                 x3="-3.313189"
                                 y3="0.388024"
                                 z3="-0.212659">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="O"
                                 id="a12"
                                 x3="-4.51797"
                                 y3="0.325317"
                                 z3="-0.521061">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a13"
                                 x3="-1.024105"
                                 y3="-1.066262"
                                 z3="-2.181363">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a14"
                                 x3="-3.226899"
                                 y3="-2.090048"
                                 z3="-0.853432">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="S"
                                 id="a15"
                                 x3="1.497278"
                                 y3="-1.512608"
                                 z3="-0.612443">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a16"
                                 x3="2.88205"
                                 y3="-0.491984"
                                 z3="-0.218492">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a17"
                                 x3="2.784501"
                                 y3="0.858638"
                                 z3="0.139876">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a18"
                                 x3="3.934076"
                                 y3="1.594059"
                                 z3="0.418546">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a19"
                                 x3="5.196229"
                                 y3="1.005849"
                                 z3="0.344188">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a20"
                                 x3="5.296154"
                                 y3="-0.339491"
                                 z3="-0.014112">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a21"
                                 x3="4.153596"
                                 y3="-1.083042"
                                 z3="-0.291103">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a22"
                                 x3="0.134378"
                                 y3="-0.135381"
                                 z3="2.337965">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a23"
                                 x3="-3.145267"
                                 y3="2.797314"
                                 z3="0.504134">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a24"
                                 x3="0.027372"
                                 y3="1.582861"
                                 z3="-2.077643">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a25"
                                 x3="-3.85026"
                                 y3="-2.450532"
                                 z3="-0.022914">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a26"
                                 x3="-2.588488"
                                 y3="-2.921983"
                                 z3="-1.194399">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a27"
                                 x3="-3.90406"
                                 y3="-1.768802"
                                 z3="-1.657695">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a28"
                                 x3="1.802289"
                                 y3="1.327631"
                                 z3="0.198252">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a29"
                                 x3="3.836116"
                                 y3="2.64642"
                                 z3="0.698836">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a30"
                                 x3="6.093569"
                                 y3="1.588649"
                                 z3="0.565388">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a31"
                                 x3="6.276923"
                                 y3="-0.819347"
                                 z3="-0.075563">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a32"
                                 x3="4.237864"
                                 y3="-2.138438"
                                 z3="-0.565204">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a33"
                                 x3="0.510833"
                                 y3="-1.13826"
                                 z3="2.593373">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a34"
                                 x3="-0.552442"
                                 y3="0.172968"
                                 z3="3.141286">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.987962"
                                 y3="0.558397"
                                 z3="2.316184">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a36"
                                 x3="-2.762004"
                                 y3="3.567659"
                                 z3="-0.200835">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a37"
                                 x3="-4.232847"
                                 y3="2.72456"
                                 z3="0.344291">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a38"
                                 x3="-2.980599"
                                 y3="3.207973"
                                 z3="1.521516">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a39"
                                 x3="0.769893"
                                 y3="2.311996"
                                 z3="-1.713615">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a40"
                                 x3="-0.810158"
                                 y3="2.144135"
                                 z3="-2.523002">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a41"
                                 x3="0.501342"
                                 y3="0.985019"
                                 z3="-2.872348">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                        </atomArray>
                        <bondArray/>
                        <formula concise="C19H19O2S"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">292.26709999999986</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1S/C19H19O2S/c1-10-12-17(3)14-16(2,13(10)20)15(21)18(12,4)19(14,17)22-11-8-6-5-7-9-11/h5-9,12,14H,1-4H3">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:23,14,24,22,19,18,20,17,21,10,16,2,11,5,7,6,1,3,4,12,8,15/E:(6,7)(8,9)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,13.3,15.3,20.1,21.1/rA:41CCCCCCC3O1HC3C3O1HCSC3C3C3C3C3C3CCCHHHHHHHHHHHHHHHHH/rB:s1;s2;s1s3;s1s4;s5;s3s6;s7;s2;s2;s6s10;s11;s5;s6;s4;s15;s16;s17;s18;s19;s16s20;s3;s10;s1;s14;s14;s14;s17;s18;s19;s20;s21;s22;s22;s22;s23;s23;s23;s24;s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
                  <module cmlx:templateRef="l202.distmat">
                     <array dataType="xsd:double" dictRef="cc:distance" size="861">0.000000 1.546943 0.000000 2.200032 1.586612 0.000000 1.512159 2.174303 1.548173 0.000000 1.494059 2.381858 2.337689 1.528464 0.000000 2.593129 2.596233 2.409499 2.532835 1.536186 0.000000 2.993438 2.469055 1.523015 2.393282 2.356955 1.512529 0.000000 4.192693 3.540816 2.446723 3.438647 3.486165 2.450592 1.208913 0.000000 2.210147 1.103389 2.209190 2.834332 3.365595 3.694150 3.376508 4.326054 0.000000 2.542657 1.492894 2.628432 3.343331 2.902283 2.455530 2.708850 3.620500 2.183100 0.000000 2.949132 2.437226 3.029833 3.520423 2.578073 1.593257 2.413308 3.227809 3.399116 1.394989 0.000000 4.078621 3.648950 4.236518 4.687557 3.561444 2.449207 3.393448 3.954440 4.547575 2.402140 1.245207 0.000000 2.217775 3.404339 3.365088 2.252073 1.093640 2.278235 3.290365 4.313765 4.327956 3.848515 3.351216 4.110984 0.000000 3.926018 4.103186 3.757945 3.713786 2.578871 1.508226 2.539253 2.947150 5.201785 3.774876 2.561030 2.758863 2.768364 0.000000 3.004022 3.865349 2.992828 1.755208 2.856747 3.959875 3.728090 4.493623 4.310589 5.098354 5.187757 6.290431 3.003016 4.765434 0.000000 3.655615 4.349734 3.722508 2.794147 4.148120 5.311445 4.904924 5.673621 4.350188 5.795390 6.257430 7.451163 4.409161 6.346354 1.764784 0.000000 3.456838 3.891387 3.655251 3.055688 4.403227 5.513293 5.078650 5.929044 3.561593 5.375367 6.125976 7.351690 4.857867 6.768925 2.801024 1.400758 0.000000 4.715553 5.036554 4.910215 4.442515 5.767628 6.868513 6.379877 7.177363 4.485489 6.493727 7.373994 8.598235 6.198419 8.152922 4.080723 2.421601 1.392847 0.000000 5.838877 6.285046 5.961644 5.366753 6.723858 7.878238 7.358670 8.076158 5.818943 7.765275 8.549970 9.776372 7.025995 9.053616 4.576025 2.813456 2.424839 1.394471 0.000000 5.953916 6.574162 5.999158 5.217764 6.556580 7.736331 7.237644 7.889103 6.326783 8.058310 8.642308 9.849670 6.720926 8.741358 4.020654 2.427534 2.787046 2.404385 1.395816 0.000000 5.021194 5.749545 5.027043 4.104398 5.399091 6.566526 6.124253 6.775015 5.714830 7.193675 7.610721 8.788197 5.511983 7.470072 2.709947 1.404084 2.414598 2.778248 2.419534 1.391054 0.000000 3.478008 2.671370 1.500529 2.669077 3.789938 3.803478 2.551723 2.910975 2.732138 3.722336 4.320342 5.480020 4.757410 5.030300 3.529753 3.769926 3.583688 4.594871 5.558767 5.676078 4.895322 0.000000 3.689105 2.615274 3.937255 4.696854 4.296502 3.885216 4.118934 4.886648 2.757408 1.493061 2.519259 3.007675 5.161244 5.073062 6.432371 6.904362 6.249264 7.181382 8.533199 9.020295 8.304394 4.766519 0.000000 1.491312 2.714050 3.626103 2.744667 2.634033 3.880536 4.476095 5.679602 2.962726 3.517950 4.008135 4.966337 2.852054 5.057592 3.726844 3.988811 3.611599 4.636100 5.737185 5.976091 5.227283 4.739346 4.266861 0.000000 4.719136 4.588354 4.104441 4.400110 3.477724 2.135961 2.652595 2.606316 5.645392 4.112641 2.895142 2.898159 3.816053 1.099221 5.461081 7.014140 7.416007 8.783478 9.691248 9.386877 8.124264 5.177935 5.321154 5.960386 0.000000 4.208516 4.648610 4.059855 3.711592 2.729166 2.174353 2.973634 3.314356 5.726362 4.612266 3.527769 3.836827 2.620132 1.102698 4.361020 6.064988 6.703909 8.095682 8.854204 8.380329 7.046513 5.258968 5.992109 5.283603 1.785136 0.000000 4.281997 4.560485 4.547316 4.400106 3.027762 2.143792 3.447979 3.936792 5.653002 3.995184 2.662547 2.460520 3.010304 1.099357 5.507508 7.053571 7.407533 8.778154 9.722216 9.454535 8.201443 5.911205 5.108687 5.183258 1.772049 1.809751 0.000000 2.642300 2.896449 2.956595 2.562674 3.792271 4.806590 4.429978 5.366236 2.493822 4.361859 5.217262 6.439543 4.402476 6.170843 2.969380 2.156515 1.090001 2.159636 3.412282 3.877046 3.402860 3.082321 5.170285 2.897442 6.802554 6.267186 6.752396 0.000000 5.019664 5.143598 5.270297 5.001394 6.244902 7.270160 6.786238 7.602868 4.394918 6.517752 7.552730 8.755936 6.760274 8.644643 4.948447 3.406070 2.148138 1.093445 2.160360 3.399363 3.871648 4.912029 6.985727 4.831824 9.250958 8.710166 9.217253 2.475124 0.000000 6.811941 7.193380 6.943560 6.419971 7.768376 8.914561 8.371723 9.071858 6.626303 8.655591 9.514933 10.741561 8.078024 10.120128 5.668419 3.906067 3.415246 2.164487 1.092614 2.165506 3.411012 6.451842 9.317763 6.616978 10.748991 9.940863 10.778087 4.314858 2.496554 0.000000 6.991225 7.645264 7.004447 6.199538 7.511591 8.692914 8.184195 8.775724 7.415758 9.125945 9.666788 10.864550 7.602655 9.619896 4.859409 3.413614 3.880600 3.399648 2.162274 1.093593 2.150467 6.635042 10.109102 6.988263 10.257844 9.179781 10.346836 4.970597 4.309150 2.498576 0.000000 5.532749 6.347977 5.470942 4.464024 5.634978 6.762394 6.359517 6.919028 6.465929 7.728366 7.970301 9.095970 5.608016 7.470482 2.811531 2.160845 3.404683 3.871897 3.410572 2.158678 1.093660 5.411028 8.945153 5.819259 8.112289 6.899921 8.223205 4.304477 4.965286 4.314285 2.477400 0.000000 4.144353 3.596574 2.151039 2.994484 4.172129 4.173919 2.828615 2.890762 3.780281 4.614350 4.982620 6.093490 5.015907 5.172717 3.374977 3.734559 3.895743 4.890198 5.622186 5.507841 4.646824 1.101235 5.763743 5.427396 5.252252 5.209095 6.161205 3.672204 5.382433 6.535725 6.361817 4.986755 0.000000 4.154589 3.003619 2.134782 3.570818 4.448039 4.126710 2.781744 2.860258 2.986842 3.696753 4.349359 5.400130 5.485321 5.313354 4.597064 4.850361 4.540242 5.437063 6.447066 6.665225 5.958662 1.100966 4.534810 5.437021 5.269774 5.702839 6.167174 3.942011 5.598479 7.266971 7.614002 6.482877 1.774847 0.000000 3.610619 2.916128 2.171606 2.969416 4.273029 4.580688 3.510160 3.997645 2.590844 4.169721 4.992392 6.198352 5.188050 5.901337 3.622888 3.333984 2.837959 3.654205 4.668886 4.979659 4.417409 1.100185 5.037842 4.612806 6.159012 6.101494 6.718590 2.395931 3.884281 5.494900 5.965881 5.112453 1.784133 1.789467 0.000000 3.731620 2.962940 4.484232 4.977526 4.583360 4.498940 4.885765 5.783242 2.902894 2.196957 3.227077 3.701181 5.330667 5.714163 6.642290 6.952435 6.182119 7.008296 8.378150 8.957377 8.334428 5.342943 1.112341 3.904158 6.118380 6.567551 5.648411 5.099977 6.722594 9.106303 10.048070 9.038277 6.376891 5.251273 5.427088 0.000000 4.453753 3.500665 4.687494 5.437829 4.793803 4.133401 4.542646 5.185380 3.810977 2.112268 2.572035 2.566417 5.571830 5.062304 7.190498 7.828451 7.264064 8.245131 9.584437 10.015923 9.232225 5.588081 1.101668 5.031770 5.202191 6.079057 4.930147 6.196419 8.077126 10.391056 11.099136 9.809632 6.517841 5.280074 5.986441 1.780831 0.000000 4.322870 2.998683 4.153608 5.156342 5.028866 4.574944 4.462818 5.073002 2.827567 2.187780 3.327175 3.852965 5.984001 5.811202 6.847558 7.147584 6.376887 7.185680 8.549618 9.134949 8.520278 4.641949 1.109424 4.964154 5.929608 6.716123 5.977328 5.306857 6.889104 9.266980 10.221139 9.221969 5.677034 4.210802 4.837481 1.773034 1.785405 0.000000 2.159054 3.004526 3.948805 3.227839 3.528028 4.722147 5.063397 6.231788 2.837542 3.987886 4.756690 5.773264 3.853550 6.007683 4.045895 3.815613 3.099407 3.882473 5.053021 5.514139 4.999927 4.775860 4.525751 1.102493 6.847332 6.240420 6.204988 2.385383 3.915799 5.835976 6.543386 5.757780 5.524629 5.467547 4.400221 4.042213 5.425181 5.033392 0.000000 2.129793 3.054929 4.246710 3.575168 3.069925 4.062702 4.885490 6.086374 3.339126 3.397831 3.832333 4.589525 3.235605 5.153291 4.727184 5.088447 4.654567 5.609193 6.752271 7.053366 6.327314 5.451361 3.878522 1.102193 6.050093 5.531112 5.062812 3.859635 5.676301 7.583414 8.062190 6.903328 6.220645 6.003006 5.400511 3.350908 4.502562 4.711761 1.783212 0.000000 2.152875 3.612615 4.221299 3.000557 2.836993 4.277402 4.973891 6.155077 3.951257 4.433408 4.688389 5.581868 2.648056 5.237541 3.512435 3.859049 3.781836 4.794223 5.691090 5.737078 4.927338 5.342033 5.289877 1.101644 6.233677 5.256161 5.335399 3.352377 5.160845 6.592071 6.665964 5.388923 5.863660 6.159033 5.228735 4.945345 5.982083 6.030877 1.782035 1.784832 0.000000</array>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.5886794 0.1782607 0.1656477</array>
                  </module>
               </module>
               <module cmlx:templateRef="l601.popanal" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="g:alphaocc" size="78">-10.24482 -10.23083 -10.23022 -10.23015 -10.22752 -10.22542 -10.22233 -10.22017 -10.21868 -10.21651 -10.20962 -10.20869 -10.20203 -10.20047 -10.18969 -10.18589 -10.14238 -7.99719 -5.93970 -5.93542 -5.93011 -1.02495 -0.94526 -0.92968 -0.87331 -0.80110 -0.77159 -0.76491 -0.75327 -0.74512 -0.71745 -0.70191 -0.66777 -0.65395 -0.62854 -0.61283 -0.59748 -0.55974 -0.54339 -0.52489 -0.50765 -0.49296 -0.47738 -0.46500 -0.45762 -0.44945 -0.44084 -0.42498 -0.42167 -0.41783 -0.41676 -0.39393 -0.39205 -0.38654 -0.38418 -0.37805 -0.37639 -0.37533 -0.37188 -0.36078 -0.35908 -0.34659 -0.34441 -0.34182 -0.33586 -0.32349 -0.31500 -0.31091 -0.30151 -0.29721 -0.29574 -0.26579 -0.26090 -0.24459 -0.22047 -0.20332 -0.17360 -0.12469</array>
                  <array dataType="xsd:double" dictRef="g:alphavirt" size="324">0.00251 0.00404 0.02922 0.07096 0.08782 0.10039 0.11330 0.11554 0.11821 0.12597 0.12694 0.13594 0.14332 0.15036 0.15488 0.16093 0.16509 0.16806 0.17142 0.17404 0.17853 0.18437 0.19038 0.19137 0.19445 0.19594 0.20929 0.21725 0.22988 0.25703 0.26088 0.26705 0.27771 0.28240 0.29393 0.30085 0.30734 0.31701 0.32734 0.33327 0.33852 0.34360 0.35333 0.36129 0.36744 0.38215 0.40281 0.40806 0.41722 0.42683 0.43976 0.44240 0.45396 0.46930 0.47453 0.48789 0.49423 0.49912 0.50302 0.50383 0.50647 0.51218 0.52056 0.52687 0.53693 0.54741 0.54985 0.56108 0.57053 0.57454 0.59210 0.59599 0.60262 0.61024 0.61692 0.62604 0.63121 0.63898 0.64549 0.65460 0.66738 0.67129 0.67462 0.67993 0.68127 0.68223 0.68863 0.69222 0.69766 0.70096 0.70315 0.70885 0.71703 0.71801 0.72057 0.72364 0.72550 0.72877 0.73155 0.73372 0.74121 0.74556 0.74657 0.75082 0.75181 0.75890 0.76663 0.77020 0.77154 0.77588 0.78537 0.78751 0.79551 0.80015 0.81037 0.81482 0.81693 0.82908 0.83852 0.85373 0.86671 0.87000 0.88033 0.88473 0.89786 0.90304 0.92009 0.94401 0.95133 0.95455 0.96053 0.97790 0.99339 1.01472 1.02920 1.05596 1.06272 1.06849 1.08312 1.09929 1.10683 1.12348 1.14735 1.16038 1.18041 1.19978 1.20239 1.21287 1.21635 1.22374 1.24082 1.26260 1.26598 1.27686 1.28815 1.29842 1.30158 1.32603 1.32843 1.33672 1.35363 1.36934 1.38480 1.39533 1.42364 1.44034 1.47125 1.49947 1.51222 1.52631 1.54241 1.55181 1.56766 1.57276 1.57629 1.58881 1.59706 1.59993 1.60645 1.63664 1.65629 1.65859 1.67133 1.68937 1.70215 1.70917 1.71607 1.72864 1.73807 1.75023 1.76109 1.77151 1.77442 1.77823 1.77892 1.78668 1.78952 1.79537 1.80966 1.81241 1.82452 1.83029 1.83362 1.83952 1.84478 1.84831 1.85642 1.86161 1.86430 1.87640 1.88612 1.89371 1.90653 1.90869 1.91544 1.91960 1.92412 1.94969 1.96227 1.97054 1.97300 1.98790 1.99117 1.99368 2.00407 2.01070 2.02509 2.02678 2.03443 2.04572 2.06012 2.06620 2.08743 2.10169 2.11686 2.12523 2.13336 2.15549 2.16131 2.17012 2.17442 2.18274 2.19632 2.21959 2.22318 2.23217 2.25043 2.27278 2.29300 2.29886 2.30182 2.30623 2.31633 2.32944 2.33634 2.34317 2.35683 2.37331 2.37612 2.39788 2.41240 2.42559 2.43141 2.44580 2.45581 2.46689 2.47777 2.48471 2.49418 2.53525 2.54118 2.55363 2.55651 2.57556 2.60611 2.63115 2.64097 2.64353 2.65157 2.66459 2.67014 2.67545 2.70102 2.72855 2.75611 2.75741 2.76055 2.77307 2.78353 2.80800 2.82850 2.83425 2.85289 2.86489 2.88503 2.89163 2.90357 2.91838 2.92640 2.95237 2.97061 2.98887 2.99602 3.00413 3.00609 3.01325 3.02483 3.03037 3.04014 3.04144 3.05869 3.07224 3.08650 3.13402 3.15369 3.20799 3.24132 3.26240 3.26711 3.47246 3.50227 3.63866 3.70656 3.74435</array>
                  <list cmlx:templateRef="multipole" dictRef="cc:multipole">
                     <array dataType="xsd:double" dictRef="cc:dipole" size="3">15.3676 1.3172 -1.8244</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">15.5315</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-201.5697 -147.3511 -148.3380</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">5.1298 3.6851 6.5280</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">-35.8168 18.4019 17.4149 5.1298 3.6851 6.5280</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">321.7053 -2.0437 -13.9199 40.5361 -24.0761 14.8184 1.1126 8.3038 -9.3269 -4.3607</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-7663.9772 -1741.4930 -1078.5330 98.0220 -65.0433 51.1812 8.5797 22.4859 11.3010 -1450.9430 -1442.2866 -486.4772 60.5796 38.7530 -19.1325</array>
                  </list>
               </module>
               <module cmlx:templateRef="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.orient">
                     <molecule cmlx:templateRef="atom"
                               formalCharge="-1"
                               id="mol.l202.orient"
                               spinMultiplicity="1">
                        <atomArray>
                           <atom elementType="C"
                                 id="a1"
                                 x3="-0.509431"
                                 y3="0.744007"
                                 z3="-0.988335">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a2"
                                 x3="-1.098555"
                                 y3="1.198452"
                                 z3="0.366258">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a3"
                                 x3="-0.599931"
                                 y3="-0.157513"
                                 z3="1.017053">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a4"
                                 x3="0.079657"
                                 y3="-0.485248"
                                 z3="-0.335721">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a5"
                                 x3="-1.165033"
                                 y3="-0.581446"
                                 z3="-1.214519">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a6"
                                 x3="-2.413146"
                                 y3="-0.912017"
                                 z3="-0.378259">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a7"
                                 x3="-1.806857"
                                 y3="-1.079858"
                                 z3="0.999292">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="O"
                                 id="a8"
                                 x3="-2.175375"
                                 y3="-1.820644"
                                 z3="1.883357">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a9"
                                 x3="-0.53076"
                                 y3="2.036498"
                                 z3="0.80178">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a10"
                                 x3="-2.579459"
                                 y3="1.426378"
                                 z3="0.332367">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a11"
                                 x3="-3.326982"
                                 y3="0.365769"
                                 z3="-0.178801">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="O"
                                 id="a12"
                                 x3="-4.54522"
                                 y3="0.291569"
                                 z3="-0.458602">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a13"
                                 x3="-1.053853"
                                 y3="-1.035085"
                                 z3="-2.203285">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a14"
                                 x3="-3.204505"
                                 y3="-2.104078"
                                 z3="-0.854658">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="S"
                                 id="a15"
                                 x3="1.485054"
                                 y3="-1.485203"
                                 z3="-0.664362">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a16"
                                 x3="2.881183"
                                 y3="-0.484663"
                                 z3="-0.231839">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a17"
                                 x3="2.800476"
                                 y3="0.875374"
                                 z3="0.088583">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a18"
                                 x3="3.958056"
                                 y3="1.590856"
                                 z3="0.392242">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a19"
                                 x3="5.205876"
                                 y3="0.968202"
                                 z3="0.376927">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a20"
                                 x3="5.28669"
                                 y3="-0.38782"
                                 z3="0.055128">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a21"
                                 x3="4.136117"
                                 y3="-1.112365"
                                 z3="-0.244634">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a22"
                                 x3="0.169768"
                                 y3="-0.118532"
                                 z3="2.304562">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a23"
                                 x3="-3.17051"
                                 y3="2.786366"
                                 z3="0.527897">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a24"
                                 x3="-0.006522"
                                 y3="1.625263"
                                 z3="-2.081788">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a25"
                                 x3="-3.921847"
                                 y3="-2.408764"
                                 z3="-0.079742">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a26"
                                 x3="-2.549826"
                                 y3="-2.963199"
                                 z3="-1.074978">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a27"
                                 x3="-3.781115"
                                 y3="-1.846965"
                                 z3="-1.754943">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a28"
                                 x3="1.831586"
                                 y3="1.374976"
                                 z3="0.101122">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a29"
                                 x3="3.877778"
                                 y3="2.652124"
                                 z3="0.642943">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a30"
                                 x3="6.109351"
                                 y3="1.534393"
                                 z3="0.615889">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a31"
                                 x3="6.256667"
                                 y3="-0.8922"
                                 z3="0.041009">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a32"
                                 x3="4.209334"
                                 y3="-2.176253"
                                 z3="-0.488415">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a33"
                                 x3="0.560887"
                                 y3="-1.116186"
                                 z3="2.559834">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a34"
                                 x3="-0.491493"
                                 y3="0.197125"
                                 z3="3.12731">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a35"
                                 x3="1.018638"
                                 y3="0.578989"
                                 z3="2.258242">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a36"
                                 x3="-2.824914"
                                 y3="3.541659"
                                 z3="-0.210862">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a37"
                                 x3="-4.265637"
                                 y3="2.71706"
                                 z3="0.424391">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a38"
                                 x3="-2.958124"
                                 y3="3.224071"
                                 z3="1.523807">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a39"
                                 x3="0.716966"
                                 y3="2.367184"
                                 z3="-1.706921">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a40"
                                 x3="-0.843258"
                                 y3="2.175709"
                                 z3="-2.543155">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a41"
                                 x3="0.486376"
                                 y3="1.039755"
                                 z3="-2.874036">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                        </atomArray>
                        <bondArray/>
                        <formula concise="C19H19O2S"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">292.26709999999986</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1S/C19H19O2S/c1-10-12-17(3)14-16(2,13(10)20)15(21)18(12,4)19(14,17)22-11-8-6-5-7-9-11/h5-9,12,14H,1-4H3">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:23,14,24,22,19,18,20,17,21,10,16,2,11,5,7,6,1,3,4,12,8,15/E:(6,7)(8,9)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,13.3,15.3,20.1,21.1/rA:41CCCCCCC3O1HC3C3O1HCSC3C3C3C3C3C3CCCHHHHHHHHHHHHHHHHH/rB:s1;s2;s1s3;s1s4;s5;s3s6;s7;s2;s2;s6s10;s11;s5;s6;s4;s15;s16;s17;s18;s19;s16s20;s3;s10;s1;s14;s14;s14;s17;s18;s19;s20;s21;s22;s22;s22;s23;s23;s23;s24;s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
                  <module cmlx:templateRef="l202.distmat">
                     <array dataType="xsd:double" dictRef="cc:distance" size="861">0.000000 1.545480 0.000000 2.200570 1.584550 0.000000 1.511290 2.171590 1.548950 0.000000 1.495928 2.381452 2.340720 1.526694 0.000000 2.595909 2.595484 2.409133 2.529429 1.538309 0.000000 2.993403 2.468425 1.519114 2.386369 2.358244 1.514399 0.000000 4.195166 3.546275 2.449186 3.434059 3.486149 2.448886 1.210842 0.000000 2.208053 1.101994 2.205631 2.832969 3.364728 3.691830 3.373294 4.330370 0.000000 2.548508 1.498724 2.626029 3.342387 2.902553 2.449641 2.706089 3.621050 2.188553 0.000000 2.955842 2.440561 3.023359 3.514832 2.577587 1.583546 2.405935 3.218555 3.401725 1.394623 0.000000 4.095474 3.658187 4.236099 4.691272 3.572007 2.449656 3.391887 3.944918 4.555132 2.403672 1.252157 0.000000 2.222087 3.404885 3.368495 2.252768 1.093530 2.278935 3.290216 4.309937 4.328818 3.849131 3.350828 4.122327 0.000000 3.923376 4.102726 3.751829 3.698057 2.570477 1.508049 2.537632 2.938736 5.199718 3.776748 2.563577 2.773716 2.754423 0.000000 3.008705 3.865128 2.989495 1.755863 2.853491 3.950489 3.710624 4.472374 4.314563 5.098140 5.178567 6.289949 3.002822 4.734045 0.000000 3.684858 4.362214 3.712804 2.803451 4.164960 5.313567 4.883407 5.641602 4.366460 5.812831 6.266367 7.470302 4.435546 6.328191 1.771252 0.000000 3.483173 3.922234 3.673102 3.071511 4.421047 5.531235 5.087224 5.937071 3.599165 5.413569 6.154424 7.389146 4.874255 6.769537 2.805278 1.399601 0.000000 4.752009 5.071880 4.921629 4.458937 5.791944 6.888415 6.382433 7.175007 4.529435 6.539858 7.409366 8.643945 6.225075 8.155340 4.085865 2.420105 1.394316 0.000000 5.880386 6.308643 5.948478 5.375732 6.747043 7.883846 7.332143 8.033047 5.850704 7.798932 8.572131 9.810189 7.060797 9.038263 4.576897 2.808132 2.424399 1.394628 0.000000 5.997072 6.586685 5.969141 5.222590 6.578315 7.729818 7.189491 7.815230 6.346458 8.077405 8.649738 9.868736 6.761795 8.710548 4.021735 2.424499 2.788914 2.407088 1.396023 0.000000 5.057700 5.754551 4.993370 4.105659 5.415233 6.553689 6.071849 6.698129 5.726260 7.202576 7.608355 8.796728 5.547799 7.432386 2.709855 1.403222 2.417866 2.782933 2.420636 1.392351 0.000000 3.471088 2.664603 1.500545 2.667151 3.792086 3.807702 2.556350 2.928189 2.719052 3.719482 4.316121 5.480362 4.760043 5.030783 3.523106 3.730838 3.580368 4.574943 5.500832 5.596013 4.818509 0.000000 3.681240 2.615454 3.938727 4.691789 4.289535 3.882365 4.126676 4.904295 2.757825 1.495708 2.526498 3.014469 5.151999 5.082229 6.429779 6.920969 6.284709 7.229392 8.572768 9.045618 8.317674 4.769951 0.000000 1.491700 2.714338 3.623980 2.740517 2.638914 3.889941 4.477939 5.683359 2.959544 3.533794 4.029037 5.001325 2.861663 5.063687 3.729463 4.026529 3.626580 4.673317 5.800526 6.052852 5.294450 4.723554 4.262562 0.000000 4.733930 4.602380 4.160074 4.447187 3.496689 2.146052 2.720935 2.692546 5.660115 4.084134 2.839315 2.797128 3.823849 1.099049 5.516278 7.071528 7.483550 8.849441 9.743088 9.428656 8.163248 5.260359 5.284232 5.967523 0.000000 4.232505 4.637099 4.006315 3.687943 2.758600 2.170586 2.898546 3.193335 5.709275 4.609759 3.533997 3.867173 2.688613 1.102377 4.316635 6.029087 6.686871 8.077418 8.815603 8.325906 6.986909 5.187447 6.000996 5.341914 1.783349 0.000000 4.243199 4.579322 4.545123 4.332900 2.955923 2.154234 3.474472 3.976974 5.673000 4.063941 2.754388 2.614897 2.880645 1.099591 5.390062 6.968639 7.357109 8.736348 9.655881 9.361119 8.093407 5.922545 5.201150 5.139138 1.772491 1.795662 0.000000 2.658081 2.947403 3.016575 2.592396 3.812902 4.845399 4.480088 5.426240 2.551315 4.417401 5.263808 6.492358 4.409585 6.195122 2.981052 2.161197 1.090187 2.157135 3.409892 3.879086 3.408412 3.138050 5.214895 2.864678 6.888497 6.276922 6.732629 0.000000 5.054659 5.191686 5.299424 5.022609 6.271848 7.302169 6.809534 7.627905 4.454147 6.579879 7.603371 8.816604 6.783621 8.661581 4.954962 3.405565 2.150520 1.093428 2.161065 3.401738 3.876326 4.918012 7.050505 4.854523 9.325717 8.706159 9.200560 2.472161 0.000000 6.856130 7.220047 6.930940 6.429752 7.793832 8.922231 8.345517 9.027703 6.661661 8.694105 9.541572 10.780492 8.115506 10.106873 5.669314 3.900807 3.414822 2.163625 1.092676 2.164746 3.411667 6.392372 9.364347 6.685030 10.800801 9.902964 10.718010 4.311574 2.495992 0.000000 7.036818 7.653489 6.964579 6.201853 7.533561 8.679968 8.122435 8.680759 7.431366 9.139902 9.668357 10.878037 7.648593 9.580430 4.859783 3.410927 3.882246 3.401844 2.162890 1.093368 2.150999 6.540074 10.131168 7.076117 10.291584 9.115305 10.241781 4.972428 4.310878 2.498107 0.000000 5.571767 6.347660 5.428700 4.465092 5.652828 6.742972 6.293641 6.820284 6.471504 7.729188 7.959510 9.095782 5.651918 7.423231 2.816063 2.165940 3.410314 3.876830 3.410206 2.157459 1.093915 5.324757 8.951122 5.896084 8.144764 6.830051 8.096901 4.314217 4.970224 4.312591 2.473996 0.000000 4.146734 3.594868 2.155627 3.002317 4.184554 4.185564 2.835987 2.905342 3.771188 4.613893 4.981148 6.096315 5.030037 5.178114 3.374270 3.684567 3.884476 4.854616 5.539466 5.397896 4.543933 1.101568 5.769056 5.420531 5.360319 5.128338 6.164764 3.723686 5.373676 6.449026 6.231899 4.871010 0.000000 4.151860 2.999098 2.142595 3.575532 4.462209 4.148730 2.808795 2.907623 2.965287 3.698969 4.358763 5.412984 5.499986 5.339666 4.594969 4.808707 4.531109 5.405698 6.373318 6.570225 5.873631 1.101735 4.542934 5.423051 5.370584 5.646557 6.231879 3.992724 5.593713 7.187952 7.499969 6.387814 1.776040 0.000000 3.592004 2.906173 2.168583 2.956845 4.263227 4.577268 3.510008 4.012542 2.578031 4.168136 4.986889 6.198417 5.177421 5.892702 3.608331 3.286478 2.823157 3.625743 4.606929 4.899459 4.340938 1.099664 5.041386 4.580557 6.229063 6.032528 6.710331 2.438780 3.883524 5.433735 5.875157 5.031504 1.781604 1.783702 0.000000 3.713863 2.967154 4.488006 4.966699 4.556592 4.475803 4.884602 5.793268 2.924739 2.197672 3.215490 3.685636 5.296508 5.694989 6.637080 6.983642 6.232476 7.083647 8.453506 9.017188 8.373591 5.356536 1.111607 3.887965 6.052106 6.567766 5.686456 5.145371 6.815155 9.194222 10.109286 9.069300 6.390300 5.270120 5.444886 0.000000 4.471891 3.512828 4.695936 5.451066 4.814552 4.152851 4.559901 5.204665 3.815088 2.125448 2.602591 2.596315 5.594536 5.099542 7.205196 7.858670 7.309892 8.300512 9.631735 10.051049 9.257514 5.590031 1.102189 5.060930 5.162016 6.120249 5.080805 6.251545 8.146606 10.443933 11.130706 9.828676 6.522977 5.282046 5.988148 1.777412 0.000000 4.296239 2.983463 4.153671 5.142471 5.019519 4.584985 4.486016 5.117726 2.797097 2.189662 3.347360 3.879225 5.971422 5.840117 6.834265 7.136842 6.382611 7.195929 8.547232 9.120293 8.500607 4.643952 1.108391 4.926302 5.935399 6.723296 6.094500 5.327712 6.916112 9.268141 10.200723 9.197011 5.682836 4.221125 4.832235 1.768526 1.781956 0.000000 2.157572 2.993346 3.940601 3.228423 3.532534 4.723992 5.057210 6.228453 2.821303 3.988762 4.763856 5.792847 3.867507 6.008033 4.064206 3.872044 3.128952 3.938760 5.142945 5.619363 5.092753 4.750810 4.503620 1.102001 6.853902 6.283650 6.163934 2.344327 3.948896 5.930160 6.660865 5.858687 5.510302 5.435008 4.360179 4.020261 5.430583 4.967711 0.000000 2.139784 3.079755 4.263591 3.578439 3.077453 4.084774 4.906748 6.110595 3.362384 3.441586 3.877491 4.647566 3.235593 5.171371 4.727914 5.127496 4.679071 5.657846 6.824732 7.134355 6.394435 5.458033 3.901329 1.102713 6.046776 5.610374 5.043232 3.845538 5.715450 7.663525 8.154686 6.977838 6.232872 6.016038 5.391622 3.351473 4.562025 4.702330 1.780519 0.000000 2.152897 3.610636 4.213559 2.988996 2.847708 4.294828 4.975374 6.156264 3.942040 4.453070 4.718077 5.631258 2.669677 5.252064 3.500776 3.878164 3.762869 4.798421 5.731279 5.801809 4.986581 5.315989 5.291183 1.101556 6.255621 5.336551 5.272286 3.282305 5.144947 6.636421 6.747310 5.467569 5.846416 6.138600 5.180337 4.931192 6.022840 5.998070 1.782525 1.779831 0.000000</array>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.5889345 0.1780739 0.1653579</array>
                  </module>
               </module>
               <module cmlx:templateRef="l716.forces">
                  <list cmlx:templateRef="force">
                     <array dataType="xsd:integer" dictRef="x:serial" size="41">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</array>
                     <array dataType="xsd:integer" dictRef="x:elementType" size="41">6 6 6 6 6 6 6 8 1 6 6 8 1 6 16 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                     <list>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000193230 0.000401903 0.001040196</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.003920353 -0.000025422 0.000017966</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001062055 -0.000290076 0.000264354</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001746408 0.000354110 -0.000710011</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000663412 -0.000792534 -0.000800048</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001561488 0.001233226 -0.000340091</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.004109032 0.002832947 -0.002023121</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.002064036 -0.001836633 0.001274096</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000212040 -0.000736983 -0.000251475</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.003231149 -0.001749058 0.000040198</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.009449626 -0.001873024 0.002115742</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.008060113 0.000475492 -0.001167560</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000259852 -0.000062272 0.000028046</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.001125008 0.000960983 0.000813367</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001447036 -0.001484055 -0.000442750</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.003506971 0.002941995 0.001265258</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001671078 -0.001788302 -0.000728509</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000539408 0.001418582 0.000436581</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000477072 -0.000260439 -0.000065390</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.001057981 0.000198916 0.000158429</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.002171771 -0.001684184 -0.000514450</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000394106 0.000068658 -0.001048973</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000255752 0.001000199 -0.000223503</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000699987 -0.000108244 0.001047269</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000582246 -0.000966655 -0.000035502</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000824725 0.000191338 -0.000149899</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000279429 -0.001085992 -0.000604761</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000389491 0.000880040 0.000234497</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000020017 0.000062101 -0.000006723</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000038124 0.000013528 -0.000025486</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000193458 -0.000071938 -0.000056984</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000855209 -0.000266743 -0.000075735</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000404124 -0.000020427 0.000341130</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000566135 0.000504246 0.000862663</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000468609 -0.000172293 0.000316137</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000318179 -0.000220602 0.000614133</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000486414 0.001075841 0.000246098</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000231188 0.000281242 -0.000619091</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000446841 -0.000047120 -0.000075585</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000349846 0.000385158 -0.000941521</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000437020 0.000262491 -0.000208990</array>
                     </list>
                  </list>
                  <list cmlx:templateRef="cartesianforce">
                     <scalar dataType="xsd:double" dictRef="cc:maxforce">0.009449626</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:rmsforce">0.001581131</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l401"/>
               <module cmlx:templateRef="l50X">
                  <scalar dataType="xsd:integer" dictRef="cc:ncycle">6</scalar>
                  <scalar dataType="xsd:double" dictRef="g:rbhflyp" units="nonsi:hartree">-1282.30994719</scalar>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:jobtime">
                  <scalar dataType="xsd:string">PT10488.200S</scalar>
               </property>
               <property dictRef="cc:jobdatetime.end">
                  <scalar dataType="xsd:date">2023-01-29T20:42:34.000</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="41">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</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="41">C C C C C C C O H C C O H C S C C C C C C C C C H H H H H H H H H H H H H H H H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="41">-0.152548 0.067792 -0.331586 -0.155563 -0.042487 -0.330916 0.216625 -0.244796 -0.003514 -0.281768 0.130166 -0.405716 0.038455 0.069785 0.046541 -0.069848 -0.049835 -0.032593 -0.049366 -0.038739 -0.039653 0.055687 0.008353 0.080834 0.020438 0.018033 0.023244 0.052665 0.038430 0.038598 0.042529 0.032608 0.036258 0.040677 0.030530 0.007728 0.009169 0.009495 0.031852 0.046291 0.036145</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">-1.00000</scalar>
                  </module>
               </property>
               <property dictRef="cc:popanal">
                  <module cmlx:templateRef="l601.popanal">
                     <array dataType="xsd:double" dictRef="g:alphaocc" size="78">-10.24508 -10.23113 -10.23063 -10.23057 -10.22815 -10.22575 -10.22282 -10.22058 -10.21779 -10.21675 -10.20972 -10.20909 -10.20225 -10.20090 -10.19106 -10.18611 -10.14295 -7.99685 -5.93937 -5.93509 -5.92974 -1.02353 -0.94201 -0.92783 -0.87325 -0.80022 -0.77194 -0.76534 -0.75358 -0.74454 -0.71722 -0.70207 -0.66781 -0.65454 -0.62911 -0.61297 -0.59766 -0.55986 -0.54418 -0.52529 -0.50770 -0.49272 -0.47781 -0.46511 -0.45799 -0.44904 -0.44085 -0.42554 -0.42120 -0.41755 -0.41637 -0.39473 -0.39216 -0.38637 -0.38335 -0.37777 -0.37616 -0.37484 -0.37131 -0.36070 -0.35866 -0.34682 -0.34524 -0.34175 -0.33629 -0.32307 -0.31421 -0.31111 -0.30165 -0.29620 -0.29370 -0.26568 -0.26106 -0.24437 -0.22052 -0.20324 -0.17208 -0.12440</array>
                     <array dataType="xsd:double" dictRef="g:alphavirt" size="324">0.00179 0.00373 0.02890 0.07053 0.08767 0.10020 0.11299 0.11535 0.11797 0.12503 0.12715 0.13568 0.14249 0.14871 0.15393 0.16098 0.16509 0.16872 0.17127 0.17294 0.17769 0.18444 0.18859 0.18949 0.19367 0.19552 0.21036 0.21866 0.22957 0.25750 0.26059 0.26523 0.27789 0.28224 0.29276 0.30030 0.30756 0.31720 0.32573 0.33176 0.33757 0.34335 0.35115 0.35996 0.36651 0.38220 0.40261 0.40948 0.41795 0.42751 0.43919 0.44233 0.45336 0.46757 0.47437 0.48698 0.49342 0.49790 0.50252 0.50326 0.50470 0.51262 0.52105 0.52503 0.53733 0.54814 0.55094 0.56245 0.57055 0.57560 0.59170 0.59658 0.60293 0.61123 0.61621 0.62629 0.63151 0.63808 0.64575 0.65544 0.66840 0.67368 0.67528 0.67906 0.68089 0.68271 0.68869 0.69155 0.69547 0.70116 0.70509 0.70703 0.71513 0.71681 0.72039 0.72374 0.72577 0.72862 0.73196 0.73244 0.74029 0.74508 0.74567 0.74752 0.75203 0.75842 0.76463 0.77044 0.77491 0.77853 0.78648 0.78806 0.79561 0.80001 0.81089 0.81382 0.81592 0.82732 0.83915 0.85406 0.86442 0.86549 0.88246 0.88541 0.89495 0.90100 0.91928 0.94179 0.95216 0.95345 0.96176 0.97746 0.99390 1.01455 1.02835 1.05723 1.06177 1.06640 1.08007 1.10034 1.10511 1.12749 1.14546 1.16081 1.17997 1.19802 1.20340 1.21106 1.21572 1.22287 1.23685 1.26295 1.26583 1.27590 1.29078 1.29677 1.30053 1.32443 1.32810 1.34473 1.35407 1.36465 1.38284 1.39423 1.42402 1.44001 1.47050 1.49932 1.51256 1.52641 1.54366 1.55344 1.56334 1.57491 1.57719 1.58790 1.59331 1.59839 1.60885 1.63499 1.65683 1.66079 1.67128 1.68986 1.70085 1.70842 1.71579 1.72843 1.73897 1.75017 1.75924 1.76851 1.77527 1.77805 1.77983 1.78541 1.78819 1.79458 1.80696 1.81450 1.82416 1.83271 1.83665 1.84015 1.84620 1.84801 1.85642 1.86239 1.86449 1.87503 1.88764 1.89570 1.90859 1.91105 1.91914 1.92233 1.92340 1.95015 1.96261 1.96908 1.97140 1.98506 1.99000 1.99191 2.00606 2.01055 2.02037 2.02657 2.03370 2.04210 2.06048 2.06596 2.08665 2.10188 2.11511 2.12207 2.13360 2.15980 2.16075 2.17219 2.17371 2.18343 2.19569 2.21761 2.22164 2.23403 2.25077 2.27558 2.29218 2.30019 2.30293 2.30746 2.31631 2.32889 2.33453 2.34498 2.35662 2.37238 2.37945 2.39772 2.41092 2.42502 2.43120 2.44368 2.45751 2.46668 2.47473 2.48553 2.48780 2.53281 2.53857 2.55146 2.55407 2.57288 2.60353 2.63029 2.63986 2.64247 2.65095 2.66409 2.67196 2.67404 2.69871 2.72642 2.75639 2.75719 2.76076 2.77334 2.78231 2.81075 2.82556 2.83182 2.85325 2.86153 2.88589 2.89694 2.90497 2.91436 2.92848 2.94886 2.96975 2.98723 2.99834 3.00313 3.00672 3.01371 3.02437 3.02909 3.04194 3.04417 3.06063 3.07212 3.08637 3.13427 3.15400 3.20641 3.23677 3.25615 3.26536 3.46994 3.49745 3.63728 3.70493 3.73896</array>
                  </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="41">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</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="41">C C C C C C C O H C C O H C S C C C C C C C C C H H H H H H H H H H H H H H H H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="41">-0.150234 0.067541 -0.326732 -0.153915 -0.046665 -0.319529 0.213798 -0.247395 -0.004578 -0.278450 0.129044 -0.415992 0.038867 0.071211 0.044529 -0.069099 -0.049774 -0.033692 -0.048768 -0.039893 -0.038031 0.054477 0.006271 0.078973 0.022990 0.016129 0.022454 0.052437 0.039034 0.038818 0.042739 0.033747 0.036655 0.041092 0.030634 0.008026 0.009663 0.008745 0.032570 0.046229 0.036076</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">-1.00000</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">15.5885 1.4368 -1.9703</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">15.7781</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-202.3082 -146.9126 -148.1179</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">4.8844 4.8581 6.2510</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">-36.5286 18.8669 17.6616 4.8844 4.8581 6.2510</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">330.0574 -1.1555 -13.2976 40.9200 -24.9352 15.1953 -0.0968 8.5855 -9.7071 -4.9141</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-7714.5736 -1741.3820 -1071.4443 97.5456 -39.2302 54.7468 7.8854 19.3492 10.1007 -1444.8949 -1438.6532 -487.2271 55.1817 38.8286 -15.3993</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">-1282.3099472</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsd" units="nonsi:unknown">7.532E-9</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsf" units="nonsi:unknown">5.881E-6</scalar>
                  <scalar dataType="xsd:string" dictRef="x:Quadrupole">-27.1580984,14.027105,13.1309934,3.6314491,3.6118484,4.6474296</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:pointgroup">C01 [X(C19H19O2S1)]</scalar>
                  <array dataType="xsd:double"
                         dictRef="cc:dipole"
                         size="3"
                         units="nonsi:debye">6.1291439 0.5646906 -0.7793147</array>
               </module>
            </module>
            <molecule formalCharge="-1" id="mol9999" spinMultiplicity="1">
               <atomArray>
                  <atom elementType="C"
                        id="a1"
                        x3="-0.50943106"
                        y3="0.74400747"
                        z3="-0.98833472">
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.0" size="3">-0.000007019 -0.000000040 0.000004618</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.1" size="3">0.000003135 -0.000001093 0.000002562</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.2" size="3">-0.000000104 -0.000005673 -0.000010964</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.3" size="3">0.000008485 -0.000002477 0.000002045</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.4" size="3">0.000003438 0.000007460 -0.000001266</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.5" size="3">-0.000006116 0.000020645 -0.000001626</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.6" size="3">0.000005244 -0.000011183 0.000015144</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.7" size="3">0.000001443 -0.000000822 -0.000016685</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.8" size="3">-0.000002591 -0.000003227 0.000003976</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.9" size="3">0.000003151 -0.000001327 0.000002617</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.10" size="3">-0.000005865 -0.000012078 -0.000016160</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.11" size="3">0.000003248 0.000004912 0.000003379</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.12" size="3">-0.000001724 0.000003158 -0.000003061</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.13" size="3">0.000002171 -0.000012228 -0.000010030</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.14" size="3">-0.000002074 0.000011827 0.000000094</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.15" size="3">-0.000007440 -0.000019722 -0.000004437</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.16" size="3">0.000004912 0.000012090 0.000005568</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.17" size="3">-0.000002458 -0.000003258 0.000001589</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.18" size="3">0.000000837 -0.000002468 0.000002643</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.19" size="3">-0.000002414 -0.000001639 -0.000001889</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.20" size="3">0.000009261 0.000006323 -0.000000020</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.21" size="3">0.000001840 0.000002229 0.000006118</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.22" size="3">0.000001419 0.000002126 0.000007378</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.23" size="3">0.000001208 0.000006074 -0.000004567</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.24" size="3">-0.000000950 0.000000220 -0.000005250</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.25" size="3">-0.000001373 0.000005778 -0.000003756</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.26" size="3">-0.000001535 0.000007862 -0.000002598</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.27" size="3">0.000000305 -0.000003503 0.000001099</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.28" size="3">0.000000343 -0.000002040 0.000005782</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.29" size="3">0.000000697 -0.000002992 0.000002505</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.30" size="3">0.000000443 0.000000223 -0.000000984</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.31" size="3">-0.000003697 -0.000001157 -0.000005407</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.32" size="3">-0.000002728 -0.000007643 -0.000001416</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.33" size="3">0.000000587 -0.000006021 -0.000000775</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.34" size="3">-0.000001137 -0.000007308 -0.000003011</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.35" size="3">-0.000004901 0.000002186 0.000005292</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.36" size="3">-0.000001294 0.000004463 0.000006431</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.37" size="3">0.000002347 -0.000004820 0.000001826</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.38" size="3">0.000002786 0.000001964 0.000002558</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.39" size="3">0.000000111 0.000006968 0.000008650</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.40" size="3">-0.000001994 0.000006209 0.000002029</array>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a2"
                        x3="-1.09855483"
                        y3="1.19845203"
                        z3="0.36625819"/>
                  <atom elementType="C"
                        id="a3"
                        x3="-0.5999311"
                        y3="-0.15751252"
                        z3="1.01705257"/>
                  <atom elementType="C"
                        id="a4"
                        x3="0.07965712"
                        y3="-0.48524753"
                        z3="-0.335721"/>
                  <atom elementType="C"
                        id="a5"
                        x3="-1.16503291"
                        y3="-0.58144599"
                        z3="-1.21451912"/>
                  <atom elementType="C"
                        id="a6"
                        x3="-2.41314611"
                        y3="-0.91201727"
                        z3="-0.3782588"/>
                  <atom elementType="C"
                        id="a7"
                        x3="-1.80685735"
                        y3="-1.07985822"
                        z3="0.99929222"/>
                  <atom elementType="O"
                        id="a8"
                        x3="-2.17537475"
                        y3="-1.82064391"
                        z3="1.88335683"/>
                  <atom elementType="H"
                        id="a9"
                        x3="-0.53075961"
                        y3="2.03649758"
                        z3="0.80178026"/>
                  <atom elementType="C"
                        id="a10"
                        x3="-2.57945851"
                        y3="1.42637752"
                        z3="0.33236693"/>
                  <atom elementType="C"
                        id="a11"
                        x3="-3.32698215"
                        y3="0.36576937"
                        z3="-0.17880083"/>
                  <atom elementType="O"
                        id="a12"
                        x3="-4.54522005"
                        y3="0.29156888"
                        z3="-0.45860184"/>
                  <atom elementType="H"
                        id="a13"
                        x3="-1.05385258"
                        y3="-1.0350854"
                        z3="-2.20328538"/>
                  <atom elementType="C"
                        id="a14"
                        x3="-3.20450498"
                        y3="-2.10407756"
                        z3="-0.85465765"/>
                  <atom elementType="S"
                        id="a15"
                        x3="1.48505411"
                        y3="-1.48520284"
                        z3="-0.66436202"/>
                  <atom elementType="C"
                        id="a16"
                        x3="2.88118292"
                        y3="-0.48466252"
                        z3="-0.2318392"/>
                  <atom elementType="C"
                        id="a17"
                        x3="2.80047572"
                        y3="0.87537409"
                        z3="0.08858268"/>
                  <atom elementType="C"
                        id="a18"
                        x3="3.95805622"
                        y3="1.59085602"
                        z3="0.39224185"/>
                  <atom elementType="C"
                        id="a19"
                        x3="5.2058758"
                        y3="0.96820174"
                        z3="0.3769266"/>
                  <atom elementType="C"
                        id="a20"
                        x3="5.28669006"
                        y3="-0.38782023"
                        z3="0.05512831"/>
                  <atom elementType="C"
                        id="a21"
                        x3="4.13611704"
                        y3="-1.11236458"
                        z3="-0.2446335"/>
                  <atom elementType="C"
                        id="a22"
                        x3="0.169768"
                        y3="-0.11853204"
                        z3="2.30456194"/>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.17051021"
                        y3="2.78636615"
                        z3="0.52789727"/>
                  <atom elementType="C"
                        id="a24"
                        x3="-0.00652247"
                        y3="1.62526305"
                        z3="-2.08178773"/>
                  <atom elementType="H"
                        id="a25"
                        x3="-3.92184693"
                        y3="-2.40876381"
                        z3="-0.07974161"/>
                  <atom elementType="H"
                        id="a26"
                        x3="-2.54982624"
                        y3="-2.96319896"
                        z3="-1.07497768"/>
                  <atom elementType="H"
                        id="a27"
                        x3="-3.78111472"
                        y3="-1.84696516"
                        z3="-1.75494317"/>
                  <atom elementType="H"
                        id="a28"
                        x3="1.8315859"
                        y3="1.3749761"
                        z3="0.10112153"/>
                  <atom elementType="H"
                        id="a29"
                        x3="3.87777761"
                        y3="2.65212403"
                        z3="0.64294348"/>
                  <atom elementType="H"
                        id="a30"
                        x3="6.10935061"
                        y3="1.53439257"
                        z3="0.61588908"/>
                  <atom elementType="H"
                        id="a31"
                        x3="6.25666692"
                        y3="-0.89219951"
                        z3="0.04100932"/>
                  <atom elementType="H"
                        id="a32"
                        x3="4.20933434"
                        y3="-2.17625325"
                        z3="-0.48841505"/>
                  <atom elementType="H"
                        id="a33"
                        x3="0.56088684"
                        y3="-1.11618629"
                        z3="2.55983425"/>
                  <atom elementType="H"
                        id="a34"
                        x3="-0.49149279"
                        y3="0.1971248"
                        z3="3.12731043"/>
                  <atom elementType="H"
                        id="a35"
                        x3="1.01863797"
                        y3="0.57898927"
                        z3="2.25824247"/>
                  <atom elementType="H"
                        id="a36"
                        x3="-2.82491421"
                        y3="3.54165917"
                        z3="-0.21086201"/>
                  <atom elementType="H"
                        id="a37"
                        x3="-4.26563711"
                        y3="2.71705984"
                        z3="0.42439098"/>
                  <atom elementType="H"
                        id="a38"
                        x3="-2.95812445"
                        y3="3.22407127"
                        z3="1.52380714"/>
                  <atom elementType="H"
                        id="a39"
                        x3="0.71696604"
                        y3="2.36718358"
                        z3="-1.70692055"/>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.84325802"
                        y3="2.17570879"
                        z3="-2.54315484"/>
                  <atom elementType="H"
                        id="a41"
                        x3="0.48637595"
                        y3="1.03975528"
                        z3="-2.87403565"/>
               </atomArray>
               <bondArray/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">292.26709999999986</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1S/C19H19O2S/c1-10-12-17(3)14-16(2,13(10)20)15(21)18(12,4)19(14,17)22-11-8-6-5-7-9-11/h5-9,12,14H,1-4H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:23,14,24,22,19,18,20,17,21,10,16,2,11,5,7,6,1,3,4,12,8,15/E:(6,7)(8,9)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,13.3,15.3,20.1,21.1/rA:41CCCCCCC3O1HC3C3O1HCSC3C3C3C3C3C3CCCHHHHHHHHHHHHHHHHH/rB:s1;s2;s1s3;s1s4;s5;s3s6;s7;s2;s2;s6s10;s11;s5;s6;s4;s15;s16;s17;s18;s19;s16s20;s3;s10;s1;s14;s14;s14;s17;s18;s19;s20;s21;s22;s22;s22;s23;s23;s23;s24;s24;s24;/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 16</scalar>
               </parameter>
               <parameter dictRef="cc:hostname">
                  <scalar dataType="xsd:string">GINC-EXP-1-17</scalar>
               </parameter>
               <parameter dictRef="cc:jobname">
                  <scalar dataType="xsd:string">WTGUO</scalar>
               </parameter>
               <parameter dictRef="cc:title">
                  <scalar dataType="xsd:string">Title Card Required</scalar>
               </parameter>
               <parameter dictRef="cc:version">
                  <scalar dataType="xsd:string">ES64L-G16RevC.01</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string">RPBE1PBE</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">def2SVP</scalar>
               </parameter>
               <parameter dictRef="g:operation">
                  <scalar dataType="xsd:string">Freq</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">#N</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">Geom=AllCheck</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">Guess=TCheck</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">SCRF=Check</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">GenChk</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">RPBE1PBE/def2SVPFreq</scalar>
               </parameter>
            </parameterList>
            <molecule cmlx:templateRef="atom"
                      formalCharge="-1"
                      id="mol.l202.orient"
                      spinMultiplicity="1">
               <atomArray>
                  <atom elementType="C"
                        id="a1"
                        x3="-0.509431"
                        y3="0.744007"
                        z3="-0.988335">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a2"
                        x3="-1.098555"
                        y3="1.198452"
                        z3="0.366258">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a3"
                        x3="-0.599931"
                        y3="-0.157513"
                        z3="1.017053">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a4"
                        x3="0.079657"
                        y3="-0.485248"
                        z3="-0.335721">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a5"
                        x3="-1.165033"
                        y3="-0.581446"
                        z3="-1.214519">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a6"
                        x3="-2.413146"
                        y3="-0.912017"
                        z3="-0.378259">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a7"
                        x3="-1.806857"
                        y3="-1.079858"
                        z3="0.999292">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a8"
                        x3="-2.175375"
                        y3="-1.820644"
                        z3="1.883357">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a9"
                        x3="-0.53076"
                        y3="2.036498"
                        z3="0.80178">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a10"
                        x3="-2.579459"
                        y3="1.426378"
                        z3="0.332367">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a11"
                        x3="-3.326982"
                        y3="0.365769"
                        z3="-0.178801">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a12"
                        x3="-4.54522"
                        y3="0.291569"
                        z3="-0.458602">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a13"
                        x3="-1.053853"
                        y3="-1.035085"
                        z3="-2.203285">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a14"
                        x3="-3.204505"
                        y3="-2.104078"
                        z3="-0.854658">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="S"
                        id="a15"
                        x3="1.485054"
                        y3="-1.485203"
                        z3="-0.664362">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a16"
                        x3="2.881183"
                        y3="-0.484663"
                        z3="-0.231839">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a17"
                        x3="2.800476"
                        y3="0.875374"
                        z3="0.088583">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a18"
                        x3="3.958056"
                        y3="1.590856"
                        z3="0.392242">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a19"
                        x3="5.205876"
                        y3="0.968202"
                        z3="0.376927">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a20"
                        x3="5.28669"
                        y3="-0.38782"
                        z3="0.055128">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a21"
                        x3="4.136117"
                        y3="-1.112365"
                        z3="-0.244634">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a22"
                        x3="0.169768"
                        y3="-0.118532"
                        z3="2.304562">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.17051"
                        y3="2.786366"
                        z3="0.527897">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a24"
                        x3="-0.006522"
                        y3="1.625263"
                        z3="-2.081788">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a25"
                        x3="-3.921847"
                        y3="-2.408764"
                        z3="-0.079742">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a26"
                        x3="-2.549826"
                        y3="-2.963199"
                        z3="-1.074978">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a27"
                        x3="-3.781115"
                        y3="-1.846965"
                        z3="-1.754943">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a28"
                        x3="1.831586"
                        y3="1.374976"
                        z3="0.101122">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a29"
                        x3="3.877778"
                        y3="2.652124"
                        z3="0.642943">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a30"
                        x3="6.109351"
                        y3="1.534393"
                        z3="0.615889">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a31"
                        x3="6.256667"
                        y3="-0.8922"
                        z3="0.041009">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a32"
                        x3="4.209334"
                        y3="-2.176253"
                        z3="-0.488415">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a33"
                        x3="0.560887"
                        y3="-1.116186"
                        z3="2.559834">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a34"
                        x3="-0.491493"
                        y3="0.197125"
                        z3="3.12731">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a35"
                        x3="1.018638"
                        y3="0.578989"
                        z3="2.258242">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a36"
                        x3="-2.824914"
                        y3="3.541659"
                        z3="-0.210862">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a37"
                        x3="-4.265637"
                        y3="2.71706"
                        z3="0.424391">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a38"
                        x3="-2.958124"
                        y3="3.224071"
                        z3="1.523807">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a39"
                        x3="0.716966"
                        y3="2.367184"
                        z3="-1.706921">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.843258"
                        y3="2.175709"
                        z3="-2.543155">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a41"
                        x3="0.486376"
                        y3="1.039755"
                        z3="-2.874036">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
               </atomArray>
               <bondArray/>
               <formula concise="C19H19O2S"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">292.26709999999986</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1S/C19H19O2S/c1-10-12-17(3)14-16(2,13(10)20)15(21)18(12,4)19(14,17)22-11-8-6-5-7-9-11/h5-9,12,14H,1-4H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:23,14,24,22,19,18,20,17,21,10,16,2,11,5,7,6,1,3,4,12,8,15/E:(6,7)(8,9)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,13.3,15.3,20.1,21.1/rA:41CCCCCCC3O1HC3C3O1HCSC3C3C3C3C3C3CCCHHHHHHHHHHHHHHHHH/rB:s1;s2;s1s3;s1s4;s5;s3s6;s7;s2;s2;s6s10;s11;s5;s6;s4;s15;s16;s17;s18;s19;s16s20;s3;s10;s1;s14;s14;s14;s17;s18;s19;s20;s21;s22;s22;s22;s23;s23;s23;s24;s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l101" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l101.title">
                     <scalar cmlx:templateRef="title" dataType="xsd:string" dictRef="cc:title">Title Card Required</scalar>
                  </module>
                  <module cmlx:templateRef="l101.redundantcoords">
                     <scalar cmlx:templateRef="redundant"
                             dataType="xsd:string"
                             dictRef="g:redundant">Redundant internal coordinates found in file.  (old form).</scalar>
                  </module>
                  <list cmlx:templateRef="rest">
                     <scalar dataType="xsd:string" dictRef="x:l101">Charge = -1 Multiplicity = 1</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l103" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="berny">
                     <scalar dataType="xsd:string" dictRef="g:optimization">Berny optimization.</scalar>
                  </list>
                  <module cmlx:templateRef="l103.init">
                     <list cmlx:templateRef="length">
                        <array dataType="xsd:string" dictRef="g:symbol" size="45">R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="45">1 1 1 1 2 2 2 3 3 3 4 4 5 5 6 6 6 7 10 10 11 14 14 14 15 16 16 17 17 18 18 19 19 20 20 21 22 22 22 23 23 23 24 24 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="45">2 4 5 24 3 9 10 4 7 22 5 15 6 13 7 11 14 8 11 23 12 25 26 27 16 17 21 18 28 19 29 20 30 21 31 32 33 34 35 36 37 38 39 40 41</array>
                        <array dataType="xsd:double" dictRef="cc:distance" size="45">1.5455 1.5113 1.4959 1.4917 1.5846 1.102 1.4987 1.549 1.5191 1.5005 1.5267 1.7559 1.5383 1.0935 1.5144 1.5835 1.508 1.2108 1.3946 1.4957 1.2522 1.099 1.1024 1.0996 1.7713 1.3996 1.4032 1.3943 1.0902 1.3946 1.0934 1.396 1.0927 1.3924 1.0934 1.0939 1.1016 1.1017 1.0997 1.1116 1.1022 1.1084 1.102 1.1027 1.1016</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="45">calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically</array>
                     </list>
                     <list cmlx:templateRef="angle">
                        <array dataType="xsd:string" dictRef="g:symbol" size="85">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 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="85">2 2 2 4 5 1 1 1 3 3 9 2 2 2 4 4 7 1 1 3 3 5 1 1 4 4 6 5 5 5 7 7 11 3 3 6 2 2 11 6 6 10 6 6 6 25 25 26 4 15 15 17 16 16 18 17 17 19 18 18 20 19 19 21 16 16 20 3 3 3 33 33 34 10 10 10 36 36 37 1 1 1 39 39 40</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="85">1 1 1 1 1 2 2 2 2 2 2 3 3 3 3 3 3 4 4 4 4 4 5 5 5 5 5 6 6 6 6 6 6 7 7 7 10 10 10 11 11 11 14 14 14 14 14 14 15 16 16 16 17 17 17 18 18 18 19 19 19 20 20 20 21 21 21 22 22 22 22 22 22 23 23 23 23 23 23 24 24 24 24 24 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="85">4 5 24 24 24 3 9 10 9 10 10 4 7 22 7 22 22 3 15 5 15 15 6 13 6 13 13 7 11 14 11 14 14 6 8 8 11 23 23 10 12 12 25 26 27 26 27 27 16 17 21 21 18 28 28 19 29 29 20 30 30 21 31 31 20 32 32 33 34 35 34 35 35 36 37 38 37 38 38 39 40 41 40 41 41</array>
                        <array dataType="xsd:double" dictRef="cc:angle" size="85">90.5311 103.0619 126.6757 131.7321 124.0813 89.3355 111.9384 113.6756 109.0456 116.7671 113.7283 87.7322 105.3527 119.4449 102.1165 121.9922 115.6795 91.9494 133.9781 99.1112 129.4295 120.5928 117.6319 117.3691 111.2295 117.6277 119.0051 101.1565 111.3024 115.0808 101.8816 114.1946 112.012 105.1542 127.2089 127.5972 114.9775 121.7215 121.8432 110.5182 119.0444 130.425 109.8103 111.5635 110.4255 108.209 107.448 109.2698 105.2773 124.0117 116.7441 119.2316 120.0411 119.947 120.0118 120.7523 119.1455 120.1021 119.2092 120.4017 120.389 120.4811 120.1604 119.3578 120.2839 119.7978 119.9181 110.9426 109.8968 112.1045 107.4295 108.0682 108.2423 114.0837 108.8555 113.6288 106.8112 105.6197 107.4336 111.6985 110.2289 111.3485 107.7235 107.9832 107.6945</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="85">calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically</array>
                     </list>
                     <list cmlx:templateRef="dihed">
                        <array dataType="xsd:string" dictRef="g:symbol" size="138">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 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 D137 D138</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="138">4 4 4 5 5 5 24 24 24 2 2 24 24 2 2 24 24 2 2 2 4 4 4 5 5 5 1 1 1 9 9 9 10 10 10 1 1 3 3 9 9 2 2 2 7 7 7 22 22 22 2 2 4 4 22 22 2 2 2 4 4 4 7 7 7 3 3 15 15 1 3 5 1 1 1 4 4 4 13 13 13 5 5 11 11 14 14 5 5 7 7 14 14 5 5 5 7 7 7 11 11 11 2 2 23 23 2 2 2 11 11 11 4 4 15 15 21 21 15 15 17 17 16 16 28 28 17 17 29 29 18 18 30 30 19 19 31 31</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="138">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 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 3 3 3 3 3 3 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 10 10 10 10 10 10 10 10 10 10 15 15 16 16 16 16 16 16 16 16 17 17 17 17 18 18 18 18 19 19 19 19 20 20 20 20</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="138">2 2 2 2 2 2 2 2 2 4 4 4 4 5 5 5 5 24 24 24 24 24 24 24 24 24 3 3 3 3 3 3 3 3 3 10 10 10 10 10 10 4 4 4 4 4 4 4 4 4 7 7 7 7 7 7 22 22 22 22 22 22 22 22 22 5 5 5 5 15 15 15 6 6 6 6 6 6 6 6 6 7 7 7 7 7 7 11 11 11 11 11 11 14 14 14 14 14 14 14 14 14 11 11 11 11 23 23 23 23 23 23 16 16 17 17 17 17 21 21 21 21 18 18 18 18 19 19 19 19 20 20 20 20 21 21 21 21</array>
                        <array dataType="xsd:integer" dictRef="g:atom4" size="138">3 9 10 3 9 10 3 9 10 3 15 3 15 6 13 6 13 39 40 41 39 40 41 39 40 41 4 7 22 4 7 22 4 7 22 11 23 11 23 11 23 1 5 15 1 5 15 1 5 15 6 8 6 8 6 8 33 34 35 33 34 35 33 34 35 6 13 6 13 16 16 16 7 11 14 7 11 14 7 11 14 3 8 3 8 3 8 10 12 10 12 10 12 25 26 27 25 26 27 25 26 27 6 12 6 12 36 37 38 36 37 38 17 21 18 28 18 28 20 32 20 32 19 29 19 29 20 30 20 30 21 31 21 31 16 32 16 32</array>
                        <array dataType="xsd:double" dictRef="cc:dihed" size="138">-5.087 105.2259 -124.211 55.2229 165.5358 -63.9012 -151.9007 -41.5877 88.9753 5.2069 -151.1358 149.1729 -7.1697 16.5221 169.0573 -137.2796 15.2556 51.2251 -68.4981 172.0417 -81.5994 158.6774 39.2172 -161.2011 79.0757 -40.3845 4.9667 -96.9779 130.8765 -108.0668 149.9886 17.843 121.3216 19.377 -112.7686 52.0865 -114.37 -49.8592 143.6844 -178.245 15.2985 -5.0819 -63.982 152.9657 100.1367 41.2367 -101.8157 -128.8156 172.2843 29.232 44.5215 -137.6426 -46.451 131.3848 178.761 -3.4031 -172.4301 68.9109 -51.508 -65.0292 176.3118 55.8929 60.0686 -58.5904 -179.0093 -23.7211 -165.9494 123.6391 -18.5892 70.6737 -78.0477 145.5406 -69.4908 38.0958 166.9003 -3.2129 104.3738 -126.8218 138.4342 -113.9791 14.8253 30.0963 -147.7283 -84.7313 97.4441 154.3099 -23.5148 -52.8955 128.2502 54.2182 -124.6362 176.684 -2.1704 166.5602 46.5937 -75.1305 50.1693 -69.7972 168.4787 -64.988 175.0455 53.3214 9.1806 -172.1351 175.6188 -5.6969 58.7036 177.874 -62.4585 -106.8252 12.3451 132.0127 -8.9996 172.3021 -178.7578 1.2755 -0.0899 179.9434 178.6091 -1.5718 -0.1545 179.6647 0.2278 -179.8483 -179.8055 0.1184 -0.1186 -179.997 179.9582 0.0798 -0.1279 -179.8389 179.7505 0.0395 0.2651 -179.5539 179.9783 0.1594</array>
                        <array dataType="xsd:string"
                               delimiter="|"
                               dictRef="g:deriv"
                               size="138">calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l103" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="berny">
                     <scalar dataType="xsd:string" dictRef="g:optimization">Berny optimization.</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 1 out of a maximum of 2</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="junk"
                            dataType="xsd:string"
                            dictRef="x:junk1"
                            size="9">Second derivative matrix not updated -- analytic derivatives used.</array>
                     <array cmlx:templateRef="eigenvaluelist"
                            dataType="xsd:double"
                            dictRef=""
                            size="117">0.00098 0.00110 0.00132 0.00177 0.00439 0.00458 0.00860 0.01041 0.01192 0.01394 0.01607 0.01749 0.01792 0.01903 0.01980 0.02363 0.02412 0.02485 0.02613 0.02688 0.02803 0.02961 0.03049 0.03073 0.03219 0.03420 0.03472 0.03742 0.04017 0.04086 0.04154 0.04205 0.04258 0.04270 0.04319 0.04438 0.04748 0.05417 0.05481 0.05753 0.06587 0.07036 0.07170 0.08173 0.08642 0.10472 0.10533 0.11005 0.11213 0.11382 0.11603 0.11768 0.11813 0.11853 0.11947 0.12275 0.12571 0.13470 0.13932 0.14092 0.14325 0.14400 0.14545 0.14634 0.15185 0.15397 0.16319 0.16968 0.17160 0.17741 0.18257 0.18934 0.19018 0.19587 0.20029 0.20383 0.22239 0.23302 0.23731 0.24619 0.25733 0.26316 0.26977 0.30317 0.31075 0.31171 0.31899 0.33034 0.33261 0.33408 0.33628 0.33999 0.34009 0.34141 0.34252 0.34299 0.34509 0.34809 0.34840 0.34899 0.35022 0.35128 0.36007 0.36066 0.36178 0.36343 0.36441 0.36598 0.40819 0.41312 0.42982 0.45278 0.48709 0.48952 0.52723 0.70194 0.87331</array>
                     <array cmlx:templateRef="junk"
                            dataType="xsd:string"
                            dictRef="x:junk1"
                            size="8">Angle between quadratic step and forces= 73.73 degrees.</array>
                     <list cmlx:templateRef="iterationList">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="2">1 2</array>
                        <array dataType="xsd:double" dictRef="g:rmscart" size="2">0.00078437 0.00000084</array>
                        <array dataType="xsd:double" dictRef="g:rmsint" size="2">0.00000080 0.00000000</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l103.deltas">
                     <list cmlx:templateRef="delta">
                        <array dataType="xsd:string" dictRef="cc:variable" size="268">R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 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 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 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 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 D137 D138</array>
                        <array dataType="xsd:double" dictRef="g:lastval" size="268">2.92053 2.85592 2.82689 2.81890 2.99437 2.08247 2.83218 2.92709 2.87071 2.83562 2.88503 3.31810 2.90698 2.06647 2.86180 2.99247 2.84980 2.28816 2.63546 2.82648 2.36623 2.07690 2.08319 2.07793 3.34718 2.64486 2.65171 2.63487 2.06015 2.63546 2.06628 2.63810 2.06486 2.63116 2.06617 2.06720 2.08166 2.08198 2.07806 2.10063 2.08283 2.09455 2.08248 2.08383 2.08164 1.58006 1.79877 2.21091 2.29916 2.16563 1.55920 1.95369 1.98401 1.90320 2.03797 1.98493 1.53122 1.83875 2.08471 1.78227 2.12916 2.01899 1.60482 2.33836 1.72982 2.25897 2.10474 2.05306 2.04848 1.94132 2.05299 2.07703 1.76551 1.94259 2.00854 1.77817 1.99307 1.95498 1.83529 2.22021 2.22699 2.00674 2.12444 2.12656 1.92891 2.07772 2.27635 1.91655 1.94715 1.92729 1.88860 1.87532 1.90712 1.83743 2.16441 2.03757 2.08098 2.09511 2.09347 2.09460 2.10753 2.07948 2.09618 2.08059 2.10141 2.10118 2.10279 2.09719 2.08319 2.09935 2.09087 2.09296 1.93631 1.91806 1.95659 1.87500 1.88615 1.88919 1.99114 1.89989 1.98320 1.86421 1.84341 1.87507 1.94951 1.92386 1.94340 1.88013 1.88466 1.87962 -0.08878 1.83654 -2.16789 0.96382 2.88914 -1.11529 -2.65117 -0.72584 1.55291 0.09088 -2.63782 2.60356 -0.12514 0.28836 2.95061 -2.39598 0.26626 0.89405 -1.19552 3.00269 -1.42418 2.76944 0.68447 -2.81349 1.38013 -0.70484 0.08668 -1.69258 2.28423 -1.88612 2.61780 0.31142 2.11746 0.33819 -1.96818 0.90908 -1.99613 -0.87021 2.50777 -3.11096 0.26701 -0.08870 -1.11670 2.66975 1.74772 0.71972 -1.77702 -2.24826 3.00693 0.51019 0.77705 -2.40232 -0.81072 2.29310 3.11997 -0.05940 -3.00947 1.20272 -0.89898 -1.13497 3.07722 0.97552 1.04839 -1.02260 -3.12430 -0.41401 -2.89636 2.15791 -0.32444 1.23349 -1.36219 2.54016 -1.21284 0.66490 2.91296 -0.05608 1.82167 -2.21346 2.41613 -1.98931 0.25875 0.52528 -2.57834 -1.47884 1.70072 2.69322 -0.41041 -0.92320 2.23839 0.94629 -2.17531 3.08372 -0.03788 2.90702 0.81321 -1.31127 0.87562 -1.21819 2.94051 -1.13425 3.05512 0.93063 0.16023 -3.00433 3.06513 -0.09943 1.02457 3.10449 -1.09011 -1.86445 0.21546 2.30406 -0.15707 3.00724 -3.11991 0.02226 -0.00157 3.14060 3.11732 -0.02743 -0.00270 3.13574 0.00398 -3.13895 -3.13820 0.00207 -0.00207 -3.14154 3.14086 0.00139 -0.00223 -3.13878 3.13724 0.00069 0.00463 -3.13381 3.14121 0.00278</array>
                        <array dataType="xsd:double" dictRef="cc:deriv" size="268">-0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00001 -0.00001 0.00001 0.00001 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00001 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00002 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00001 -0.00000 -0.00001 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000</array>
                        <array dataType="xsd:double" dictRef="cc:delta.linear" size="268">0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000</array>
                        <array dataType="xsd:double" dictRef="cc:delta.quad" size="268">-0.00001 0.00003 -0.00002 0.00001 -0.00001 -0.00001 0.00002 -0.00001 -0.00001 0.00001 0.00003 -0.00002 -0.00000 0.00000 0.00004 -0.00007 0.00003 -0.00002 0.00003 0.00002 -0.00001 0.00001 -0.00001 -0.00000 -0.00003 0.00003 0.00000 -0.00001 0.00000 0.00001 0.00000 -0.00001 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00001 0.00004 0.00001 -0.00005 0.00000 0.00000 -0.00001 -0.00000 -0.00002 -0.00003 0.00008 -0.00000 0.00000 0.00003 0.00003 -0.00001 -0.00002 -0.00002 0.00001 0.00002 -0.00010 -0.00002 0.00005 0.00003 -0.00001 0.00012 -0.00002 -0.00002 -0.00008 0.00001 0.00002 0.00001 -0.00000 -0.00002 -0.00004 -0.00001 -0.00002 0.00010 -0.00007 0.00004 -0.00001 0.00004 -0.00004 -0.00001 -0.00003 0.00006 -0.00003 0.00004 -0.00001 -0.00001 -0.00001 -0.00003 -0.00002 -0.00000 0.00007 0.00006 -0.00002 0.00003 -0.00002 0.00001 -0.00004 0.00003 -0.00000 0.00001 -0.00000 0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00001 0.00001 -0.00004 0.00003 0.00002 -0.00001 -0.00005 -0.00000 0.00003 0.00001 0.00016 0.00018 -0.00021 -0.00017 0.00001 0.00001 0.00004 -0.00010 0.00004 -0.00001 0.00001 0.00002 0.00000 0.00000 0.00002 0.00002 0.00001 0.00003 -0.00009 -0.00009 -0.00007 -0.00000 -0.00019 0.00003 -0.00015 0.00000 -0.00000 0.00012 0.00011 0.00116 0.00121 0.00123 0.00108 0.00113 0.00115 0.00103 0.00108 0.00109 -0.00000 0.00001 0.00003 -0.00003 -0.00002 -0.00000 0.00003 0.00004 0.00006 -0.00012 -0.00023 -0.00013 -0.00024 -0.00007 -0.00018 0.00000 0.00003 0.00023 0.00003 0.00005 0.00025 0.00010 0.00012 0.00032 -0.00007 -0.00020 -0.00009 -0.00022 -0.00016 -0.00029 -0.00119 -0.00120 -0.00117 -0.00122 -0.00122 -0.00120 -0.00116 -0.00117 -0.00114 -0.00002 0.00002 -0.00017 -0.00013 0.00040 0.00013 0.00034 -0.00005 0.00004 0.00008 -0.00003 0.00006 0.00009 -0.00005 0.00004 0.00007 0.00006 0.00020 0.00006 0.00019 -0.00002 0.00011 -0.00012 -0.00003 -0.00012 -0.00003 -0.00012 -0.00004 -0.00035 -0.00032 -0.00038 -0.00024 -0.00021 -0.00027 -0.00035 -0.00032 -0.00037 0.00016 0.00006 0.00025 0.00016 0.00281 0.00283 0.00284 0.00271 0.00273 0.00273 -0.00052 -0.00045 0.00006 0.00005 -0.00001 -0.00002 -0.00008 -0.00009 -0.00001 -0.00002 0.00002 0.00001 0.00003 0.00003 -0.00001 -0.00002 -0.00001 -0.00001 -0.00001 0.00002 0.00000 0.00002 0.00002 0.00003 -0.00000 0.00001</array>
                        <array dataType="xsd:double" dictRef="cc:delta.total" size="268">-0.00001 0.00003 -0.00002 0.00001 -0.00001 -0.00001 0.00002 -0.00001 -0.00001 0.00001 0.00003 -0.00002 -0.00000 0.00000 0.00004 -0.00007 0.00003 -0.00002 0.00003 0.00002 -0.00001 0.00001 -0.00001 -0.00000 -0.00003 0.00003 0.00000 -0.00001 0.00000 0.00001 0.00000 -0.00001 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00001 0.00004 0.00001 -0.00005 0.00000 0.00000 -0.00001 -0.00000 -0.00002 -0.00003 0.00008 -0.00000 0.00000 0.00003 0.00003 -0.00001 -0.00002 -0.00002 0.00001 0.00002 -0.00010 -0.00002 0.00005 0.00003 -0.00001 0.00012 -0.00002 -0.00002 -0.00008 0.00001 0.00002 0.00001 -0.00000 -0.00002 -0.00004 -0.00001 -0.00002 0.00010 -0.00007 0.00004 -0.00001 0.00004 -0.00004 -0.00001 -0.00003 0.00006 -0.00003 0.00004 -0.00001 -0.00001 -0.00001 -0.00003 -0.00002 -0.00000 0.00007 0.00006 -0.00002 0.00003 -0.00002 0.00001 -0.00004 0.00003 -0.00000 0.00001 -0.00000 0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00001 0.00001 -0.00004 0.00003 0.00002 -0.00001 -0.00005 -0.00000 0.00003 0.00001 0.00016 0.00018 -0.00021 -0.00017 0.00001 0.00001 0.00004 -0.00010 0.00004 -0.00001 0.00001 0.00002 0.00000 0.00000 0.00002 0.00002 0.00001 0.00003 -0.00009 -0.00009 -0.00007 -0.00000 -0.00019 0.00003 -0.00015 0.00000 -0.00000 0.00012 0.00011 0.00116 0.00121 0.00123 0.00108 0.00113 0.00115 0.00103 0.00108 0.00109 -0.00000 0.00001 0.00003 -0.00003 -0.00002 -0.00000 0.00003 0.00004 0.00006 -0.00012 -0.00023 -0.00013 -0.00024 -0.00007 -0.00018 0.00000 0.00003 0.00023 0.00003 0.00005 0.00025 0.00010 0.00012 0.00032 -0.00007 -0.00020 -0.00009 -0.00022 -0.00016 -0.00029 -0.00119 -0.00120 -0.00117 -0.00122 -0.00122 -0.00120 -0.00116 -0.00117 -0.00114 -0.00002 0.00002 -0.00017 -0.00013 0.00040 0.00013 0.00034 -0.00005 0.00004 0.00008 -0.00003 0.00006 0.00009 -0.00005 0.00004 0.00007 0.00006 0.00020 0.00006 0.00019 -0.00002 0.00011 -0.00012 -0.00003 -0.00012 -0.00003 -0.00012 -0.00004 -0.00035 -0.00032 -0.00038 -0.00024 -0.00021 -0.00027 -0.00035 -0.00032 -0.00037 0.00016 0.00006 0.00025 0.00016 0.00281 0.00283 0.00284 0.00271 0.00273 0.00273 -0.00052 -0.00045 0.00006 0.00005 -0.00001 -0.00002 -0.00008 -0.00009 -0.00001 -0.00002 0.00002 0.00001 0.00003 0.00003 -0.00001 -0.00002 -0.00001 -0.00001 -0.00001 0.00002 0.00000 0.00002 0.00002 0.00003 -0.00000 0.00001</array>
                        <array dataType="xsd:double" dictRef="cc:newval" size="268">2.92052 2.85596 2.82687 2.81891 2.99435 2.08246 2.83219 2.92708 2.87070 2.83563 2.88506 3.31808 2.90698 2.06648 2.86184 2.99240 2.84983 2.28814 2.63548 2.82650 2.36622 2.07691 2.08318 2.07792 3.34715 2.64489 2.65171 2.63486 2.06016 2.63547 2.06628 2.63810 2.06486 2.63116 2.06617 2.06720 2.08166 2.08198 2.07806 2.10067 2.08284 2.09450 2.08248 2.08383 2.08163 1.58006 1.79875 2.21088 2.29924 2.16562 1.55920 1.95372 1.98405 1.90320 2.03795 1.98491 1.53123 1.83878 2.08461 1.78225 2.12921 2.01902 1.60481 2.33847 1.72980 2.25895 2.10467 2.05307 2.04849 1.94133 2.05299 2.07701 1.76548 1.94258 2.00852 1.77827 1.99300 1.95502 1.83528 2.22025 2.22696 2.00673 2.12441 2.12663 1.92888 2.07775 2.27633 1.91654 1.94714 1.92726 1.88859 1.87532 1.90718 1.83750 2.16439 2.03760 2.08097 2.09512 2.09343 2.09464 2.10752 2.07949 2.09618 2.08060 2.10141 2.10117 2.10279 2.09718 2.08320 2.09936 2.09083 2.09299 1.93633 1.91805 1.95655 1.87500 1.88618 1.88919 1.99130 1.90007 1.98299 1.86404 1.84342 1.87508 1.94955 1.92376 1.94344 1.88012 1.88467 1.87964 -0.08878 1.83654 -2.16787 0.96384 2.88916 -1.11525 -2.65126 -0.72594 1.55284 0.09087 -2.63801 2.60359 -0.12529 0.28837 2.95060 -2.39586 0.26637 0.89521 -1.19431 3.00392 -1.42309 2.77057 0.68562 -2.81246 1.38121 -0.70375 0.08668 -1.69257 2.28425 -1.88615 2.61778 0.31142 2.11749 0.33824 -1.96812 0.90896 -1.99636 -0.87034 2.50753 -3.11103 0.26683 -0.08869 -1.11667 2.66998 1.74775 0.71977 -1.77677 -2.24816 3.00705 0.51051 0.77698 -2.40252 -0.81081 2.29288 3.11981 -0.05969 -3.01067 1.20152 -0.90016 -1.13619 3.07600 0.97432 1.04723 -1.02376 -3.12544 -0.41403 -2.89634 2.15774 -0.32458 1.23388 -1.36206 2.54050 -1.21289 0.66494 2.91303 -0.05610 1.82173 -2.21336 2.41608 -1.98927 0.25882 0.52534 -2.57815 -1.47878 1.70091 2.69320 -0.41030 -0.92332 2.23835 0.94617 -2.17534 3.08359 -0.03792 2.90667 0.81289 -1.31165 0.87538 -1.21840 2.94024 -1.13460 3.05480 0.93026 0.16039 -3.00426 3.06538 -0.09927 1.02739 3.10732 -1.08727 -1.86174 0.21819 2.30679 -0.15759 3.00679 -3.11985 0.02231 -0.00158 3.14058 3.11724 -0.02752 -0.00271 3.13572 0.00399 -3.13893 -3.13817 0.00209 -0.00208 -3.14156 3.14086 0.00138 -0.00224 -3.13876 3.13724 0.00071 0.00464 -3.13378 3.14121 0.00279</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">0.000020 0.000003 0.006258 0.000784</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">YES YES NO YES</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="preddelta">
                     <list cmlx:templateRef="predicted">
                        <scalar dataType="xsd:double" dictRef="g:predchange">-5.022126e-08</scalar>
                     </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">def2SVP</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:diffuse">(5D, 7F)</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:natoms">41</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">41</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">41</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="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.distmat">
                     <array dataType="xsd:double" dictRef="cc:distance" size="861">0.000000 1.545480 0.000000 2.200570 1.584550 0.000000 1.511290 2.171590 1.548950 0.000000 1.495928 2.381452 2.340720 1.526694 0.000000 2.595909 2.595484 2.409133 2.529429 1.538309 0.000000 2.993403 2.468425 1.519114 2.386369 2.358244 1.514399 0.000000 4.195166 3.546275 2.449186 3.434059 3.486149 2.448886 1.210842 0.000000 2.208053 1.101994 2.205631 2.832969 3.364728 3.691830 3.373294 4.330370 0.000000 2.548508 1.498724 2.626029 3.342387 2.902553 2.449641 2.706089 3.621050 2.188553 0.000000 2.955842 2.440561 3.023359 3.514832 2.577587 1.583546 2.405935 3.218555 3.401725 1.394623 0.000000 4.095474 3.658187 4.236099 4.691272 3.572007 2.449656 3.391887 3.944918 4.555132 2.403672 1.252157 0.000000 2.222087 3.404885 3.368495 2.252768 1.093530 2.278935 3.290216 4.309937 4.328818 3.849131 3.350828 4.122327 0.000000 3.923376 4.102726 3.751829 3.698057 2.570477 1.508049 2.537632 2.938736 5.199718 3.776748 2.563577 2.773716 2.754423 0.000000 3.008705 3.865128 2.989495 1.755863 2.853491 3.950489 3.710624 4.472374 4.314563 5.098140 5.178567 6.289949 3.002822 4.734045 0.000000 3.684858 4.362214 3.712804 2.803451 4.164960 5.313567 4.883407 5.641602 4.366460 5.812831 6.266367 7.470302 4.435546 6.328191 1.771252 0.000000 3.483173 3.922234 3.673102 3.071511 4.421047 5.531235 5.087224 5.937071 3.599165 5.413569 6.154424 7.389146 4.874255 6.769537 2.805278 1.399601 0.000000 4.752009 5.071880 4.921629 4.458937 5.791944 6.888415 6.382433 7.175007 4.529435 6.539858 7.409366 8.643945 6.225075 8.155340 4.085865 2.420105 1.394316 0.000000 5.880386 6.308643 5.948478 5.375732 6.747043 7.883846 7.332143 8.033047 5.850704 7.798932 8.572131 9.810189 7.060797 9.038263 4.576897 2.808132 2.424399 1.394628 0.000000 5.997072 6.586685 5.969141 5.222590 6.578315 7.729818 7.189491 7.815230 6.346458 8.077405 8.649738 9.868736 6.761795 8.710548 4.021735 2.424499 2.788914 2.407088 1.396023 0.000000 5.057700 5.754551 4.993370 4.105659 5.415233 6.553689 6.071849 6.698129 5.726260 7.202576 7.608355 8.796728 5.547799 7.432386 2.709855 1.403222 2.417866 2.782933 2.420636 1.392351 0.000000 3.471088 2.664603 1.500545 2.667151 3.792086 3.807702 2.556350 2.928189 2.719052 3.719482 4.316121 5.480362 4.760043 5.030783 3.523106 3.730838 3.580368 4.574943 5.500832 5.596013 4.818509 0.000000 3.681240 2.615454 3.938727 4.691789 4.289535 3.882365 4.126676 4.904295 2.757825 1.495708 2.526498 3.014469 5.151999 5.082229 6.429779 6.920969 6.284709 7.229392 8.572768 9.045618 8.317674 4.769951 0.000000 1.491700 2.714338 3.623980 2.740517 2.638914 3.889941 4.477939 5.683359 2.959544 3.533794 4.029037 5.001325 2.861663 5.063687 3.729463 4.026529 3.626580 4.673317 5.800526 6.052852 5.294450 4.723554 4.262562 0.000000 4.733930 4.602380 4.160074 4.447187 3.496689 2.146052 2.720935 2.692546 5.660115 4.084134 2.839315 2.797128 3.823849 1.099049 5.516278 7.071528 7.483550 8.849441 9.743088 9.428656 8.163248 5.260359 5.284232 5.967523 0.000000 4.232505 4.637099 4.006315 3.687943 2.758600 2.170586 2.898546 3.193335 5.709275 4.609759 3.533997 3.867173 2.688613 1.102377 4.316635 6.029087 6.686871 8.077418 8.815603 8.325906 6.986909 5.187447 6.000996 5.341914 1.783349 0.000000 4.243199 4.579322 4.545123 4.332900 2.955923 2.154234 3.474472 3.976974 5.673000 4.063941 2.754388 2.614897 2.880645 1.099591 5.390062 6.968639 7.357109 8.736348 9.655881 9.361119 8.093407 5.922545 5.201150 5.139138 1.772491 1.795662 0.000000 2.658081 2.947403 3.016575 2.592396 3.812902 4.845399 4.480088 5.426240 2.551315 4.417401 5.263808 6.492358 4.409585 6.195122 2.981052 2.161197 1.090187 2.157135 3.409892 3.879086 3.408412 3.138050 5.214895 2.864678 6.888497 6.276922 6.732629 0.000000 5.054659 5.191686 5.299424 5.022609 6.271848 7.302169 6.809534 7.627905 4.454147 6.579879 7.603371 8.816604 6.783621 8.661581 4.954962 3.405565 2.150520 1.093428 2.161065 3.401738 3.876326 4.918012 7.050505 4.854523 9.325717 8.706159 9.200560 2.472161 0.000000 6.856130 7.220047 6.930940 6.429752 7.793832 8.922231 8.345517 9.027703 6.661661 8.694105 9.541572 10.780492 8.115506 10.106873 5.669314 3.900807 3.414822 2.163625 1.092676 2.164746 3.411667 6.392372 9.364347 6.685030 10.800801 9.902964 10.718010 4.311574 2.495992 0.000000 7.036818 7.653489 6.964579 6.201853 7.533561 8.679968 8.122435 8.680759 7.431366 9.139902 9.668357 10.878037 7.648593 9.580430 4.859783 3.410927 3.882246 3.401844 2.162890 1.093368 2.150999 6.540074 10.131168 7.076117 10.291584 9.115305 10.241781 4.972428 4.310878 2.498107 0.000000 5.571767 6.347660 5.428700 4.465092 5.652828 6.742972 6.293641 6.820284 6.471504 7.729188 7.959510 9.095782 5.651918 7.423231 2.816063 2.165940 3.410314 3.876830 3.410206 2.157459 1.093915 5.324757 8.951122 5.896084 8.144764 6.830051 8.096901 4.314217 4.970224 4.312591 2.473996 0.000000 4.146734 3.594868 2.155627 3.002317 4.184554 4.185564 2.835987 2.905342 3.771188 4.613893 4.981148 6.096315 5.030037 5.178114 3.374270 3.684567 3.884476 4.854616 5.539466 5.397896 4.543933 1.101568 5.769056 5.420531 5.360319 5.128338 6.164764 3.723686 5.373676 6.449026 6.231899 4.871010 0.000000 4.151860 2.999098 2.142595 3.575532 4.462209 4.148730 2.808795 2.907623 2.965287 3.698969 4.358763 5.412984 5.499986 5.339666 4.594969 4.808707 4.531109 5.405698 6.373318 6.570225 5.873631 1.101735 4.542934 5.423051 5.370584 5.646557 6.231879 3.992724 5.593713 7.187952 7.499969 6.387814 1.776040 0.000000 3.592004 2.906173 2.168583 2.956845 4.263227 4.577268 3.510008 4.012542 2.578031 4.168136 4.986889 6.198417 5.177421 5.892702 3.608331 3.286478 2.823157 3.625743 4.606929 4.899459 4.340938 1.099664 5.041386 4.580557 6.229063 6.032528 6.710331 2.438780 3.883524 5.433735 5.875157 5.031504 1.781604 1.783702 0.000000 3.713863 2.967154 4.488006 4.966699 4.556592 4.475803 4.884602 5.793268 2.924739 2.197672 3.215490 3.685636 5.296508 5.694989 6.637080 6.983642 6.232476 7.083647 8.453506 9.017188 8.373591 5.356536 1.111607 3.887965 6.052106 6.567766 5.686456 5.145371 6.815155 9.194222 10.109286 9.069300 6.390300 5.270120 5.444886 0.000000 4.471891 3.512828 4.695936 5.451066 4.814552 4.152851 4.559901 5.204665 3.815088 2.125448 2.602591 2.596315 5.594536 5.099542 7.205196 7.858670 7.309892 8.300512 9.631735 10.051049 9.257514 5.590031 1.102189 5.060930 5.162016 6.120249 5.080805 6.251545 8.146606 10.443933 11.130706 9.828676 6.522977 5.282046 5.988148 1.777412 0.000000 4.296239 2.983463 4.153671 5.142471 5.019519 4.584985 4.486016 5.117726 2.797097 2.189662 3.347360 3.879225 5.971422 5.840117 6.834265 7.136842 6.382611 7.195929 8.547232 9.120293 8.500607 4.643952 1.108391 4.926302 5.935399 6.723296 6.094500 5.327712 6.916112 9.268141 10.200723 9.197011 5.682836 4.221125 4.832235 1.768526 1.781956 0.000000 2.157572 2.993346 3.940601 3.228423 3.532534 4.723992 5.057210 6.228453 2.821303 3.988762 4.763856 5.792847 3.867507 6.008033 4.064206 3.872044 3.128952 3.938760 5.142945 5.619363 5.092753 4.750810 4.503620 1.102001 6.853902 6.283650 6.163934 2.344327 3.948896 5.930160 6.660865 5.858687 5.510302 5.435008 4.360179 4.020261 5.430583 4.967711 0.000000 2.139784 3.079755 4.263591 3.578439 3.077453 4.084774 4.906748 6.110595 3.362384 3.441586 3.877491 4.647566 3.235593 5.171371 4.727914 5.127496 4.679071 5.657846 6.824732 7.134355 6.394435 5.458033 3.901329 1.102713 6.046776 5.610374 5.043232 3.845538 5.715450 7.663525 8.154686 6.977838 6.232872 6.016038 5.391622 3.351473 4.562025 4.702330 1.780519 0.000000 2.152897 3.610636 4.213559 2.988996 2.847708 4.294828 4.975374 6.156264 3.942040 4.453070 4.718077 5.631258 2.669677 5.252064 3.500776 3.878164 3.762869 4.798421 5.731279 5.801809 4.986581 5.315989 5.291183 1.101556 6.255621 5.336551 5.272286 3.282305 5.144947 6.636421 6.747310 5.467569 5.846416 6.138600 5.180337 4.931192 6.022840 5.998070 1.782525 1.779831 0.000000</array>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.5889345 0.1780739 0.1653579</array>
                  </module>
               </module>
               <module cmlx:templateRef="l50X">
                  <scalar dataType="xsd:integer" dictRef="cc:ncycle">1</scalar>
                  <scalar dataType="xsd:double" dictRef="g:rbhflyp" units="nonsi:hartree">-1282.30994719</scalar>
               </module>
               <module cmlx:templateRef="l1102">
                  <list cmlx:templateRef="l1102">
                     <scalar dataType="xsd:string" dictRef="g:l1102">Symmetrizing basis deriv contribution to polar:</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l1102">IMax=3 JMax=2 DiffMx= 0.00D+00</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l1002.minotr">
                  <list cmlx:templateRef="l1002">
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="1">IDoAtm=11111111111111111111111111111111111111111</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="9">NEqPCM: Using equilibrium solvation (IEInf=0, Eps= 7.4257, EpsInf= 1.9740)</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="9">Keep R1 ints in memory in canonical form, NReq=3486639124.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="14">There are 126 degrees of freedom in the 1st order CPHF. IDoFFX=6 NUNeed= 3.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">123 vectors produced by pass 0 Test12= 2.69D-14 1.00D-09 XBig12= 2.68D+02 6.05D+00.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="10">AX will form 123 AO Fock derivatives at one time.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">123 vectors produced by pass 1 Test12= 2.69D-14 1.00D-09 XBig12= 3.97D+01 1.06D+00.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">123 vectors produced by pass 2 Test12= 2.69D-14 1.00D-09 XBig12= 5.44D-01 5.95D-02.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">123 vectors produced by pass 3 Test12= 2.69D-14 1.00D-09 XBig12= 2.48D-03 3.15D-03.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">123 vectors produced by pass 4 Test12= 2.69D-14 1.00D-09 XBig12= 7.97D-06 2.46D-04.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">103 vectors produced by pass 5 Test12= 2.69D-14 1.00D-09 XBig12= 1.17D-08 7.06D-06.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">42 vectors produced by pass 6 Test12= 2.69D-14 1.00D-09 XBig12= 1.46D-11 2.99D-07.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">3 vectors produced by pass 7 Test12= 2.69D-14 1.00D-09 XBig12= 1.43D-14 7.14D-09.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="6">InvSVY: IOpt=1 It= 1 EMax= 7.11D-15</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="9">Solved reduced A of dimension 763 with 126 vectors.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="7">Isotropic polarizability for W= 0.000000 292.61 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>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:jobtime">
                  <scalar dataType="xsd:string">PT7486.500S</scalar>
               </property>
               <property dictRef="cc:jobdatetime.end">
                  <scalar dataType="xsd:date">2023-01-29T20:51:22.000</scalar>
               </property>
               <property dictRef="cc:popanal">
                  <module cmlx:templateRef="l601.popanal">
                     <array dataType="xsd:double" dictRef="g:alphaocc" size="78">-10.24508 -10.23113 -10.23063 -10.23057 -10.22815 -10.22575 -10.22282 -10.22058 -10.21779 -10.21675 -10.20972 -10.20909 -10.20225 -10.20090 -10.19106 -10.18611 -10.14295 -7.99685 -5.93937 -5.93509 -5.92974 -1.02353 -0.94201 -0.92783 -0.87325 -0.80022 -0.77194 -0.76534 -0.75358 -0.74454 -0.71722 -0.70207 -0.66781 -0.65454 -0.62911 -0.61297 -0.59766 -0.55986 -0.54418 -0.52529 -0.50770 -0.49272 -0.47781 -0.46511 -0.45799 -0.44904 -0.44085 -0.42554 -0.42120 -0.41755 -0.41637 -0.39473 -0.39216 -0.38637 -0.38335 -0.37777 -0.37616 -0.37484 -0.37131 -0.36070 -0.35866 -0.34682 -0.34524 -0.34175 -0.33629 -0.32307 -0.31421 -0.31111 -0.30165 -0.29620 -0.29370 -0.26568 -0.26106 -0.24437 -0.22052 -0.20324 -0.17208 -0.12440</array>
                     <array dataType="xsd:double" dictRef="g:alphavirt" size="324">0.00179 0.00373 0.02890 0.07053 0.08767 0.10020 0.11299 0.11535 0.11797 0.12503 0.12715 0.13568 0.14249 0.14871 0.15393 0.16098 0.16509 0.16872 0.17127 0.17294 0.17769 0.18444 0.18859 0.18949 0.19367 0.19552 0.21036 0.21866 0.22957 0.25750 0.26059 0.26523 0.27789 0.28224 0.29276 0.30030 0.30756 0.31720 0.32573 0.33176 0.33757 0.34335 0.35115 0.35996 0.36651 0.38220 0.40261 0.40948 0.41795 0.42751 0.43919 0.44233 0.45336 0.46757 0.47437 0.48698 0.49342 0.49790 0.50252 0.50326 0.50470 0.51262 0.52105 0.52503 0.53733 0.54814 0.55094 0.56245 0.57055 0.57560 0.59170 0.59658 0.60293 0.61123 0.61621 0.62629 0.63151 0.63808 0.64575 0.65544 0.66840 0.67368 0.67528 0.67906 0.68089 0.68271 0.68869 0.69155 0.69547 0.70116 0.70509 0.70703 0.71513 0.71681 0.72039 0.72374 0.72577 0.72862 0.73196 0.73244 0.74029 0.74508 0.74567 0.74752 0.75203 0.75842 0.76463 0.77044 0.77491 0.77853 0.78648 0.78806 0.79561 0.80001 0.81089 0.81382 0.81592 0.82732 0.83915 0.85406 0.86442 0.86549 0.88246 0.88541 0.89495 0.90100 0.91928 0.94179 0.95216 0.95345 0.96176 0.97746 0.99390 1.01455 1.02835 1.05723 1.06177 1.06640 1.08007 1.10034 1.10511 1.12749 1.14546 1.16081 1.17997 1.19802 1.20340 1.21106 1.21572 1.22287 1.23685 1.26295 1.26583 1.27590 1.29078 1.29677 1.30053 1.32443 1.32810 1.34473 1.35407 1.36465 1.38284 1.39423 1.42402 1.44001 1.47050 1.49932 1.51256 1.52641 1.54366 1.55344 1.56334 1.57491 1.57719 1.58790 1.59331 1.59839 1.60885 1.63499 1.65683 1.66079 1.67128 1.68986 1.70085 1.70842 1.71579 1.72843 1.73897 1.75017 1.75924 1.76851 1.77527 1.77805 1.77983 1.78541 1.78819 1.79458 1.80696 1.81450 1.82416 1.83271 1.83665 1.84015 1.84620 1.84801 1.85642 1.86239 1.86449 1.87503 1.88764 1.89570 1.90859 1.91105 1.91914 1.92233 1.92340 1.95015 1.96261 1.96908 1.97140 1.98506 1.99000 1.99191 2.00606 2.01055 2.02037 2.02657 2.03370 2.04210 2.06048 2.06596 2.08665 2.10188 2.11511 2.12207 2.13360 2.15980 2.16075 2.17219 2.17371 2.18343 2.19569 2.21761 2.22164 2.23403 2.25077 2.27558 2.29218 2.30019 2.30293 2.30746 2.31631 2.32889 2.33453 2.34498 2.35662 2.37238 2.37945 2.39772 2.41092 2.42502 2.43120 2.44368 2.45751 2.46668 2.47473 2.48553 2.48780 2.53281 2.53857 2.55146 2.55407 2.57288 2.60353 2.63029 2.63986 2.64247 2.65095 2.66409 2.67196 2.67404 2.69871 2.72642 2.75639 2.75719 2.76076 2.77334 2.78231 2.81075 2.82556 2.83182 2.85325 2.86153 2.88589 2.89694 2.90497 2.91436 2.92848 2.94886 2.96975 2.98723 2.99834 3.00313 3.00672 3.01371 3.02437 3.02909 3.04194 3.04417 3.06063 3.07212 3.08637 3.13427 3.15400 3.20641 3.23677 3.25615 3.26536 3.46994 3.49745 3.63728 3.70493 3.73896</array>
                     <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="41">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</array>
                              <array dataType="xsd:string" dictRef="cc:elementType" size="41">C C C C C C C O H C C O H C S C C C C C C C C C H H H H H H H H H H H H H H H H H</array>
                              <array dataType="xsd:double" dictRef="x:charge" size="41">-0.150235 0.067541 -0.326732 -0.153916 -0.046665 -0.319528 0.213799 -0.247396 -0.004577 -0.278449 0.129044 -0.415993 0.038867 0.071211 0.044529 -0.069099 -0.049774 -0.033693 -0.048768 -0.039893 -0.038031 0.054477 0.006270 0.078973 0.022990 0.016129 0.022454 0.052437 0.039034 0.038818 0.042739 0.033747 0.036655 0.041092 0.030634 0.008026 0.009663 0.008745 0.032570 0.046229 0.036076</array>
                           </list>
                           <scalar dataType="xsd:double" dictRef="x:chargesum">-1.00000</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="22">1 2 3 4 5 6 7 8 10 11 12 14 15 16 17 18 19 20 21 22 23 24</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="22">C C C C C C C O C C O C S C C C C C C C C C</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="22">-0.150235 0.062964 -0.326732 -0.153916 -0.007799 -0.319528 0.213799 -0.247396 -0.278449 0.129044 -0.415993 0.132784 0.044529 -0.069099 0.002663 0.005341 -0.009950 0.002846 -0.004284 0.162858 0.032705 0.193848</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">-1.00000</scalar>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l601.polariz">
                     <array dataType="xsd:double" dictRef="g:l601.pol.exact" size="6">369.257 7.324 296.326 20.117 17.281 212.236</array>
                     <array dataType="xsd:double" dictRef="g:l601.pol.approx" size="6">392.910 13.610 351.083 25.766 17.305 250.245</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">-3.0367 -0.0027 -0.0021 0.0005 10.2170 17.3556 29.4027 49.2901 62.0605</array>
                     </module>
                     <module cmlx:templateRef="l716.freq.chunkx"
                             dictRef="cc:vibrations"
                             id="default">
                        <array dataType="xsd:integer" dictRef="x:serial" size="117">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117</array>
                        <array dataType="xsd:string"
                               delimiter="|"
                               dictRef="cc:irrep"
                               size="117">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|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|A|A|A|A|A</array>
                        <array dataType="xsd:double" dictRef="cc:frequency" size="117">27.0081 49.1113 61.9722 96.7210 116.1741 120.5447 129.7515 142.9194 146.8051 161.7207 167.8316 190.8567 197.1234 204.8117 221.0218 227.6451 241.0324 268.7170 291.7377 303.7182 313.5881 404.7941 419.8854 420.9875 427.7264 440.1612 482.1672 492.6902 504.6448 515.7188 554.7312 604.6233 626.6198 656.7497 682.1718 713.4945 722.7045 731.3436 759.2719 766.0798 799.5420 829.5773 854.7930 860.7745 875.9016 898.2277 906.0780 928.7080 934.6004 947.7911 962.3579 1003.8117 1007.2532 1011.1343 1023.7424 1025.0231 1040.4274 1044.3718 1056.1758 1069.1215 1090.7909 1100.8775 1109.6440 1120.5793 1127.6917 1151.2023 1155.9321 1170.3396 1182.1438 1184.4646 1196.0968 1230.3294 1258.0650 1316.3007 1318.2569 1321.4129 1349.6221 1359.6004 1375.6107 1390.2767 1391.9704 1407.6769 1433.1910 1435.6989 1437.9804 1439.0372 1440.6996 1443.0590 1445.6571 1446.9079 1468.5690 1476.5202 1504.2956 1511.0310 1654.1809 1669.8169 1714.9362 1848.6488 2956.6458 3010.9448 3041.3206 3052.8026 3053.6384 3084.0575 3120.7927 3131.4731 3141.6810 3143.6146 3147.8168 3157.8443 3168.3829 3197.0185 3197.4370 3205.7539 3213.5817 3226.5258 3244.4407</array>
                        <array dataType="xsd:double" dictRef="cc:redmass" size="117">4.7855 4.8642 4.1517 2.7227 4.5777 1.2730 3.5078 2.1047 3.2986 1.6386 1.1795 2.1514 2.5476 1.4049 2.7204 2.9004 2.6482 3.5198 3.9692 4.7590 4.2355 6.0249 4.2409 3.6448 4.6928 6.7483 5.0121 3.1687 5.4035 4.9995 4.3208 4.1515 6.3460 5.8309 3.9265 6.3252 1.7378 4.3123 3.5404 1.8494 3.9487 6.2680 2.8667 1.2561 2.5363 2.5900 2.4544 1.3940 1.6548 1.7950 1.9536 1.3701 2.3101 5.5174 1.9498 1.5647 1.5771 1.5988 2.3356 2.0170 2.0364 1.4646 2.2981 2.6756 2.6288 2.0231 1.0695 1.6575 1.1320 1.9357 2.6623 3.2527 3.4423 1.4209 3.5426 2.0396 1.3191 1.7303 1.3476 6.5137 2.0606 2.6759 1.1201 1.1681 1.0660 1.2687 1.1279 1.0642 1.0662 1.0715 1.8171 2.5486 5.8862 2.3141 6.5084 6.3832 10.4366 12.7468 1.0496 1.0928 1.0372 1.0385 1.0378 1.0882 1.0955 1.1034 1.1038 1.1030 1.1019 1.1038 1.1032 1.0883 1.0921 1.0894 1.0951 1.0996 1.0935</array>
                        <array dataType="xsd:double" dictRef="cc:forceconst" size="117">0.0021 0.0069 0.0094 0.0150 0.0364 0.0109 0.0348 0.0253 0.0419 0.0253 0.0196 0.0462 0.0583 0.0347 0.0783 0.0886 0.0906 0.1497 0.1990 0.2586 0.2454 0.5817 0.4405 0.3806 0.5058 0.7703 0.6865 0.4532 0.8108 0.7834 0.7834 0.8942 1.4681 1.4818 1.0766 1.8972 0.5348 1.3589 1.2025 0.6395 1.4873 2.5415 1.2341 0.5483 1.1465 1.2312 1.1872 0.7084 0.8516 0.9500 1.0660 0.8134 1.3809 3.3235 1.2040 0.9686 1.0059 1.0274 1.5350 1.3584 1.4276 1.0458 1.6672 1.9795 1.9697 1.5797 0.8419 1.3376 0.9320 1.6000 2.2441 2.9009 3.2100 1.4506 3.6272 2.0983 1.4157 1.8845 1.5025 7.4179 2.3524 3.1241 1.3555 1.4186 1.2987 1.5480 1.3793 1.3057 1.3129 1.3217 2.3090 3.2737 7.8479 3.1130 10.4928 10.4863 18.0844 25.6661 5.4061 5.8372 5.6524 5.7023 5.7018 6.0985 6.2860 6.3752 6.4191 6.4223 6.4332 6.4852 6.5249 6.5538 6.5786 6.5964 6.6630 6.7447 6.7818</array>
                        <array dataType="xsd:double" dictRef="cc:irintensity" size="117">0.2658 1.8755 0.0437 0.6922 2.1824 0.3764 0.4220 0.6430 5.8884 2.4274 2.6315 1.2390 0.5560 1.0006 3.5753 2.1498 1.7000 4.3706 6.5432 23.7684 14.0310 4.6071 4.1939 2.6594 2.0778 5.2511 6.0080 11.1534 5.3365 7.0126 3.5474 2.2349 1.2742 4.4232 3.5021 15.0730 49.6858 8.0713 3.3394 50.8018 19.9255 3.9992 13.4782 0.5475 17.0686 10.0828 9.2173 3.6840 3.5098 60.2757 3.4712 0.1926 72.2473 1.5436 32.5562 18.5835 18.1360 3.0421 27.1972 5.3033 11.4240 18.6277 18.7909 18.4521 34.7626 10.1764 0.1055 14.1584 1.8860 9.9171 11.2112 5.4280 7.4718 2.6801 10.8887 0.9660 42.0633 6.6352 5.7050 3.9588 7.0427 15.7062 10.2826 28.5887 2.6549 32.1450 28.2945 5.8978 21.7225 12.4819 20.2309 12.6447 2.9631 86.0435 4.0147 97.2079 758.7554 540.0406 234.5684 96.4257 46.4654 73.9693 23.2719 60.9505 26.1661 26.1627 16.7264 20.2664 28.4731 20.8683 16.2008 1.8445 7.5348 0.3169 14.5824 13.2008 3.1122</array>
                        <array dataType="xsd:double" dictRef="cc:displacement" size="14391">-0.05 0.03 -0.06 -0.00 0.02 -0.04 0.05 0.03 -0.06 -0.00 0.04 -0.08 -0.04 0.01 -0.03 0.00 -0.01 0.02 0.06 0.01 -0.00 0.11 0.01 0.01 0.00 0.03 -0.06 -0.01 -0.01 0.02 -0.01 -0.02 0.05 -0.02 -0.04 0.09 -0.07 0.02 -0.04 0.01 -0.02 0.06 -0.01 0.05 -0.13 -0.01 0.00 -0.02 0.02 0.03 -0.13 0.01 -0.01 -0.03 -0.02 -0.07 0.17 -0.04 -0.10 0.27 -0.04 -0.06 0.18 0.11 0.04 -0.09 -0.02 -0.02 0.05 -0.11 0.04 -0.08 0.05 -0.04 0.09 0.01 -0.01 0.02 -0.04 -0.03 0.08 0.04 0.07 -0.29 0.03 0.01 -0.12 -0.02 -0.10 0.24 -0.06 -0.14 0.43 -0.06 -0.09 0.28 0.16 0.06 -0.12 0.13 0.01 -0.06 0.08 0.08 -0.12 -0.07 -0.01 0.04 -0.03 -0.04 0.10 0.01 -0.02 0.04 -0.11 0.05 -0.12 -0.14 0.02 -0.05 -0.14 0.04 -0.10 -0.03 0.08 0.04 -0.09 0.05 0.02 -0.04 0.07 0.03 0.00 0.10 0.05 0.02 0.06 0.02 0.02 -0.01 -0.01 0.00 0.01 0.00 0.02 -0.01 -0.01 -0.15 0.08 0.04 -0.11 -0.03 -0.01 -0.04 -0.06 -0.03 -0.03 -0.12 -0.06 0.07 0.06 0.02 0.10 -0.05 -0.04 -0.02 0.07 0.05 0.04 -0.00 0.02 0.13 0.01 -0.01 0.18 -0.06 -0.06 0.14 -0.14 -0.09 0.05 -0.15 -0.06 -0.00 -0.08 -0.00 -0.07 0.12 0.04 -0.18 -0.06 -0.01 -0.04 0.12 0.06 0.13 -0.12 -0.04 0.16 -0.00 -0.06 0.09 -0.07 -0.03 0.16 0.07 0.01 0.26 -0.05 -0.08 0.19 -0.19 -0.13 0.02 -0.21 -0.08 -0.08 -0.10 0.02 -0.04 0.14 0.07 -0.09 0.12 0.03 -0.09 0.14 0.04 -0.22 -0.03 -0.00 -0.18 -0.12 -0.01 -0.21 -0.05 -0.01 -0.07 0.14 0.10 -0.05 0.11 0.06 -0.01 0.15 0.06 -0.03 -0.00 -0.04 -0.01 0.02 -0.05 0.02 0.05 -0.02 -0.00 0.02 -0.03 -0.02 -0.01 0.00 0.01 -0.02 0.03 0.03 0.03 0.03 0.05 0.06 0.06 -0.02 0.04 -0.07 -0.02 0.00 -0.03 -0.01 -0.02 0.02 -0.01 -0.05 0.03 -0.03 -0.04 0.01 0.02 -0.04 0.09 -0.01 0.04 -0.08 0.00 0.01 -0.04 -0.00 -0.05 0.18 -0.00 -0.09 0.28 0.00 -0.07 0.15 0.01 -0.01 -0.10 0.01 0.02 -0.19 0.02 0.08 -0.02 -0.03 0.01 -0.10 -0.02 -0.03 -0.06 0.04 -0.03 0.11 0.03 -0.04 0.10 -0.01 -0.08 0.09 -0.01 -0.05 0.27 -0.01 -0.13 0.46 -0.00 -0.11 0.23 0.01 -0.00 -0.22 0.01 0.07 -0.38 0.10 0.11 -0.04 -0.01 0.02 -0.02 -0.03 0.15 -0.00 -0.01 -0.02 -0.12 -0.02 -0.01 -0.13 -0.06 0.05 -0.11 0.02 -0.06 -0.08 -0.01 0.01 -0.04 -0.07 -0.05 -0.07 0.02 -0.02 -0.06 0.01 0.02 -0.07 -0.00 0.03 -0.04 0.01 -0.01 -0.02 0.02 -0.02 -0.03 0.01 0.01 -0.04 -0.02 0.05 -0.02 -0.07 0.11 0.01 0.01 0.02 -0.09 0.00 0.00 -0.05 0.00 0.00 -0.04 -0.01 -0.02 0.03 0.03 -0.05 -0.02 0.01 -0.00 -0.02 0.01 -0.02 0.02 0.01 -0.01 0.01 0.00 -0.01 0.03 0.00 -0.01 0.02 0.01 0.00 0.01 0.01 0.01 -0.01 0.02 0.00 -0.01 -0.03 0.06 -0.02 -0.06 -0.07 0.27 0.05 -0.07 -0.08 0.01 0.01 -0.01 0.01 -0.01 -0.01 0.01 -0.02 -0.03 0.00 -0.02 0.04 -0.01 -0.01 0.04 0.00 0.01 0.01 0.02 0.02 -0.03 0.02 0.01 -0.02 -0.03 0.07 0.02 -0.05 0.08 -0.05 -0.03 0.06 -0.02 -0.36 0.06 0.26 -0.08 -0.15 0.61 0.22 -0.19 0.26 0.07 -0.08 -0.10 0.07 -0.06 -0.10 0.04 -0.11 -0.05 0.01 0.02 -0.04 0.00 0.05 -0.05 -0.01 0.08 -0.02 -0.00 0.03 -0.00 -0.00 0.03 -0.01 -0.00 0.03 -0.01 0.07 -0.03 -0.05 0.26 -0.24 -0.14 0.01 0.06 -0.07 0.01 0.04 -0.00 0.00 0.02 0.04 -0.01 0.01 0.09 0.01 -0.01 0.00 -0.01 0.04 -0.03 -0.04 -0.04 0.09 -0.04 -0.04 0.05 -0.05 -0.04 0.05 -0.06 -0.02 0.02 -0.05 0.00 -0.02 -0.03 0.01 -0.02 -0.03 -0.02 0.01 -0.05 0.14 0.00 0.00 0.04 -0.01 0.05 -0.01 -0.06 -0.03 0.04 -0.05 -0.01 0.04 -0.02 0.02 0.06 -0.04 -0.06 -0.06 0.07 -0.08 -0.02 0.02 -0.05 0.02 -0.05 -0.02 0.03 -0.06 -0.01 -0.02 0.00 -0.18 0.13 0.15 -0.05 0.33 -0.07 0.03 0.04 -0.05 -0.31 -0.05 -0.25 -0.03 -0.02 0.39 0.34 0.19 -0.15 0.06 -0.02 -0.06 0.07 -0.01 -0.08 0.05 -0.05 -0.03 -0.01 -0.00 0.02 -0.01 -0.01 0.02 0.00 -0.02 0.01 -0.00 -0.00 0.01 -0.01 -0.01 0.01 -0.00 -0.01 0.02 -0.01 -0.01 0.02 -0.02 0.01 0.02 -0.00 -0.02 0.03 -0.01 -0.01 0.03 0.00 -0.00 -0.01 0.02 0.02 -0.08 -0.01 0.00 0.01 -0.01 -0.01 0.02 0.00 0.01 -0.02 0.00 0.01 -0.01 0.01 0.01 -0.01 0.01 0.00 0.00 0.01 -0.00 0.01 0.00 -0.00 0.00 0.00 0.01 -0.01 0.01 -0.03 0.01 0.02 0.01 -0.03 -0.03 0.01 0.02 -0.01 0.00 0.02 -0.01 -0.02 0.03 0.00 -0.02 0.02 0.01 0.02 -0.01 0.02 0.00 0.00 0.01 -0.01 0.02 0.00 -0.01 0.01 -0.00 0.01 -0.01 0.01 -0.03 -0.00 0.02 -0.04 0.02 0.01 -0.03 0.01 -0.39 -0.15 -0.39 -0.03 -0.05 0.52 0.50 0.25 -0.25 -0.04 0.02 0.03 -0.03 -0.00 0.02 -0.01 0.02 0.02 -0.03 -0.07 -0.02 -0.02 -0.03 -0.02 -0.05 -0.03 -0.00 -0.03 -0.04 0.01 -0.04 -0.06 0.00 -0.07 -0.01 0.00 -0.06 -0.04 -0.01 -0.03 -0.09 -0.04 0.01 -0.05 -0.04 -0.01 0.00 0.00 -0.04 0.01 0.03 -0.05 0.03 0.09 -0.05 -0.08 0.01 -0.14 0.03 -0.00 0.06 0.08 -0.03 0.05 0.10 -0.00 0.11 0.10 0.00 0.15 0.04 0.02 0.12 -0.02 0.03 0.06 -0.02 0.02 0.03 0.04 0.00 -0.10 -0.01 0.03 0.03 0.02 -0.01 0.00 -0.13 -0.06 -0.20 0.11 -0.02 -0.19 -0.03 0.05 -0.08 0.05 -0.03 0.14 0.15 0.00 0.20 0.04 0.03 0.15 -0.06 0.05 0.04 -0.07 0.02 -0.02 0.04 -0.00 -0.41 -0.07 0.25 -0.06 0.35 -0.07 0.10 -0.26 -0.07 0.07 0.00 -0.02 0.03 0.06 -0.03 0.03 0.03 -0.02 -0.01 -0.11 -0.08 0.02 -0.17 -0.13 0.03 -0.19 0.01 0.03 0.01 0.04 0.01 0.00 0.02 0.00 0.01 0.04 0.01 -0.00 0.04 0.03 0.01 0.02 0.02 -0.00 0.01 0.00 0.01 0.03 -0.02 0.02 0.02 -0.00 0.00 0.04 0.00 -0.01 0.01 0.01 -0.01 0.00 0.02 -0.02 -0.02 0.04 0.00 0.03 0.06 -0.02 0.00 -0.02 -0.00 -0.09 -0.01 -0.02 -0.08 -0.04 -0.02 -0.08 -0.06 -0.01 -0.02 -0.05 -0.01 0.04 -0.03 -0.00 0.03 -0.01 -0.01 -0.04 -0.06 0.08 0.07 -0.01 -0.02 0.00 0.12 -0.01 0.06 0.06 -0.04 -0.01 0.09 0.00 0.01 0.07 -0.03 -0.01 -0.04 -0.03 -0.11 -0.08 -0.01 -0.02 -0.07 -0.00 0.09 -0.02 0.01 0.07 0.01 -0.01 -0.04 -0.42 0.02 0.38 -0.02 0.53 -0.06 0.17 -0.21 -0.06 0.01 -0.01 0.02 -0.01 -0.02 -0.04 -0.05 -0.02 0.01 0.02 0.05 0.13 0.15 -0.08 -0.08 0.27 -0.02 0.16 0.04 0.02 -0.01 0.00 0.01 -0.02 -0.01 -0.01 -0.02 -0.00 0.00 -0.01 0.01 0.04 -0.03 0.01 -0.00 -0.04 -0.02 0.00 -0.03 -0.10 0.07 0.00 -0.01 -0.00 0.01 0.00 -0.00 -0.03 -0.02 -0.04 0.08 -0.06 -0.09 0.27 0.02 0.04 -0.03 0.03 0.00 -0.09 -0.00 0.01 -0.01 -0.01 0.00 0.02 -0.00 0.00 0.01 0.00 0.01 -0.02 0.00 0.01 -0.02 -0.00 0.00 0.01 -0.01 -0.00 0.03 -0.01 -0.05 -0.02 0.00 0.01 -0.13 0.16 0.01 0.04 0.20 -0.19 -0.01 0.07 0.10 -0.35 -0.16 0.10 0.06 -0.00 0.00 0.01 0.00 0.01 -0.03 0.00 0.01 -0.04 -0.01 -0.00 0.02 -0.01 -0.01 0.05 0.14 -0.02 -0.15 -0.05 -0.25 0.02 -0.11 0.08 0.05 -0.16 -0.10 -0.32 -0.02 -0.03 0.08 0.17 0.18 -0.24 0.10 0.03 0.13 0.22 -0.00 -0.09 0.28 0.00 0.12 0.00 -0.01 0.01 -0.02 0.01 0.01 -0.01 0.01 0.02 -0.02 0.00 0.02 -0.01 -0.00 0.02 -0.01 0.01 0.02 0.00 -0.01 0.02 0.04 -0.05 -0.00 -0.02 0.02 0.01 -0.02 0.01 0.00 -0.01 0.01 -0.01 -0.00 0.01 -0.05 -0.01 -0.02 0.02 -0.02 0.01 0.03 -0.02 0.04 -0.03 -0.02 0.03 -0.01 -0.00 0.03 -0.01 0.01 0.01 -0.01 -0.00 -0.01 -0.01 -0.02 -0.02 0.00 -0.03 0.00 0.00 0.03 -0.01 -0.00 -0.04 -0.00 0.02 0.14 -0.09 0.01 -0.18 0.16 -0.06 -0.04 -0.07 0.25 0.16 -0.07 -0.10 0.01 0.04 -0.01 0.03 0.01 -0.02 0.01 -0.03 -0.01 -0.03 -0.03 0.01 -0.05 0.00 0.01 0.34 0.06 -0.22 -0.03 -0.37 0.09 -0.18 0.25 0.10 -0.03 0.02 0.05 -0.03 -0.02 -0.01 -0.07 -0.03 0.04 0.02 -0.00 0.08 0.22 -0.19 -0.24 0.35 -0.16 0.19 0.01 0.01 0.00 0.01 0.00 -0.00 0.00 -0.00 -0.00 0.01 0.00 -0.00 0.01 0.00 -0.00 0.01 0.00 -0.01 -0.01 0.00 -0.00 -0.02 0.02 0.01 0.01 -0.00 0.00 0.01 0.00 -0.01 0.01 -0.01 0.01 -0.00 -0.03 0.06 0.01 0.01 -0.00 0.02 0.01 -0.04 0.00 -0.01 -0.00 0.01 -0.01 -0.01 -0.00 -0.01 -0.01 -0.01 -0.01 -0.00 -0.00 0.00 0.00 0.01 0.00 0.00 0.01 -0.01 -0.00 -0.01 -0.00 0.00 0.00 0.00 -0.02 -0.03 0.04 0.01 -0.38 0.34 -0.28 -0.03 -0.15 0.47 0.46 -0.14 -0.36 -0.01 -0.02 -0.01 -0.02 -0.01 -0.00 -0.01 0.01 0.01 0.01 0.01 0.01 0.02 -0.00 -0.00 -0.03 -0.01 0.02 -0.01 0.02 -0.01 0.01 -0.02 0.00 -0.03 -0.01 -0.05 -0.00 -0.01 0.01 0.03 0.03 -0.04 0.00 0.01 -0.00 -0.05 0.07 0.08 -0.09 0.06 -0.05 0.01 -0.02 0.02 -0.00 -0.01 0.00 -0.02 0.01 0.03 0.03 -0.00 0.04 0.03 -0.02 0.03 0.01 -0.00 -0.00 -0.01 -0.02 0.00 -0.02 -0.03 -0.01 0.01 -0.01 -0.00 0.01 0.01 -0.01 0.01 0.01 0.01 0.00 0.00 0.03 0.05 -0.03 0.04 -0.00 0.03 -0.06 0.02 -0.03 0.01 0.04 -0.01 -0.10 0.02 -0.01 -0.12 -0.01 -0.01 -0.02 -0.01 -0.01 0.09 0.03 0.01 0.03 0.06 0.01 -0.08 -0.12 0.08 0.09 0.05 0.02 0.01 -0.09 -0.01 -0.02 0.03 -0.05 -0.05 -0.01 0.05 -0.16 -0.05 0.10 -0.01 0.01 -0.03 -0.16 -0.04 -0.01 -0.00 -0.03 -0.01 0.20 0.03 0.02 0.08 0.09 0.01 -0.10 0.23 0.19 -0.02 -0.30 -0.28 0.08 -0.37 0.41 0.26 0.06 0.02 0.01 0.04 0.06 0.02 0.08 0.01 0.01 -0.18 0.10 -0.06 -0.16 -0.13 -0.04 -0.03 0.01 0.00 -0.01 0.02 -0.00 -0.01 0.01 0.00 0.00 0.00 -0.01 -0.01 0.00 -0.01 -0.01 0.01 -0.01 -0.01 0.01 -0.01 -0.00 0.01 -0.00 -0.00 0.01 -0.01 -0.01 0.01 0.01 -0.01 0.00 0.01 -0.01 0.00 0.00 -0.01 0.00 0.01 -0.01 0.02 -0.01 -0.00 0.01 -0.01 -0.01 -0.04 0.13 0.01 0.04 -0.09 0.02 0.04 -0.11 0.01 0.00 0.02 -0.00 -0.03 0.12 -0.00 -0.01 0.01 0.01 0.04 -0.12 0.12 -0.07 -0.08 -0.05 -0.01 -0.01 -0.01 0.01 -0.01 -0.02 0.02 -0.03 -0.00 0.01 0.00 0.02 0.01 -0.03 0.03 0.06 -0.15 0.02 -0.01 0.05 -0.02 -0.08 0.27 -0.01 -0.02 0.03 0.01 0.05 -0.18 -0.04 -0.13 -0.08 0.27 0.10 -0.02 0.25 -0.24 -0.21 -0.07 -0.01 -0.02 -0.05 -0.05 -0.02 -0.07 0.01 -0.02 -0.29 0.26 0.07 -0.04 -0.27 -0.27 0.34 0.04 0.19 0.01 -0.01 0.01 -0.00 0.01 0.00 -0.01 0.00 0.01 -0.01 -0.01 0.01 -0.01 0.00 0.00 -0.01 0.00 0.01 -0.01 -0.00 0.01 0.00 -0.02 -0.01 -0.01 0.01 0.01 -0.01 0.01 -0.02 -0.01 0.00 -0.01 -0.01 0.00 -0.00 -0.01 -0.00 0.01 -0.02 0.00 0.02 -0.00 -0.01 0.03 0.00 0.02 -0.06 0.01 0.03 -0.08 0.01 0.01 -0.02 -0.00 -0.01 0.06 -0.00 -0.00 0.02 0.00 0.02 -0.05 0.02 -0.00 -0.01 -0.05 -0.01 -0.01 0.08 -0.01 0.04 0.00 0.00 0.04 -0.02 0.00 0.01 -0.04 0.00 0.03 0.02 0.03 -0.09 0.01 0.01 -0.01 -0.01 -0.03 0.13 -0.01 -0.02 0.06 0.00 0.02 -0.07 0.05 0.00 -0.04 0.03 -0.03 0.02 -0.00 0.02 -0.02 -0.09 0.01 -0.01 -0.04 -0.06 0.00 -0.05 -0.01 -0.01 0.48 -0.37 -0.02 0.18 0.41 0.38 -0.37 -0.06 -0.21 -0.01 -0.02 -0.03 -0.02 -0.03 -0.04 -0.01 -0.01 -0.04 -0.00 -0.03 -0.04 -0.02 -0.03 -0.05 -0.04 -0.01 -0.01 -0.01 -0.01 -0.03 -0.00 -0.01 -0.03 -0.02 -0.03 -0.06 -0.02 -0.00 -0.05 -0.03 0.00 -0.03 -0.04 0.00 0.00 -0.02 -0.04 -0.04 -0.14 -0.01 0.15 0.03 -0.04 -0.01 0.06 -0.05 -0.00 0.03 -0.05 -0.00 -0.00 -0.01 -0.00 0.02 0.04 0.01 0.06 0.04 0.01 0.08 -0.01 0.01 -0.01 0.08 -0.05 0.00 -0.01 0.00 0.05 0.16 0.15 -0.10 0.15 0.26 -0.23 -0.09 0.22 -0.20 -0.08 0.17 0.01 -0.08 -0.01 -0.04 -0.01 -0.01 0.00 0.07 0.00 0.07 0.07 0.02 0.12 -0.00 0.02 0.07 0.13 -0.00 -0.04 0.07 -0.06 -0.07 0.15 -0.08 0.00 0.02 0.03 -0.00 0.01 0.02 0.03 -0.05 0.02 -0.11 0.19 0.40 0.07 0.13 0.09 0.27 0.34 0.14 -0.01 -0.02 -0.02 -0.01 -0.05 -0.03 -0.01 -0.02 -0.02 -0.03 -0.01 -0.01 -0.01 -0.02 -0.03 0.00 -0.03 -0.02 -0.01 -0.02 -0.01 -0.03 -0.01 -0.01 -0.02 -0.04 -0.03 0.01 -0.03 -0.03 -0.02 -0.03 -0.02 -0.02 -0.06 -0.01 0.01 -0.04 -0.02 0.09 -0.10 0.01 -0.03 0.02 0.05 -0.07 0.09 -0.00 -0.02 0.09 -0.00 0.03 0.02 0.01 -0.01 -0.05 0.01 -0.07 -0.04 -0.02 -0.11 0.03 -0.03 0.00 0.07 -0.03 0.25 0.06 0.06 0.02 0.05 0.05 0.08 -0.12 0.00 0.16 -0.07 0.09 0.11 -0.21 -0.03 0.01 0.14 0.01 0.09 0.02 0.02 0.02 -0.10 0.03 -0.10 -0.10 -0.02 -0.17 0.03 -0.04 0.07 0.11 0.01 -0.00 0.07 -0.04 -0.04 0.13 -0.08 0.42 0.03 0.11 0.23 0.34 0.10 0.39 -0.06 0.08 0.03 0.00 0.12 0.04 0.11 0.08 0.02 0.11 0.00 -0.02 -0.02 0.02 -0.02 -0.04 0.02 0.00 -0.03 0.00 -0.01 -0.03 0.00 -0.02 -0.02 0.02 -0.01 -0.03 0.02 -0.01 -0.05 0.05 -0.04 -0.01 0.07 -0.02 -0.05 0.04 -0.02 -0.04 0.07 -0.00 -0.03 0.03 0.01 -0.00 -0.04 -0.03 -0.02 0.01 -0.07 0.09 -0.18 0.01 -0.01 -0.01 0.00 -0.01 0.02 0.00 -0.01 0.03 0.00 -0.00 0.02 0.01 0.01 -0.01 0.01 0.01 -0.01 0.00 -0.00 0.02 0.14 0.20 -0.08 0.01 -0.03 -0.00 0.01 -0.02 0.04 -0.15 0.02 -0.28 -0.14 0.07 -0.30 -0.00 0.31 -0.16 0.00 -0.01 0.02 -0.00 -0.00 0.02 0.01 0.02 -0.03 0.01 0.01 -0.03 0.01 -0.00 0.02 0.28 0.29 0.04 0.22 0.29 -0.05 0.06 0.28 -0.32 0.05 -0.07 -0.03 0.01 -0.01 -0.04 -0.02 0.02 -0.02 0.04 -0.06 0.05 0.03 0.02 0.05 -0.02 -0.03 0.02 -0.04 0.04 0.04 -0.08 0.02 0.04 -0.05 0.01 0.02 -0.03 0.02 0.02 -0.05 0.06 0.02 -0.05 0.05 0.01 -0.05 0.02 0.01 -0.06 -0.06 -0.06 -0.12 0.03 0.07 -0.09 0.02 0.02 -0.12 0.03 0.00 -0.11 0.02 -0.01 -0.08 0.09 0.00 0.15 -0.08 0.01 -0.01 -0.01 -0.02 0.10 -0.10 -0.00 0.05 -0.11 -0.01 -0.01 -0.02 -0.00 0.03 0.07 0.01 0.10 0.07 0.02 0.15 -0.03 0.02 0.08 0.01 -0.05 0.05 0.10 0.03 0.01 -0.08 -0.03 0.16 -0.20 -0.02 0.32 0.03 0.09 0.17 -0.24 -0.05 0.02 -0.16 -0.03 -0.10 -0.03 -0.01 -0.01 0.13 0.01 0.14 0.13 0.03 0.24 -0.02 0.03 0.08 -0.00 -0.09 0.20 0.05 0.03 0.10 -0.03 -0.17 0.16 0.05 0.03 0.04 0.27 0.05 0.13 0.07 0.02 0.09 -0.12 -0.12 0.06 -0.05 -0.08 -0.06 -0.22 0.02 -0.05 0.03 -0.03 -0.07 0.02 -0.03 -0.01 0.04 -0.03 -0.01 0.05 -0.02 -0.03 0.00 0.00 -0.01 -0.03 0.03 0.04 0.01 0.03 0.20 0.10 0.16 -0.11 0.05 -0.04 -0.08 -0.01 -0.02 -0.06 -0.04 -0.01 -0.04 -0.17 -0.08 -0.04 -0.02 0.01 -0.10 0.08 -0.10 -0.02 0.01 0.01 0.04 -0.04 -0.01 0.02 -0.04 -0.02 -0.01 -0.01 -0.01 0.01 0.02 0.01 0.04 0.02 0.02 0.06 -0.01 -0.01 -0.08 -0.13 0.02 0.10 0.06 0.04 0.06 0.01 0.00 -0.17 0.07 -0.17 -0.19 0.04 -0.20 -0.06 0.28 -0.08 0.00 -0.07 -0.02 -0.04 -0.01 -0.02 -0.01 0.04 0.03 0.05 0.04 0.04 0.10 -0.01 -0.01 -0.25 -0.21 -0.06 -0.10 -0.14 0.00 0.03 -0.24 0.15 0.23 0.04 0.08 0.08 0.30 0.08 0.22 -0.03 0.06 0.10 -0.06 0.06 0.14 0.10 -0.04 0.06 -0.02 0.03 -0.07 0.05 -0.08 0.01 -0.03 0.03 0.02 -0.01 -0.11 -0.03 0.02 -0.13 -0.07 0.05 -0.10 -0.03 -0.03 -0.03 0.02 0.01 -0.05 0.03 0.10 0.02 0.04 -0.05 0.02 -0.01 -0.14 0.36 0.00 -0.04 0.13 0.03 0.14 -0.04 -0.11 0.08 -0.12 0.03 -0.08 0.01 -0.01 -0.03 0.06 0.02 -0.01 -0.00 0.02 -0.00 -0.01 0.02 0.00 -0.01 0.02 0.01 0.02 0.02 0.01 0.01 0.03 0.01 -0.01 -0.14 0.03 -0.03 0.01 -0.09 -0.00 0.07 0.01 -0.06 -0.01 -0.05 -0.02 0.08 -0.07 0.12 0.09 -0.19 -0.06 0.02 -0.01 -0.01 0.01 0.01 -0.02 0.01 0.01 0.03 0.02 0.01 0.02 0.05 0.01 -0.02 -0.11 0.07 0.06 -0.33 -0.02 -0.16 -0.21 0.12 0.12 0.15 -0.30 -0.15 0.02 -0.09 -0.17 -0.14 0.16 -0.08 0.14 -0.08 -0.01 0.19 0.12 -0.14 0.07 -0.05 -0.02 -0.02 -0.09 -0.02 0.01 -0.03 -0.06 -0.02 -0.01 -0.01 -0.03 -0.10 -0.01 -0.06 -0.07 0.02 -0.08 -0.02 0.04 -0.01 0.00 0.06 0.15 0.02 0.14 0.05 -0.02 -0.12 0.03 0.04 -0.13 -0.05 0.06 -0.03 -0.08 0.23 0.04 -0.12 -0.11 0.03 0.13 -0.10 -0.14 0.03 -0.04 -0.02 -0.01 0.03 0.00 0.01 0.03 0.01 0.03 0.01 0.01 0.03 0.00 -0.00 0.00 -0.00 0.00 -0.01 0.02 0.01 -0.04 -0.03 -0.01 -0.06 -0.01 -0.01 -0.01 0.04 0.10 0.07 -0.35 -0.29 0.32 0.05 -0.16 0.23 -0.10 -0.20 0.02 0.05 0.03 0.05 0.01 0.01 0.03 -0.01 -0.01 -0.01 -0.02 0.00 -0.03 0.02 0.01 -0.04 -0.03 -0.02 -0.06 -0.05 -0.01 -0.04 -0.02 0.03 -0.18 0.09 0.04 -0.06 -0.14 0.03 -0.07 -0.07 0.02 -0.11 0.05 0.27 -0.03 0.04 0.13 0.10 0.21 0.05 -0.08 -0.04 -0.10 0.02 0.03 -0.09 -0.06 0.09 0.04 -0.02 0.15 0.10 0.06 -0.14 0.02 0.02 -0.14 -0.03 -0.05 -0.03 0.02 -0.05 -0.04 0.01 0.09 0.06 -0.24 0.09 -0.04 -0.02 0.11 -0.04 -0.01 0.10 0.14 0.06 0.24 -0.35 0.14 -0.06 -0.12 -0.05 -0.14 0.21 0.04 0.06 -0.09 0.00 0.02 -0.10 -0.03 -0.06 -0.03 -0.02 -0.03 0.02 0.02 0.04 0.02 0.01 0.09 -0.07 -0.02 0.03 -0.03 -0.01 0.06 -0.09 -0.00 0.01 0.04 -0.00 -0.07 -0.10 -0.06 -0.11 -0.15 -0.08 -0.05 -0.06 -0.04 -0.02 -0.17 -0.07 -0.12 -0.03 -0.05 -0.06 0.06 0.03 0.08 0.10 0.02 0.15 -0.06 -0.03 -0.02 -0.09 -0.16 0.18 -0.05 0.11 0.10 -0.11 -0.06 0.05 -0.07 0.01 0.07 -0.13 -0.01 0.06 -0.11 0.01 0.01 -0.04 0.16 0.08 0.14 0.01 0.06 0.13 -0.04 -0.06 -0.04 -0.06 0.02 0.03 -0.05 -0.03 -0.01 -0.02 -0.06 -0.03 -0.04 -0.06 -0.04 -0.01 0.02 0.00 0.06 -0.02 -0.04 0.03 -0.06 -0.05 0.01 0.15 -0.02 -0.11 0.03 0.12 0.03 0.10 0.03 0.06 0.14 -0.11 -0.03 -0.13 -0.09 0.01 0.06 0.01 0.00 -0.08 -0.05 -0.02 -0.02 -0.01 -0.00 0.03 -0.03 0.17 0.08 0.05 -0.14 0.07 0.04 0.01 0.01 0.00 0.17 0.03 0.08 -0.14 -0.03 -0.00 -0.04 -0.05 0.12 0.03 -0.01 0.02 0.01 0.05 -0.08 -0.04 0.13 0.08 -0.02 0.09 0.04 -0.01 0.03 -0.03 0.36 0.07 0.10 -0.34 0.08 0.04 -0.01 -0.03 -0.07 0.34 0.09 0.13 -0.33 -0.03 -0.00 -0.03 -0.04 -0.01 -0.04 -0.03 -0.00 -0.02 -0.11 0.15 0.04 -0.05 0.04 0.01 -0.12 0.13 0.04 -0.05 -0.01 0.14 0.03 0.05 -0.01 0.07 0.09 -0.00 -0.05 -0.04 -0.06 0.01 0.02 -0.04 -0.03 0.01 -0.02 -0.05 -0.03 -0.02 -0.04 -0.04 -0.01 0.01 0.00 0.04 -0.02 -0.02 0.02 -0.04 -0.04 0.00 0.12 -0.01 -0.11 0.02 0.09 0.04 0.08 0.03 0.05 0.11 -0.09 -0.02 -0.08 -0.10 0.01 0.05 0.01 0.00 -0.06 -0.04 -0.01 -0.01 0.00 -0.02 0.05 0.05 -0.17 0.02 -0.03 0.18 0.05 0.03 0.01 0.04 0.07 -0.16 -0.01 -0.01 0.18 -0.04 -0.01 -0.03 -0.04 0.10 0.02 0.01 0.01 0.02 0.04 -0.07 -0.03 0.10 0.06 -0.02 0.07 0.02 -0.01 0.08 0.12 -0.34 -0.02 -0.09 0.40 0.05 0.02 0.02 0.05 0.10 -0.36 -0.01 -0.06 0.41 -0.04 -0.02 -0.05 -0.05 -0.04 -0.02 -0.04 -0.01 -0.00 -0.07 0.11 0.02 -0.04 0.04 0.00 -0.10 0.12 0.02 -0.01 -0.02 0.13 0.04 0.07 0.02 0.05 0.09 -0.01 -0.08 -0.16 -0.08 -0.05 0.01 -0.09 0.02 0.11 0.03 0.04 -0.04 0.05 0.06 -0.19 0.01 0.01 0.06 -0.02 -0.01 0.13 -0.03 0.00 0.03 -0.12 0.04 0.08 -0.34 -0.10 0.02 0.21 -0.04 0.04 0.04 -0.02 -0.05 -0.02 0.12 -0.38 0.10 0.05 0.05 -0.02 0.14 0.04 0.01 0.03 0.02 -0.01 -0.06 -0.00 0.01 -0.07 -0.01 -0.02 -0.09 -0.06 -0.03 -0.04 -0.06 0.00 -0.02 -0.05 -0.03 0.04 -0.02 0.03 -0.05 0.10 0.03 -0.02 -0.03 0.08 0.05 -0.02 -0.05 0.10 0.10 -0.04 0.07 0.06 -0.03 -0.09 -0.06 0.03 -0.02 -0.01 -0.03 -0.09 -0.05 -0.04 -0.02 -0.04 0.05 -0.08 -0.05 -0.03 -0.02 -0.08 -0.12 0.11 -0.08 0.10 0.10 -0.09 0.07 0.06 -0.04 -0.07 -0.05 0.17 -0.05 -0.11 0.25 -0.03 -0.06 -0.10 0.30 0.01 0.08 0.15 0.04 0.15 -0.01 -0.03 0.08 0.00 -0.05 -0.02 0.02 -0.03 -0.17 -0.10 0.03 0.05 -0.10 -0.01 0.04 -0.03 0.03 -0.08 0.06 0.04 -0.23 0.02 -0.06 -0.06 0.14 0.04 -0.17 0.20 -0.01 0.17 -0.07 0.04 0.06 0.06 0.07 0.01 -0.01 -0.11 0.15 -0.09 0.01 -0.07 0.02 0.18 0.13 0.07 0.07 -0.01 0.04 -0.08 -0.03 -0.03 -0.12 -0.03 -0.04 -0.15 -0.09 -0.01 -0.03 -0.08 -0.04 0.01 -0.10 -0.04 -0.08 -0.00 -0.11 -0.08 0.19 0.03 0.03 0.02 -0.04 0.01 -0.07 0.01 0.02 -0.07 0.04 0.02 -0.08 0.01 -0.13 -0.13 -0.09 -0.08 -0.02 -0.06 -0.17 -0.07 0.01 0.02 0.01 -0.04 -0.06 -0.10 -0.08 -0.03 0.06 0.06 -0.16 0.07 -0.20 -0.13 0.06 -0.15 -0.16 0.28 0.09 -0.09 0.13 0.06 -0.10 0.11 0.06 0.08 -0.01 -0.08 0.10 0.05 -0.13 0.02 -0.08 0.03 -0.03 -0.03 0.21 0.03 0.06 0.12 -0.10 0.04 -0.04 -0.06 -0.09 0.02 -0.01 -0.00 -0.03 -0.02 -0.05 -0.15 -0.04 0.10 -0.13 0.14 0.13 -0.04 0.06 0.03 0.14 0.04 0.05 0.02 0.11 0.02 -0.06 0.11 -0.05 0.05 0.01 0.31 -0.17 -0.06 -0.11 -0.04 -0.00 0.03 -0.00 0.01 -0.02 0.05 0.00 -0.01 -0.01 -0.01 0.00 -0.02 -0.01 -0.01 0.03 0.01 0.00 -0.02 0.01 -0.01 -0.01 -0.06 0.03 -0.13 -0.00 0.05 0.00 -0.09 -0.16 0.20 -0.01 -0.05 0.03 -0.06 -0.13 0.01 -0.12 -0.23 -0.04 0.00 -0.01 -0.05 -0.01 0.01 -0.07 -0.02 -0.01 0.05 0.02 0.03 -0.05 0.02 -0.00 -0.05 0.01 0.05 -0.15 0.02 0.05 -0.08 -0.09 0.06 -0.25 -0.02 0.05 -0.01 0.00 0.02 -0.00 -0.02 0.08 -0.00 -0.07 -0.13 0.08 -0.12 -0.22 0.18 -0.14 -0.27 0.25 0.01 -0.02 -0.02 0.01 -0.01 -0.02 0.02 -0.01 0.00 -0.01 -0.02 -0.01 -0.02 -0.00 -0.00 -0.01 0.03 0.02 0.00 0.01 0.01 -0.01 -0.01 -0.01 0.01 -0.01 -0.03 0.00 -0.01 0.00 -0.01 0.00 0.00 -0.01 -0.01 -0.01 -0.05 -0.03 0.01 0.02 0.04 0.01 -0.00 0.01 -0.03 -0.04 -0.08 0.31 0.01 0.01 -0.04 0.02 0.04 -0.13 -0.02 -0.05 0.20 0.01 0.04 -0.13 0.00 0.01 -0.02 0.00 -0.00 0.02 0.00 -0.02 -0.00 0.01 0.01 -0.01 0.02 0.01 -0.00 0.04 0.06 0.00 0.03 0.05 0.01 0.04 0.08 -0.34 0.05 0.11 -0.44 -0.03 -0.08 0.32 0.05 0.11 -0.46 0.04 0.08 -0.33 -0.00 -0.00 0.03 -0.02 -0.01 0.00 -0.00 0.00 0.04 -0.00 -0.02 -0.01 0.00 -0.03 -0.01 -0.00 -0.01 -0.00 0.00 0.01 0.01 0.00 0.02 0.01 0.01 0.04 -0.03 -0.01 -0.00 0.00 -0.12 -0.06 0.02 0.08 -0.10 0.00 0.11 0.10 0.06 0.20 -0.11 -0.03 0.11 -0.11 -0.12 0.15 -0.15 -0.11 0.01 0.08 0.02 -0.07 -0.11 0.05 -0.12 0.08 0.06 -0.05 0.06 -0.01 -0.06 0.10 0.03 0.45 -0.19 0.03 -0.04 -0.09 -0.02 -0.10 -0.07 -0.03 -0.07 -0.01 0.03 0.03 0.02 0.00 0.06 0.02 -0.00 0.06 0.03 0.04 -0.01 0.04 -0.01 -0.04 0.06 0.01 0.05 -0.01 0.04 -0.09 0.19 0.03 0.00 -0.02 0.00 -0.01 0.10 0.08 -0.19 -0.22 0.01 -0.10 -0.12 0.01 0.07 0.09 -0.01 0.04 0.02 -0.04 0.08 0.01 0.04 -0.04 -0.01 -0.07 0.00 0.07 -0.02 0.07 0.03 0.15 0.02 0.06 -0.01 0.03 0.01 -0.00 -0.03 0.14 0.00 -0.10 0.28 0.02 -0.08 0.22 0.01 0.05 -0.04 -0.04 0.02 0.00 -0.01 -0.04 -0.07 0.01 -0.16 -0.08 -0.00 0.00 -0.13 0.02 0.19 -0.15 -0.00 -0.04 -0.01 -0.09 -0.12 0.00 -0.09 0.02 0.10 0.01 0.18 -0.02 -0.07 -0.00 0.08 -0.08 0.07 -0.15 -0.05 0.03 0.01 -0.09 -0.01 0.03 -0.04 -0.02 -0.02 0.01 -0.21 0.04 -0.12 0.08 0.12 0.03 -0.08 0.10 0.06 0.03 -0.02 -0.03 0.02 -0.04 -0.01 -0.02 -0.01 0.01 -0.01 0.01 -0.02 0.01 0.01 0.01 0.03 -0.04 -0.00 0.07 0.00 0.13 -0.00 -0.03 -0.03 -0.06 -0.11 0.11 0.08 0.09 0.00 0.12 0.16 0.02 0.11 0.14 0.02 -0.00 -0.08 0.00 -0.05 -0.02 0.05 -0.02 0.03 -0.02 0.03 0.03 0.04 0.06 -0.04 0.03 0.10 0.09 0.41 -0.17 0.08 -0.08 -0.00 0.10 0.24 -0.09 0.04 -0.00 0.00 -0.12 0.00 -0.02 -0.06 -0.01 -0.03 -0.20 0.23 0.06 -0.02 0.02 -0.01 -0.16 0.18 -0.16 0.07 -0.01 0.03 0.13 0.03 0.12 0.11 0.07 -0.00 0.06 -0.08 -0.13 0.04 0.01 -0.06 -0.14 0.02 0.05 0.01 -0.01 -0.06 0.00 -0.08 0.00 0.22 -0.12 0.01 0.04 -0.06 0.03 -0.04 0.02 0.04 0.01 -0.00 -0.17 0.17 -0.05 -0.12 -0.19 -0.08 0.08 -0.07 -0.01 -0.01 0.02 0.02 -0.02 0.03 0.00 0.00 -0.00 -0.01 -0.00 -0.02 0.01 0.00 -0.01 -0.01 -0.01 0.02 0.01 0.12 0.02 0.19 0.00 0.04 0.00 -0.01 0.01 0.01 -0.19 -0.23 -0.16 -0.15 -0.20 -0.14 -0.06 -0.09 -0.10 -0.02 0.04 -0.01 0.03 0.01 -0.03 -0.01 -0.02 0.01 -0.00 -0.02 -0.05 -0.04 0.02 -0.02 0.04 -0.02 0.17 0.06 -0.02 0.17 0.16 -0.02 0.34 -0.01 0.09 0.04 -0.00 0.07 0.04 0.05 -0.03 0.02 0.06 -0.11 0.11 0.18 0.13 -0.18 0.06 -0.11 0.14 0.20 -0.05 -0.04 0.12 -0.04 0.01 0.04 -0.08 0.06 -0.06 -0.11 0.02 -0.05 0.03 -0.06 -0.13 0.03 -0.08 -0.06 0.03 -0.01 0.06 0.02 0.02 0.18 -0.09 0.05 0.04 0.05 0.09 -0.05 0.05 -0.01 -0.04 -0.10 -0.03 -0.02 -0.03 -0.03 -0.10 -0.13 -0.06 -0.04 0.07 0.02 0.02 -0.01 -0.01 0.02 -0.02 -0.00 -0.01 0.02 0.01 -0.01 0.01 -0.01 -0.01 0.00 0.01 0.02 -0.04 -0.01 0.09 0.00 0.14 -0.04 0.10 0.02 0.06 0.08 -0.11 -0.05 -0.20 -0.04 0.03 -0.05 0.02 -0.13 -0.31 -0.09 0.01 -0.05 -0.01 -0.03 0.01 0.02 -0.01 0.00 -0.01 0.01 0.03 0.03 0.03 -0.04 0.00 0.19 0.08 0.27 0.07 0.07 0.10 0.02 0.08 0.06 -0.11 0.08 -0.03 -0.03 -0.02 -0.03 -0.17 0.22 -0.00 -0.04 0.23 -0.20 -0.15 -0.07 0.10 0.03 0.26 -0.27 0.01 -0.00 -0.01 -0.00 -0.02 0.01 -0.01 -0.02 0.02 -0.02 -0.01 0.01 0.00 -0.00 -0.02 -0.00 0.02 -0.03 -0.01 -0.00 0.00 0.01 0.00 0.01 0.01 -0.03 0.01 0.00 0.00 0.01 0.01 0.01 -0.02 0.00 -0.01 0.01 0.02 -0.02 -0.01 0.00 0.00 -0.00 -0.02 0.03 0.01 -0.08 0.10 0.02 -0.31 0.04 -0.02 -0.08 -0.34 -0.09 0.08 -0.11 -0.01 0.34 -0.06 0.02 0.08 0.29 0.08 0.01 -0.00 0.02 -0.00 0.00 0.00 0.01 0.01 -0.01 0.02 0.01 0.02 0.01 0.01 0.02 -0.02 -0.04 -0.00 -0.22 0.20 0.02 0.08 -0.33 -0.08 -0.16 0.25 0.05 0.27 -0.21 -0.03 -0.08 0.29 0.06 0.03 0.01 0.04 0.03 0.02 0.02 0.00 0.01 -0.01 -0.01 -0.00 -0.01 -0.00 -0.01 -0.01 -0.02 0.02 -0.00 0.01 0.02 -0.02 -0.00 0.01 0.00 -0.00 0.02 -0.03 0.20 -0.06 0.08 0.09 0.07 -0.06 0.11 0.04 -0.12 0.09 0.00 0.03 -0.03 -0.00 0.16 -0.04 -0.08 0.18 0.14 -0.02 -0.10 -0.06 0.07 -0.15 0.03 0.09 -0.01 0.03 0.02 -0.06 -0.13 -0.07 0.31 -0.06 0.01 -0.12 -0.10 -0.00 0.16 -0.04 -0.07 0.00 -0.05 0.05 0.01 -0.02 -0.00 -0.00 -0.02 -0.01 -0.01 -0.00 -0.04 -0.01 0.02 0.00 0.00 0.02 0.01 0.00 0.00 0.02 0.01 -0.05 0.00 -0.14 -0.01 0.01 0.00 0.01 -0.05 0.07 -0.18 -0.20 -0.18 -0.05 -0.04 -0.11 0.11 0.16 -0.03 0.00 0.02 0.01 -0.02 -0.04 -0.00 -0.01 0.03 0.01 0.01 -0.01 0.01 0.01 0.02 0.02 -0.15 -0.03 -0.12 -0.22 -0.04 -0.26 -0.03 -0.01 0.06 -0.06 0.08 0.05 -0.01 -0.02 0.03 -0.01 -0.04 0.03 -0.10 0.09 -0.00 -0.21 -0.20 0.29 -0.03 0.10 -0.07 -0.11 0.06 -0.02 0.09 -0.05 0.09 0.08 -0.10 -0.08 0.12 0.16 0.03 0.03 -0.08 0.23 -0.15 0.07 0.04 -0.08 0.05 -0.03 0.03 0.01 -0.03 0.16 -0.14 0.16 0.08 0.02 0.03 0.00 0.11 -0.13 -0.03 -0.09 0.01 0.10 -0.27 0.33 -0.05 -0.03 -0.01 0.01 -0.02 -0.00 -0.02 -0.01 -0.00 0.00 -0.01 -0.00 0.01 -0.02 -0.00 0.02 0.01 0.00 -0.02 0.01 0.00 -0.02 0.02 0.00 -0.03 -0.02 -0.09 0.03 -0.02 -0.00 -0.01 0.03 -0.02 -0.03 -0.24 -0.08 0.17 0.13 0.02 -0.01 -0.15 -0.07 0.02 0.02 -0.01 -0.01 -0.01 -0.02 0.02 0.01 -0.01 -0.03 -0.02 -0.02 -0.01 0.03 -0.01 0.03 0.05 0.08 -0.14 0.05 -0.21 -0.10 0.07 -0.11 -0.09 0.00 -0.04 0.04 -0.22 -0.05 -0.09 0.05 -0.01 0.08 -0.10 0.08 0.19 0.18 -0.22 0.05 -0.09 0.11 -0.02 0.00 -0.02 -0.02 -0.04 0.02 -0.02 -0.03 0.01 -0.01 0.02 0.06 -0.01 0.00 0.04 -0.02 0.01 0.01 0.02 -0.01 -0.05 0.02 0.04 -0.03 -0.01 -0.07 0.05 0.01 0.01 -0.03 0.00 -0.01 0.05 0.02 -0.00 -0.01 0.07 -0.13 0.12 -0.00 0.00 0.00 -0.11 -0.09 -0.04 0.22 0.15 0.05 -0.06 0.24 0.07 -0.06 0.25 0.04 -0.23 -0.15 -0.05 0.21 -0.16 -0.03 0.18 -0.12 -0.00 -0.01 -0.00 -0.00 0.01 -0.01 -0.01 0.00 0.02 -0.02 0.00 -0.03 -0.01 0.03 0.03 0.02 0.00 -0.02 -0.01 -0.17 0.04 0.01 0.31 0.28 0.08 -0.23 -0.16 -0.03 0.37 0.14 0.06 -0.07 -0.14 -0.01 0.04 0.02 -0.01 0.05 0.03 0.03 -0.02 0.00 -0.11 -0.02 0.02 0.01 0.01 -0.04 0.00 0.00 -0.03 0.01 0.02 -0.00 -0.01 0.04 0.04 -0.05 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 -0.00 0.01 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 -0.00 -0.00 0.00 0.00 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 0.02 -0.09 -0.01 -0.02 0.08 0.02 0.03 -0.14 -0.00 -0.02 0.08 0.01 0.04 -0.14 -0.01 -0.02 0.06 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.05 -0.12 0.48 -0.02 -0.03 0.11 -0.06 -0.14 0.60 -0.02 -0.03 0.14 -0.05 -0.12 0.50 -0.00 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 0.01 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.01 -0.00 -0.00 -0.00 0.01 -0.01 -0.01 -0.00 0.00 -0.00 0.00 -0.06 0.00 -0.05 -0.11 -0.12 0.05 -0.16 -0.06 0.11 -0.05 0.01 0.12 -0.04 0.01 0.01 -0.06 0.04 0.00 0.02 -0.00 -0.16 0.07 0.13 -0.08 -0.08 -0.20 0.15 0.02 0.03 -0.11 0.02 -0.06 0.24 0.10 0.02 -0.04 0.05 -0.24 0.14 -0.00 0.03 0.01 0.06 -0.01 -0.01 -0.03 -0.02 -0.01 0.01 -0.04 0.00 0.01 -0.04 -0.02 0.04 0.02 0.01 -0.04 0.03 -0.01 -0.04 0.02 0.00 -0.01 -0.01 0.07 0.02 -0.04 -0.02 0.02 0.06 -0.09 0.02 -0.06 -0.00 0.14 0.12 0.07 0.03 -0.07 -0.03 0.02 -0.02 0.02 -0.05 -0.04 -0.02 0.04 0.01 0.05 -0.08 -0.03 0.00 -0.00 0.01 0.05 0.19 0.05 -0.01 0.33 0.08 0.31 -0.05 0.00 -0.38 -0.05 0.08 0.06 0.02 -0.09 0.03 0.06 -0.16 0.03 0.05 0.02 -0.06 0.10 0.12 -0.16 0.04 0.04 -0.06 0.04 0.03 0.03 -0.09 -0.02 0.14 0.04 -0.03 -0.02 -0.10 -0.14 -0.06 -0.00 -0.14 0.07 0.05 -0.08 0.11 0.03 0.15 0.03 0.01 0.03 -0.11 -0.23 -0.04 0.36 -0.09 -0.03 -0.02 0.07 -0.06 -0.12 0.05 0.05 0.07 -0.15 -0.13 0.05 0.02 -0.02 0.03 -0.01 0.02 0.00 -0.00 -0.01 0.03 0.00 -0.00 -0.02 -0.00 -0.00 0.00 0.00 0.01 -0.02 0.01 0.00 0.00 0.01 -0.01 -0.02 -0.00 -0.01 -0.03 -0.05 0.04 -0.00 0.06 0.09 -0.10 -0.15 -0.08 -0.16 -0.10 -0.05 -0.17 0.17 0.35 0.04 -0.00 -0.02 0.01 -0.02 -0.03 0.09 -0.01 -0.01 0.09 0.00 -0.01 0.11 0.01 -0.02 0.02 -0.00 0.02 0.10 -0.14 0.02 -0.15 -0.05 0.05 0.04 0.09 0.02 0.04 -0.07 0.29 0.06 0.10 -0.05 0.00 0.05 0.13 -0.17 0.04 0.08 -0.10 0.05 0.12 -0.13 -0.01 0.00 -0.00 0.01 0.00 -0.01 -0.00 0.00 0.00 0.01 0.01 0.01 0.00 0.01 -0.00 -0.00 0.01 -0.01 -0.00 -0.01 -0.00 -0.00 -0.00 0.01 0.02 0.01 -0.04 0.01 0.00 0.00 -0.01 0.01 0.01 -0.00 -0.00 -0.01 0.01 0.02 -0.01 -0.00 0.00 -0.00 0.00 -0.00 -0.01 -0.02 -0.04 0.18 0.01 0.03 -0.10 -0.00 0.00 0.01 0.01 0.03 -0.13 0.00 -0.00 0.01 0.01 0.03 -0.10 0.00 0.00 0.00 0.01 -0.00 0.00 -0.01 -0.01 0.01 0.01 0.01 0.01 0.01 0.01 0.02 -0.01 -0.03 -0.00 -0.01 -0.01 0.08 -0.05 -0.13 0.55 -0.06 -0.12 0.47 -0.06 -0.14 0.56 -0.01 -0.02 0.08 0.00 -0.00 -0.01 0.01 -0.00 0.01 0.00 -0.00 -0.00 -0.01 -0.00 -0.00 0.01 -0.03 -0.01 -0.01 0.00 -0.00 -0.00 -0.02 0.02 0.00 0.00 -0.00 -0.00 -0.02 0.02 -0.11 0.06 -0.00 0.18 -0.02 0.12 -0.06 0.02 0.03 -0.05 -0.07 -0.07 0.12 -0.10 -0.07 0.15 -0.11 -0.01 -0.09 0.10 0.03 0.02 -0.02 -0.01 0.29 -0.07 0.09 0.11 0.04 -0.04 -0.14 0.03 0.13 -0.14 -0.03 -0.07 0.13 0.09 -0.16 0.07 -0.00 0.01 -0.01 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.01 -0.00 -0.00 0.01 -0.00 -0.00 -0.02 0.00 0.01 0.03 0.03 -0.00 -0.03 0.05 -0.03 -0.02 0.21 0.02 -0.24 -0.21 -0.11 0.06 0.28 0.10 -0.00 -0.01 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.01 0.01 0.00 0.01 0.00 -0.01 0.01 0.03 0.02 -0.01 0.05 0.02 0.06 -0.04 0.02 -0.09 -0.19 0.14 0.01 0.04 -0.26 -0.02 -0.12 0.04 0.03 0.09 -0.08 -0.01 0.18 0.17 -0.27 0.01 -0.14 0.14 0.03 0.00 -0.01 -0.08 -0.15 -0.04 0.10 -0.10 -0.06 0.15 0.14 -0.08 0.11 0.03 -0.12 -0.05 0.05 -0.03 -0.28 0.30 0.17 0.04 -0.08 0.00 -0.09 -0.13 -0.07 -0.06 -0.01 -0.10 0.03 -0.17 0.21 0.10 0.05 -0.02 0.18 0.06 -0.13 -0.06 -0.03 -0.02 -0.02 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.01 -0.01 0.00 0.01 -0.00 -0.01 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.01 0.06 -0.03 0.01 -0.06 0.07 -0.02 -0.02 -0.05 0.07 -0.04 -0.12 -0.04 0.04 0.04 0.01 -0.05 -0.13 -0.05 -0.00 0.01 0.05 0.01 -0.00 0.05 -0.01 -0.01 0.01 0.01 0.00 -0.03 -0.00 0.02 -0.04 0.07 0.04 0.28 -0.18 0.02 -0.20 -0.02 0.08 0.16 0.01 0.15 0.10 -0.08 0.27 0.09 0.10 -0.12 0.03 0.01 -0.04 -0.01 -0.05 -0.11 0.06 -0.08 -0.15 0.12 -0.04 0.05 0.04 0.01 0.20 0.04 0.07 -0.01 -0.05 -0.10 -0.12 -0.02 0.09 -0.13 0.03 -0.06 0.08 -0.10 -0.03 -0.08 -0.03 -0.00 -0.02 0.05 -0.11 0.30 0.02 -0.03 0.01 -0.04 -0.00 -0.04 0.11 0.02 0.01 -0.02 0.20 -0.14 0.05 -0.01 0.07 -0.03 -0.00 0.01 0.00 -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 0.00 -0.00 0.01 -0.01 -0.01 0.06 -0.02 -0.01 -0.01 -0.06 -0.02 -0.01 0.04 -0.01 0.18 0.04 0.14 0.22 0.19 0.20 -0.13 -0.35 -0.07 -0.00 -0.00 -0.04 0.00 0.01 -0.04 0.00 0.01 -0.01 0.01 0.00 0.03 0.01 -0.02 0.04 0.02 0.03 0.26 -0.21 0.03 -0.24 -0.01 0.08 0.20 0.13 -0.08 0.02 -0.03 0.15 0.04 0.15 -0.14 -0.01 0.04 0.01 -0.04 0.07 0.08 -0.11 -0.00 -0.03 0.04 -0.00 -0.00 -0.00 0.00 -0.01 -0.01 0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 0.01 -0.00 0.00 -0.00 0.00 -0.00 0.01 0.01 0.00 -0.00 -0.00 0.01 -0.01 -0.01 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.01 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.01 -0.02 0.07 -0.01 -0.02 0.07 0.00 -0.00 0.00 0.01 0.02 -0.06 0.01 0.02 -0.08 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.01 0.00 -0.00 -0.01 -0.01 -0.01 0.00 0.01 0.00 0.05 0.12 -0.51 0.05 0.11 -0.44 0.00 0.01 -0.04 -0.05 -0.10 0.43 -0.06 -0.12 0.52 0.00 -0.00 0.00 -0.01 -0.00 -0.00 -0.00 0.00 -0.01 -0.00 0.00 0.00 -0.00 0.01 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.01 -0.00 -0.00 0.00 0.05 -0.01 0.02 -0.08 -0.08 0.15 -0.01 0.13 -0.00 0.01 0.06 -0.10 0.03 -0.12 -0.14 -0.06 0.05 0.02 0.06 -0.03 0.03 -0.03 -0.02 0.02 -0.18 -0.07 0.25 0.03 0.04 -0.02 -0.00 0.07 0.02 0.01 -0.02 -0.00 0.08 -0.18 -0.12 -0.06 0.00 0.01 -0.00 -0.01 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.01 0.00 0.00 0.01 -0.00 -0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 -0.00 0.01 0.08 -0.00 0.06 -0.02 -0.01 0.03 -0.00 0.02 -0.06 -0.29 -0.11 0.21 0.20 0.03 0.05 -0.13 -0.10 0.01 0.02 -0.03 0.01 0.01 -0.02 -0.00 -0.01 0.01 -0.00 -0.01 0.03 0.00 -0.01 0.03 -0.25 -0.10 -0.32 0.01 -0.13 0.08 0.17 -0.11 0.27 -0.13 0.07 -0.00 0.07 -0.29 -0.03 -0.07 -0.03 0.02 0.02 0.09 -0.15 -0.08 -0.12 0.07 -0.06 -0.03 -0.02 0.06 -0.02 0.00 0.03 0.15 0.04 -0.08 -0.06 0.02 0.07 0.15 -0.15 0.00 -0.13 -0.05 -0.01 -0.03 0.05 -0.06 -0.03 -0.07 0.02 0.01 0.01 -0.00 0.17 0.05 -0.01 -0.00 0.01 -0.00 0.02 -0.02 -0.01 -0.00 0.00 -0.25 0.10 -0.19 0.02 0.04 0.06 -0.01 -0.01 0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.01 -0.00 0.01 0.00 -0.01 -0.00 -0.00 0.00 -0.00 -0.01 0.00 0.00 0.00 -0.02 -0.06 0.08 -0.02 -0.04 -0.01 0.02 -0.05 0.01 -0.06 -0.13 -0.09 0.12 0.14 -0.03 0.15 0.16 0.00 0.02 0.04 -0.02 0.01 0.01 -0.01 -0.01 -0.01 0.01 0.00 -0.00 0.02 0.00 0.00 0.01 0.30 0.11 0.25 0.21 0.16 0.19 -0.15 0.08 -0.36 0.12 -0.09 0.00 -0.03 0.14 0.02 0.10 -0.07 -0.02 -0.09 0.02 0.09 -0.10 -0.08 0.20 0.04 0.15 -0.12 -0.01 -0.09 -0.07 0.09 0.01 0.21 0.03 0.05 -0.00 0.03 0.08 0.03 -0.11 0.04 -0.01 0.02 -0.00 -0.07 -0.01 -0.01 0.01 -0.01 -0.01 0.02 0.13 -0.04 0.24 -0.00 -0.02 -0.04 0.00 -0.09 0.00 -0.02 0.02 -0.00 -0.04 -0.28 0.14 0.04 0.03 -0.04 0.01 -0.01 -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 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.01 0.02 -0.04 -0.05 0.04 -0.02 0.02 -0.07 -0.05 0.16 0.30 0.17 -0.08 -0.09 0.08 -0.14 -0.09 0.04 0.01 0.01 -0.02 0.00 -0.00 0.01 -0.00 -0.01 0.03 -0.01 -0.01 0.00 -0.00 0.01 -0.02 -0.09 -0.02 -0.11 -0.06 -0.03 -0.06 0.02 -0.01 0.05 0.03 0.10 0.07 -0.07 0.25 0.08 0.09 -0.09 0.01 -0.17 -0.07 0.29 -0.05 0.03 0.19 0.15 0.33 -0.26 -0.00 0.00 0.00 0.00 0.01 -0.01 0.00 -0.00 0.00 -0.01 0.00 0.01 -0.00 0.01 -0.01 0.00 0.00 0.00 0.01 0.00 0.00 -0.00 -0.00 -0.00 0.01 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.05 -0.07 0.03 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.01 0.02 -0.06 -0.01 -0.02 0.10 0.00 0.00 -0.00 0.01 0.02 -0.10 -0.00 0.00 -0.01 -0.01 -0.02 0.10 -0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 0.00 0.01 -0.01 -0.01 -0.01 -0.00 -0.00 -0.01 0.01 0.01 0.00 0.06 0.12 -0.55 -0.00 -0.00 0.01 -0.06 -0.14 0.56 -0.01 -0.02 0.07 0.06 0.12 -0.51 0.01 0.00 0.02 -0.01 0.00 -0.02 -0.01 0.01 -0.02 0.00 -0.00 -0.00 0.00 -0.01 -0.00 -0.00 0.00 -0.00 0.01 0.02 -0.04 -0.01 -0.02 0.01 -0.02 -0.03 0.02 -0.01 -0.02 0.00 0.00 -0.07 -0.01 -0.01 0.04 -0.01 0.09 -0.06 -0.05 0.06 -0.04 0.12 -0.01 0.01 -0.02 -0.02 -0.02 -0.03 0.00 0.00 0.01 -0.04 -0.09 0.08 -0.01 -0.01 -0.01 0.01 -0.01 0.01 0.01 0.01 0.00 -0.38 0.61 -0.22 -0.01 0.02 -0.03 -0.03 0.02 0.01 0.00 0.00 -0.01 -0.00 -0.00 0.01 -0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.01 -0.00 0.05 0.03 -0.02 0.01 -0.00 -0.02 0.00 -0.06 0.09 0.04 0.08 0.06 0.05 0.09 -0.09 -0.17 -0.03 0.01 0.02 -0.08 0.00 0.00 -0.01 -0.01 -0.01 0.08 0.00 -0.00 0.01 0.01 0.01 -0.07 -0.09 -0.05 -0.21 0.12 -0.07 0.17 0.11 -0.08 0.08 0.02 0.00 0.01 -0.03 0.10 0.02 0.03 -0.01 -0.00 -0.02 -0.11 0.19 0.12 0.19 -0.09 0.13 0.12 -0.05 -0.00 0.02 0.01 0.14 -0.04 -0.00 -0.01 0.03 0.02 0.01 -0.01 -0.00 0.02 0.00 -0.05 -0.05 0.02 0.03 0.05 -0.04 -0.01 -0.01 0.01 0.00 0.37 -0.13 -0.11 -0.01 -0.05 -0.01 0.02 -0.09 -0.04 -0.02 0.02 0.01 0.15 -0.11 0.02 -0.03 0.03 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.04 0.03 0.00 -0.10 0.03 -0.01 -0.02 0.05 0.04 -0.07 -0.21 -0.09 0.18 0.20 0.02 0.10 0.01 -0.05 0.00 -0.00 0.02 -0.00 -0.00 0.01 -0.00 0.01 -0.02 0.00 0.00 -0.01 -0.00 -0.00 0.01 -0.04 -0.02 -0.20 0.11 -0.03 0.15 0.02 -0.06 -0.09 0.16 -0.01 0.06 -0.14 0.48 0.09 0.15 -0.05 -0.02 0.12 0.02 -0.17 0.04 -0.02 -0.16 -0.10 -0.25 0.20 -0.06 -0.04 -0.04 -0.01 0.06 0.05 0.01 -0.02 0.03 0.02 -0.05 0.12 0.09 0.07 -0.10 -0.02 0.03 0.04 0.06 0.01 0.04 -0.01 -0.01 -0.00 0.01 0.06 0.02 -0.00 0.01 -0.00 0.00 0.00 -0.01 -0.01 -0.00 -0.00 0.27 0.38 -0.23 -0.07 -0.02 0.06 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.01 0.00 -0.02 -0.03 -0.05 0.01 -0.02 -0.01 -0.02 -0.05 -0.07 -0.20 -0.36 -0.20 0.12 0.15 -0.08 0.16 0.08 -0.06 -0.01 -0.03 -0.01 -0.00 -0.00 0.01 0.00 -0.01 0.00 -0.00 -0.01 -0.02 -0.01 0.01 -0.00 0.02 0.02 0.06 -0.09 0.04 -0.13 -0.08 0.04 -0.10 0.02 -0.01 0.01 0.01 -0.01 0.01 0.03 -0.05 -0.00 -0.12 -0.15 0.32 0.07 0.17 0.02 0.17 0.26 -0.18 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 -0.01 0.01 -0.00 0.00 0.00 -0.00 0.01 0.00 0.00 -0.00 0.00 0.02 -0.01 0.01 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.02 -0.08 -0.01 -0.02 0.08 -0.00 -0.00 0.01 0.01 0.02 -0.10 -0.01 -0.02 0.08 0.01 0.00 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 -0.00 -0.01 -0.01 -0.01 -0.00 -0.00 -0.01 0.01 0.02 0.00 -0.04 -0.09 0.42 0.05 0.11 -0.45 0.01 0.02 -0.07 -0.06 -0.13 0.57 0.06 0.10 -0.44 -0.01 -0.00 -0.00 -0.00 -0.00 -0.00 0.01 -0.00 0.03 0.01 -0.01 0.00 -0.01 0.02 0.00 0.01 -0.01 -0.00 -0.00 -0.01 0.02 0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 -0.01 -0.01 -0.00 -0.04 0.01 -0.00 -0.01 -0.02 0.00 -0.01 0.03 -0.01 0.03 -0.02 0.03 -0.01 0.02 -0.09 -0.02 -0.06 0.02 0.00 0.01 0.10 -0.12 0.02 -0.01 0.07 0.01 -0.03 0.22 0.05 0.04 -0.03 0.00 0.03 -0.04 0.02 0.02 -0.05 0.02 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.01 -0.01 0.00 -0.00 0.01 -0.00 -0.01 -0.01 -0.01 0.00 -0.01 0.01 -0.00 0.02 -0.00 0.05 0.05 0.00 -0.09 -0.14 -0.05 0.01 -0.00 -0.00 -0.09 -0.01 -0.06 -0.13 -0.14 -0.11 0.07 0.16 0.05 0.01 -0.03 -0.04 -0.01 0.00 0.03 -0.01 -0.02 0.01 0.00 -0.00 -0.06 -0.02 0.01 0.04 -0.13 -0.04 -0.05 -0.07 -0.09 -0.04 0.14 -0.03 0.29 0.34 -0.26 0.04 -0.12 0.42 0.08 0.35 -0.31 -0.06 -0.01 0.01 -0.01 -0.02 -0.02 0.03 -0.01 0.02 -0.03 0.00 -0.00 0.01 -0.00 0.00 -0.00 0.00 0.01 0.01 -0.00 0.00 0.01 -0.01 -0.02 0.00 -0.00 -0.00 -0.00 0.01 0.00 0.01 -0.00 0.00 -0.00 -0.00 0.01 -0.03 0.00 -0.01 -0.00 0.00 -0.03 -0.00 -0.00 0.00 -0.00 -0.08 0.02 -0.03 -0.00 0.01 -0.01 0.01 0.01 0.00 -0.06 -0.04 -0.02 0.31 -0.21 -0.02 -0.03 0.13 0.03 -0.24 -0.16 -0.06 0.11 -0.08 -0.01 -0.07 0.36 0.08 -0.00 -0.01 -0.00 0.01 0.02 0.01 0.00 0.02 0.00 0.03 0.02 0.02 0.02 0.01 0.02 -0.02 -0.04 -0.01 0.23 -0.38 -0.06 -0.16 0.11 0.01 -0.25 -0.16 -0.08 0.04 -0.20 -0.04 -0.22 0.36 0.06 0.01 0.00 0.02 -0.01 0.01 -0.02 -0.02 0.01 -0.02 -0.05 0.03 -0.01 0.02 -0.06 -0.01 -0.05 0.04 0.01 0.02 0.02 -0.05 -0.00 -0.01 -0.03 -0.02 -0.03 0.02 -0.00 -0.01 -0.01 -0.01 0.01 0.01 0.02 -0.01 0.03 0.03 -0.02 -0.04 -0.00 -0.01 -0.01 0.04 0.06 0.01 0.12 0.07 0.11 -0.02 -0.02 -0.01 0.03 0.00 -0.01 -0.01 0.04 -0.01 -0.01 0.07 0.03 0.00 -0.01 -0.01 -0.09 -0.07 0.01 -0.03 -0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 -0.00 -0.01 0.03 0.01 0.01 -0.06 -0.01 -0.02 0.07 0.00 0.01 -0.05 -0.00 -0.01 0.02 -0.08 -0.04 -0.01 -0.02 -0.06 -0.01 0.00 0.01 0.01 0.09 0.07 0.08 -0.10 -0.13 0.06 -0.20 -0.28 -0.04 0.02 0.04 -0.18 -0.04 -0.10 0.38 0.04 0.09 -0.37 -0.04 -0.08 0.33 0.02 0.03 -0.15 0.11 0.03 -0.05 0.10 0.08 0.09 -0.13 0.00 -0.35 0.13 -0.13 -0.01 -0.03 0.11 0.01 0.11 -0.08 -0.03 0.03 0.02 -0.05 0.01 -0.01 -0.03 -0.02 -0.04 0.03 -0.00 0.01 0.00 0.00 -0.01 -0.01 -0.01 0.01 -0.02 -0.02 0.01 0.03 0.00 0.01 0.00 -0.02 -0.04 -0.01 -0.08 -0.04 -0.07 0.02 0.01 0.01 -0.01 -0.00 -0.00 0.01 -0.02 0.00 0.00 -0.04 -0.02 -0.00 0.01 0.00 0.05 0.06 -0.01 0.02 0.03 0.05 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.01 -0.01 0.04 0.01 0.02 -0.08 -0.01 -0.02 0.08 0.01 0.01 -0.06 -0.00 -0.01 0.03 0.05 0.02 0.01 0.01 0.04 0.00 0.00 -0.01 -0.00 -0.06 -0.04 -0.05 0.06 0.08 -0.04 0.13 0.18 0.03 0.02 0.06 -0.28 -0.05 -0.12 0.50 0.06 0.11 -0.46 -0.05 -0.10 0.38 0.02 0.04 -0.17 -0.07 -0.02 0.03 -0.07 -0.05 -0.06 0.09 -0.00 0.22 -0.08 0.08 0.01 0.02 -0.07 -0.00 -0.07 0.04 0.02 -0.02 -0.00 0.02 -0.01 0.00 0.03 0.01 0.03 -0.02 0.03 0.05 -0.01 0.00 0.01 -0.03 -0.01 -0.03 -0.03 -0.06 -0.03 -0.11 0.04 0.06 0.04 -0.01 0.01 0.01 0.00 0.01 0.01 0.00 -0.00 -0.00 -0.07 -0.12 0.31 0.01 0.01 -0.06 0.00 -0.01 0.01 0.00 0.00 -0.00 0.39 -0.20 0.20 -0.01 -0.01 0.01 0.00 0.00 0.00 -0.01 0.00 -0.00 0.01 -0.01 0.00 -0.00 0.00 -0.00 -0.01 -0.00 0.00 0.01 -0.00 0.00 0.00 0.00 -0.00 -0.01 0.03 0.05 -0.01 -0.01 0.09 -0.04 -0.07 -0.00 -0.03 -0.04 -0.03 -0.01 -0.00 -0.02 0.02 0.02 0.00 0.02 0.01 -0.02 -0.02 -0.00 0.01 -0.02 0.02 -0.01 0.01 0.00 0.00 -0.01 -0.00 0.01 -0.01 -0.01 -0.11 0.13 -0.04 0.18 0.07 -0.07 0.01 0.14 -0.35 -0.18 0.01 0.06 -0.16 -0.08 0.39 -0.07 -0.11 -0.16 0.30 0.02 0.08 0.09 0.10 0.09 -0.03 -0.02 -0.04 0.01 0.00 -0.01 0.03 0.00 0.01 0.03 0.03 0.04 0.09 -0.04 -0.05 -0.04 0.00 -0.00 -0.02 -0.01 -0.00 0.00 0.00 -0.00 0.00 0.03 0.03 -0.09 0.02 0.02 -0.10 0.00 -0.02 0.02 -0.00 0.00 -0.01 -0.28 0.14 -0.16 0.01 0.01 0.00 0.00 -0.01 -0.00 0.01 -0.00 -0.00 -0.01 0.01 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 0.00 -0.00 0.00 0.02 -0.01 -0.04 -0.02 -0.02 0.12 0.02 0.05 -0.01 0.00 0.01 -0.00 0.01 0.01 -0.00 0.01 0.02 0.01 -0.01 0.01 0.01 0.02 -0.00 -0.00 0.01 -0.02 -0.00 -0.01 0.00 -0.00 0.01 0.00 -0.00 -0.04 -0.01 0.05 -0.12 0.00 -0.15 -0.02 0.04 0.06 0.19 -0.49 -0.26 0.01 0.09 -0.23 -0.10 0.54 -0.11 0.07 0.08 -0.17 0.01 -0.02 -0.08 -0.05 -0.05 0.02 -0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.01 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 0.01 -0.02 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.01 0.01 0.00 -0.04 -0.02 -0.01 -0.06 -0.04 -0.02 -0.07 0.17 0.04 0.16 0.10 0.04 0.13 -0.13 -0.02 -0.06 -0.04 -0.01 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.01 -0.00 -0.23 -0.34 -0.09 -0.46 0.17 -0.02 0.17 0.12 0.05 -0.03 -0.49 -0.12 -0.39 -0.06 -0.07 0.00 0.00 -0.01 0.01 0.00 0.01 -0.00 -0.00 -0.01 0.00 -0.01 -0.01 0.00 0.00 -0.01 -0.01 0.02 -0.00 -0.00 0.03 -0.03 -0.02 -0.03 0.03 -0.02 0.00 -0.02 0.08 -0.06 0.01 -0.03 0.03 0.07 0.05 0.03 -0.03 0.15 -0.10 -0.00 -0.04 0.07 -0.06 -0.01 -0.00 0.00 -0.07 -0.03 -0.05 0.00 -0.01 0.02 -0.34 0.35 -0.13 -0.01 -0.00 -0.01 0.00 0.02 -0.00 0.02 -0.00 0.01 -0.09 -0.40 0.14 0.02 -0.01 0.02 -0.03 0.02 0.00 0.02 0.01 0.01 0.01 -0.01 0.00 -0.00 -0.01 -0.00 0.00 0.01 0.00 -0.00 -0.00 -0.00 -0.01 0.00 -0.00 -0.03 -0.00 0.02 0.01 0.01 0.01 -0.09 0.05 -0.01 -0.05 -0.00 -0.04 -0.03 -0.03 -0.05 0.06 0.12 0.04 -0.00 -0.02 -0.02 -0.04 -0.01 0.00 -0.01 0.02 -0.00 -0.01 -0.02 -0.00 -0.06 0.00 -0.00 0.07 0.02 -0.05 0.10 0.04 0.11 -0.02 -0.02 -0.13 -0.03 0.00 -0.02 0.02 -0.06 -0.02 -0.04 0.04 0.01 0.13 -0.22 0.10 0.21 0.23 -0.33 0.07 -0.17 0.25 0.16 -0.01 0.03 0.01 0.01 -0.07 -0.08 0.02 0.05 -0.06 0.10 0.03 -0.05 -0.06 -0.03 0.00 0.02 -0.01 0.05 0.01 0.03 -0.00 0.00 -0.01 0.03 -0.22 0.34 0.01 -0.01 0.03 -0.00 0.01 0.00 -0.00 -0.00 -0.00 -0.09 0.02 -0.08 0.00 -0.01 -0.01 0.02 -0.01 -0.00 -0.04 -0.01 -0.01 0.01 0.01 0.01 -0.01 0.01 -0.00 -0.00 0.02 0.00 0.03 -0.02 0.00 -0.01 -0.03 -0.01 0.05 -0.03 -0.03 -0.01 -0.00 -0.02 -0.12 0.01 -0.02 0.01 0.03 0.01 -0.03 -0.03 -0.01 -0.03 -0.03 -0.00 0.10 0.17 0.02 -0.09 0.00 0.00 -0.06 0.10 0.02 0.06 0.03 0.01 -0.07 -0.03 -0.02 -0.03 -0.00 0.19 -0.17 0.01 -0.22 -0.03 0.08 0.15 0.01 0.05 0.04 -0.02 0.04 0.04 0.03 -0.08 0.01 0.07 -0.32 0.27 0.22 0.30 -0.27 0.16 -0.11 0.25 -0.03 -0.00 -0.00 -0.00 -0.02 0.02 0.02 0.01 -0.00 0.00 -0.01 -0.00 0.01 0.01 0.01 0.00 -0.01 -0.00 -0.01 -0.00 -0.01 0.00 -0.00 0.00 -0.00 0.07 -0.14 -0.00 0.00 -0.01 -0.00 0.00 0.00 0.00 -0.00 0.00 0.03 0.03 0.01 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.05 0.02 0.00 0.10 0.01 0.01 -0.01 -0.06 -0.02 -0.05 0.06 0.01 0.08 -0.02 0.00 -0.05 -0.08 -0.02 -0.01 -0.00 0.00 -0.00 -0.00 0.00 0.02 -0.00 0.00 -0.00 -0.01 -0.00 0.01 0.01 0.00 0.01 0.00 -0.00 0.30 0.39 0.12 -0.22 -0.08 -0.04 -0.31 0.46 0.08 0.20 0.20 0.08 -0.42 -0.11 -0.08 0.01 0.00 -0.01 0.01 0.01 0.01 -0.01 -0.00 -0.04 0.00 -0.02 -0.01 0.00 -0.00 -0.01 -0.00 0.02 -0.00 -0.01 0.06 -0.05 -0.04 -0.06 0.05 -0.03 0.03 -0.06 -0.03 -0.00 0.01 -0.01 0.12 -0.04 0.06 -0.12 -0.02 0.03 0.01 0.06 -0.00 -0.08 -0.04 -0.11 0.14 -0.07 0.02 -0.00 0.02 -0.00 -0.01 0.01 0.08 -0.12 0.32 -0.00 0.01 0.01 0.02 -0.06 0.02 0.01 0.00 -0.00 -0.12 0.05 -0.12 0.08 -0.09 0.03 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 0.00 0.00 -0.00 -0.01 -0.00 -0.00 0.01 0.00 0.01 -0.00 0.00 -0.01 -0.01 -0.00 -0.04 0.08 0.02 0.02 0.00 -0.01 0.01 0.02 0.01 -0.17 0.20 -0.09 -0.28 -0.28 -0.22 0.04 0.36 0.17 0.03 0.04 0.02 -0.02 -0.01 -0.01 -0.03 0.05 0.01 0.02 0.02 0.01 -0.05 -0.01 -0.01 -0.11 -0.04 -0.32 0.12 -0.13 0.22 0.15 -0.16 0.01 -0.03 0.05 0.02 0.02 -0.07 0.01 -0.00 -0.04 0.02 0.02 0.05 -0.08 -0.00 -0.02 -0.03 -0.04 -0.03 0.01 -0.01 0.01 -0.00 0.00 0.06 -0.05 -0.02 -0.05 -0.02 0.02 -0.00 0.04 -0.03 -0.01 -0.03 0.06 -0.07 0.02 -0.01 0.03 0.01 0.01 0.00 -0.01 0.08 -0.20 0.34 -0.01 0.01 0.01 -0.01 -0.00 -0.01 -0.01 0.00 -0.00 -0.11 -0.07 -0.01 -0.04 0.04 -0.01 -0.03 -0.02 -0.01 0.25 0.16 0.07 0.05 -0.03 -0.00 -0.02 -0.11 -0.03 0.02 0.03 0.01 -0.09 0.02 -0.01 -0.04 0.03 0.00 0.01 0.02 0.01 0.01 -0.01 -0.00 -0.00 0.00 0.01 0.08 -0.09 0.04 0.13 0.13 0.10 -0.01 -0.16 -0.08 -0.08 -0.31 -0.07 -0.26 -0.13 -0.06 -0.05 0.13 0.03 -0.18 -0.14 -0.05 -0.53 0.02 -0.06 -0.04 -0.01 -0.02 0.01 -0.05 0.03 0.07 -0.03 0.10 -0.00 0.00 0.00 0.01 -0.04 -0.00 -0.00 -0.02 0.01 0.00 0.01 -0.01 -0.01 -0.01 0.00 -0.01 -0.02 0.02 0.03 0.00 -0.01 0.01 -0.10 0.05 -0.06 0.12 0.05 -0.05 0.02 -0.10 0.06 -0.01 0.06 -0.12 0.14 -0.02 0.05 -0.06 -0.01 -0.02 0.00 0.02 -0.04 0.14 -0.37 0.02 -0.02 -0.01 0.02 -0.01 0.01 0.02 -0.00 0.00 0.18 0.15 0.01 0.07 -0.08 0.01 -0.01 -0.01 -0.00 0.13 0.08 0.03 0.02 -0.02 -0.00 -0.01 -0.05 -0.01 0.01 0.01 0.00 -0.05 0.01 -0.00 -0.01 0.02 0.00 0.02 -0.07 -0.02 -0.02 0.01 0.00 -0.00 -0.02 -0.00 -0.14 0.18 -0.07 -0.25 -0.27 -0.18 -0.00 0.28 0.16 -0.07 -0.19 -0.05 -0.12 -0.06 -0.03 0.00 0.02 0.01 -0.11 -0.10 -0.03 -0.21 0.02 -0.02 0.08 0.03 0.25 -0.10 0.12 -0.19 -0.15 0.14 -0.03 0.01 0.00 0.01 -0.02 0.08 0.01 0.01 0.03 -0.01 -0.02 -0.02 0.04 -0.00 0.01 0.03 0.02 0.02 -0.01 0.05 -0.01 0.10 0.01 -0.05 -0.01 0.12 -0.06 0.01 -0.09 0.08 0.01 -0.11 -0.07 0.00 -0.02 -0.08 -0.05 -0.01 0.03 0.03 0.00 -0.01 -0.00 -0.22 0.28 -0.32 0.03 -0.02 -0.00 -0.01 0.05 0.02 0.02 -0.01 -0.00 0.53 0.33 -0.11 0.02 0.04 0.01 0.01 -0.01 -0.00 0.03 0.02 0.01 0.00 -0.00 -0.00 -0.02 -0.01 -0.00 0.01 -0.01 -0.00 -0.01 0.00 -0.00 0.00 0.01 0.00 -0.07 0.03 -0.00 -0.02 0.01 -0.00 -0.01 0.01 -0.05 0.05 0.06 0.04 0.08 0.08 0.03 0.04 0.04 -0.00 0.01 0.02 0.01 -0.16 -0.01 -0.02 0.08 -0.11 -0.02 -0.02 -0.01 -0.01 -0.04 0.01 -0.00 -0.03 -0.02 -0.27 0.07 -0.03 0.13 0.03 -0.09 -0.18 0.01 0.01 0.02 -0.02 0.08 0.02 0.01 -0.00 -0.01 0.01 -0.04 0.02 0.08 0.13 -0.06 0.11 0.10 -0.04 0.01 -0.00 0.01 0.00 -0.00 -0.00 0.01 -0.01 0.00 -0.01 0.01 0.00 -0.01 -0.01 -0.00 -0.00 -0.01 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.03 0.03 -0.02 0.00 -0.00 0.00 -0.00 0.01 0.00 0.00 -0.00 -0.00 0.05 0.03 -0.01 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.01 -0.00 0.01 -0.00 -0.00 0.03 0.00 0.00 -0.03 0.04 0.01 -0.02 -0.03 -0.01 0.00 -0.01 -0.00 -0.01 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.01 0.01 0.00 0.01 0.01 0.00 0.00 0.00 0.00 -0.07 -0.15 -0.04 0.47 0.02 0.06 -0.37 0.55 0.09 -0.22 -0.42 -0.13 0.20 0.00 0.03 -0.00 -0.00 -0.02 0.00 -0.00 0.01 0.00 -0.01 -0.02 0.00 0.00 0.00 -0.00 0.01 0.00 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.01 0.01 -0.01 0.01 0.01 0.00 -0.04 -0.03 -0.08 0.03 -0.02 -0.05 0.03 0.11 -0.07 0.03 -0.02 0.05 -0.03 -0.01 -0.01 -0.07 -0.05 0.01 0.00 -0.01 0.00 -0.01 -0.01 0.01 -0.42 -0.07 0.63 0.06 -0.03 0.00 -0.01 0.04 0.01 0.01 -0.01 0.00 0.29 0.22 -0.09 0.03 0.02 -0.00 0.00 0.00 -0.00 -0.01 -0.01 -0.00 -0.00 -0.00 -0.00 0.01 0.00 0.00 -0.00 0.00 0.00 0.01 0.00 0.00 -0.01 -0.00 -0.00 -0.01 -0.06 0.03 -0.03 0.01 -0.00 0.02 0.02 0.04 0.04 0.11 0.04 0.01 -0.00 0.03 -0.00 0.07 0.04 -0.01 -0.02 -0.00 0.05 0.00 0.01 -0.00 0.00 -0.00 0.04 0.06 0.02 -0.04 -0.00 -0.01 0.18 0.05 0.14 0.07 0.14 0.02 -0.10 0.05 -0.13 0.01 0.03 0.03 -0.04 0.12 0.03 0.00 0.03 -0.01 0.04 0.07 -0.10 -0.06 -0.13 -0.00 -0.12 -0.11 0.05 0.01 0.00 0.01 0.00 -0.00 0.00 -0.00 -0.02 0.01 -0.01 0.01 -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 -0.01 0.04 -0.06 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.01 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 0.00 -0.03 -0.01 -0.01 -0.03 -0.04 -0.01 0.05 0.00 0.01 0.01 0.01 0.00 0.02 0.04 0.01 -0.05 -0.01 -0.01 -0.00 0.01 -0.00 -0.00 0.00 0.00 -0.01 -0.00 -0.00 0.01 0.01 0.01 -0.00 -0.00 0.01 -0.01 -0.01 0.00 -0.22 -0.41 -0.12 0.51 0.03 0.06 0.00 0.02 0.00 0.24 0.44 0.13 -0.45 -0.03 -0.06 -0.03 -0.01 -0.03 -0.01 -0.02 -0.00 0.01 -0.01 0.01 -0.00 0.00 0.00 -0.00 0.01 0.00 -0.00 0.00 -0.00 -0.00 -0.02 0.02 0.01 0.02 -0.00 0.02 0.01 0.00 0.02 -0.06 0.04 -0.06 0.04 0.04 -0.03 0.02 -0.05 0.07 -0.02 -0.02 -0.02 0.01 -0.04 -0.13 -0.08 0.12 0.00 0.01 -0.00 -0.00 0.01 -0.02 0.54 -0.28 -0.13 -0.08 0.07 0.00 0.01 -0.03 -0.03 0.01 0.00 0.01 0.48 0.16 -0.06 0.06 0.03 -0.06 -0.01 0.00 0.00 -0.01 -0.01 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.02 -0.01 0.02 0.04 -0.03 0.01 -0.00 0.02 -0.02 0.17 0.28 0.15 -0.01 -0.06 0.14 -0.14 0.02 0.07 0.01 0.02 0.01 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.02 -0.00 0.00 0.04 0.02 0.09 0.03 0.01 0.02 0.02 0.01 0.08 0.02 -0.08 -0.05 0.05 -0.18 -0.05 0.02 -0.04 0.01 0.05 -0.00 -0.07 0.05 0.05 -0.09 0.03 0.03 -0.00 -0.01 0.03 -0.05 0.04 0.01 0.01 -0.04 -0.11 0.06 -0.03 0.02 0.03 0.11 0.01 -0.10 -0.09 -0.01 0.23 -0.01 -0.00 -0.04 0.02 0.03 -0.04 -0.45 0.39 -0.08 0.09 -0.07 0.01 0.01 0.01 -0.03 -0.01 -0.01 0.00 -0.09 -0.03 -0.11 0.03 0.00 -0.10 0.00 -0.00 -0.00 0.01 0.00 0.00 0.01 0.01 0.00 -0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.02 0.06 -0.02 -0.04 0.03 0.00 -0.01 -0.02 0.02 0.19 0.22 0.15 -0.10 -0.17 0.20 -0.28 -0.17 0.05 0.03 0.05 0.01 -0.07 -0.01 -0.01 -0.00 0.00 0.00 -0.03 -0.04 -0.01 0.03 0.00 0.00 -0.18 -0.05 -0.11 -0.07 -0.15 -0.02 0.10 -0.04 0.13 -0.01 0.05 0.04 -0.05 0.18 0.03 -0.03 0.08 -0.02 -0.02 -0.03 0.07 -0.03 -0.03 0.04 -0.02 -0.04 0.03 0.07 0.10 -0.00 -0.02 -0.06 0.03 0.19 0.11 -0.17 -0.18 0.04 0.14 0.10 -0.03 -0.07 -0.01 0.01 0.09 -0.07 -0.03 -0.05 -0.01 -0.01 0.01 0.29 -0.19 -0.12 -0.05 0.02 -0.01 0.00 -0.00 -0.01 0.01 0.00 0.01 -0.53 -0.08 -0.12 0.01 -0.01 -0.02 0.01 -0.01 -0.01 0.01 0.01 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 -0.07 -0.04 0.07 0.01 -0.01 0.01 -0.04 -0.04 -0.01 0.03 0.03 0.02 -0.06 -0.08 0.05 -0.09 -0.05 0.03 -0.01 -0.03 -0.00 0.01 -0.00 -0.00 0.00 -0.00 -0.00 -0.01 -0.01 -0.00 -0.04 0.00 -0.01 0.28 0.06 -0.07 0.18 0.19 0.17 -0.06 -0.05 -0.25 0.00 -0.04 -0.03 0.02 -0.06 -0.03 0.01 -0.01 0.00 -0.06 -0.11 0.18 -0.01 0.07 0.09 0.08 -0.01 0.05 -0.11 0.16 0.29 0.03 -0.06 -0.13 -0.02 0.07 0.01 0.13 -0.06 0.02 -0.04 -0.05 -0.12 -0.07 -0.01 0.00 0.02 -0.00 0.01 -0.01 -0.00 0.00 -0.06 -0.10 0.05 0.06 -0.04 0.00 -0.00 0.02 0.01 0.00 -0.01 -0.00 -0.15 -0.48 0.05 0.03 0.01 -0.01 -0.01 0.00 0.00 -0.00 -0.01 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.01 0.00 -0.00 0.01 -0.04 -0.00 -0.02 0.01 -0.01 0.04 -0.07 -0.10 0.02 0.09 0.01 -0.00 -0.02 0.02 -0.04 0.06 0.05 0.02 0.04 0.02 0.01 0.01 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.04 0.00 0.09 -0.02 0.07 -0.07 -0.07 0.07 -0.00 -0.01 0.06 0.05 -0.03 0.14 0.04 -0.02 0.05 -0.02 -0.23 0.14 0.04 0.11 0.27 0.15 0.18 0.34 -0.30 0.01 0.01 -0.01 -0.03 0.00 0.00 0.01 -0.00 0.01 0.01 0.00 0.00 0.01 0.00 -0.00 -0.03 -0.03 -0.02 0.01 0.01 0.01 -0.00 -0.00 -0.00 0.03 -0.02 -0.03 0.04 0.01 0.01 0.00 -0.00 0.00 -0.01 -0.00 -0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 -0.00 -0.01 -0.00 -0.08 0.12 0.02 0.04 0.02 0.01 0.05 -0.02 0.00 0.01 -0.02 -0.00 -0.01 -0.05 -0.01 -0.03 -0.03 -0.01 -0.00 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.05 0.03 0.06 0.05 0.01 0.03 0.07 0.01 -0.21 -0.48 -0.14 -0.40 -0.05 -0.06 -0.13 0.19 0.03 0.18 0.30 0.09 0.54 -0.01 0.06 -0.01 -0.01 -0.02 -0.01 0.01 -0.01 -0.01 0.00 -0.02 0.03 0.00 0.02 -0.01 0.02 0.01 0.03 0.00 -0.01 -0.00 -0.01 0.03 -0.01 0.00 0.02 0.01 -0.02 0.02 0.04 0.00 -0.03 -0.21 0.04 0.05 -0.02 -0.02 -0.07 -0.01 -0.02 0.00 0.07 0.05 0.03 -0.10 -0.12 -0.11 0.07 0.05 0.07 -0.01 -0.01 -0.01 0.15 -0.07 -0.24 0.30 0.02 0.04 0.03 -0.02 0.01 -0.09 -0.02 -0.03 -0.30 -0.09 0.06 -0.00 0.01 0.02 0.00 0.00 -0.00 0.03 -0.05 -0.01 -0.02 -0.01 -0.00 -0.02 0.01 -0.00 -0.01 0.01 0.00 0.00 0.02 0.01 0.01 0.01 0.00 -0.00 0.00 0.01 -0.07 -0.01 -0.02 -0.01 0.00 0.00 0.04 0.18 0.12 0.24 0.20 0.03 0.14 0.26 0.01 0.08 0.19 0.05 0.15 0.02 0.02 0.05 -0.07 -0.01 -0.07 -0.12 -0.04 -0.21 0.00 -0.02 0.07 0.05 0.10 0.09 -0.02 0.09 0.05 -0.05 0.10 0.14 0.07 0.16 -0.08 0.23 0.06 0.14 0.09 -0.10 0.03 -0.06 0.04 -0.03 -0.02 0.01 0.02 -0.04 0.05 0.01 0.07 -0.06 0.04 -0.02 -0.03 0.08 0.01 0.17 0.01 -0.03 -0.03 0.05 0.02 -0.01 -0.11 -0.11 -0.06 0.00 0.01 -0.00 0.00 -0.00 0.00 -0.04 -0.03 0.12 -0.09 0.07 0.01 0.00 0.01 0.01 0.02 -0.00 0.00 -0.20 -0.09 0.01 0.01 -0.00 0.00 -0.00 0.00 0.00 0.01 -0.02 -0.00 -0.01 -0.00 -0.00 -0.01 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 0.00 0.01 0.00 0.00 0.00 0.00 -0.00 0.01 0.00 0.00 0.00 -0.01 -0.00 0.06 0.22 0.14 0.24 0.16 0.08 0.09 0.28 0.04 0.03 0.07 0.02 0.05 0.00 0.01 0.02 -0.03 -0.00 -0.03 -0.05 -0.01 -0.08 0.00 -0.01 -0.15 -0.12 -0.27 -0.26 0.02 -0.23 -0.09 0.08 -0.31 0.10 -0.12 -0.07 0.03 -0.23 -0.05 0.12 -0.15 0.04 -0.06 -0.05 0.18 -0.11 -0.06 0.14 -0.04 -0.15 0.08 0.01 -0.00 -0.01 -0.03 0.03 0.01 0.02 0.01 0.04 0.00 -0.01 -0.01 0.01 0.01 0.00 -0.01 -0.02 -0.01 -0.01 0.00 -0.01 0.00 -0.00 0.00 0.15 -0.10 0.01 -0.02 -0.02 -0.01 -0.04 0.03 0.00 0.03 0.00 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.01 -0.00 0.01 0.08 -0.11 -0.02 0.00 0.00 -0.00 0.01 0.01 0.01 0.00 0.00 -0.00 0.01 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 -0.00 -0.00 -0.04 -0.05 -0.11 -0.10 0.02 -0.08 -0.03 0.03 -0.12 -0.38 0.26 0.12 0.01 0.56 0.14 -0.45 0.33 -0.07 0.01 -0.02 0.02 -0.03 -0.02 0.02 -0.00 -0.03 0.03 0.01 0.06 -0.03 0.09 -0.04 0.03 -0.07 -0.03 -0.08 0.02 -0.01 0.05 -0.01 -0.02 -0.00 -0.04 -0.03 -0.04 0.07 0.03 0.05 -0.01 -0.00 -0.01 -0.12 0.19 -0.14 -0.10 0.02 -0.01 -0.01 0.03 0.01 0.03 0.00 0.01 -0.06 -0.01 -0.02 -0.01 -0.02 -0.01 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.01 -0.00 -0.00 -0.02 0.01 -0.05 0.03 -0.03 -0.00 0.02 0.02 -0.05 0.03 0.15 0.09 0.16 0.10 0.02 0.06 0.16 0.00 0.00 0.00 -0.01 -0.00 0.00 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 0.01 0.00 -0.00 0.08 0.14 0.35 0.30 -0.10 0.26 0.08 -0.08 0.35 -0.11 0.02 -0.03 0.02 0.07 0.01 -0.11 0.02 0.01 -0.06 -0.07 0.28 -0.19 -0.06 0.25 -0.01 -0.27 0.16 0.00 -0.02 -0.00 0.04 -0.01 -0.00 -0.00 -0.00 -0.01 -0.03 0.02 -0.00 0.03 0.02 0.00 0.02 0.02 0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.06 0.03 0.04 -0.04 0.00 -0.00 0.00 0.01 0.00 0.00 0.00 0.00 -0.06 -0.03 0.01 -0.06 -0.09 -0.04 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.01 0.00 -0.01 0.01 -0.01 -0.00 -0.03 -0.05 0.08 0.12 0.24 0.25 0.32 0.18 0.12 0.14 0.37 -0.03 -0.00 -0.01 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.03 0.04 0.07 0.07 -0.01 0.06 0.02 -0.03 0.07 -0.05 0.00 -0.02 0.01 0.04 0.02 -0.06 0.00 0.01 0.03 0.10 -0.33 0.28 0.10 -0.32 -0.01 0.36 -0.22 -0.00 0.00 0.00 0.01 -0.00 -0.00 -0.00 0.00 0.01 0.01 0.01 0.01 0.00 0.00 -0.01 -0.01 -0.01 -0.01 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.01 0.01 0.01 -0.01 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.02 -0.01 -0.00 0.01 0.01 0.00 -0.00 -0.01 -0.00 -0.17 0.27 0.05 -0.10 -0.28 -0.08 0.22 -0.01 0.02 -0.19 0.27 0.05 -0.08 -0.19 -0.06 0.31 -0.01 0.03 -0.01 0.00 -0.02 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.01 -0.02 -0.03 -0.02 -0.01 -0.01 -0.02 -0.03 0.01 0.16 0.21 0.07 0.12 -0.02 0.01 0.30 -0.45 -0.07 -0.04 -0.12 -0.04 -0.27 -0.04 -0.04 0.01 0.03 0.08 0.05 -0.04 0.04 0.01 -0.02 0.04 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.01 0.01 0.01 0.01 -0.00 -0.01 -0.02 0.01 -0.02 0.02 0.02 -0.05 0.04 -0.01 0.01 -0.00 -0.02 0.01 -0.02 0.01 0.01 0.05 0.03 0.00 -0.11 -0.12 -0.07 0.05 0.02 0.04 -0.01 -0.00 -0.01 -0.06 0.07 -0.01 -0.05 0.03 -0.00 -0.02 0.02 0.00 0.03 -0.00 0.01 -0.20 -0.07 0.02 0.09 0.12 0.06 0.00 -0.00 -0.00 0.00 -0.01 -0.00 0.00 0.01 0.00 -0.01 0.00 -0.00 0.01 -0.01 -0.00 0.00 0.01 0.00 -0.01 0.00 -0.00 -0.02 0.01 -0.04 0.02 -0.01 -0.00 -0.04 -0.06 0.09 -0.17 -0.19 -0.29 -0.28 -0.12 -0.15 -0.14 -0.36 0.06 -0.01 -0.01 -0.00 -0.00 0.00 -0.00 -0.01 0.01 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.06 0.15 0.11 -0.08 0.10 0.02 -0.03 0.10 -0.03 -0.03 -0.04 0.01 0.00 0.00 -0.04 -0.04 0.02 -0.00 0.08 -0.25 0.25 0.07 -0.29 -0.05 0.30 -0.20 -0.01 -0.03 0.01 -0.06 0.03 -0.04 0.15 0.05 0.21 -0.01 -0.01 -0.06 0.01 0.01 -0.01 0.01 0.01 0.02 -0.08 -0.03 -0.06 0.01 0.00 0.01 0.14 -0.21 0.16 0.04 -0.02 -0.00 -0.01 -0.00 -0.00 -0.00 -0.00 -0.00 0.02 0.00 -0.00 -0.00 0.00 -0.01 -0.00 0.00 0.00 0.00 -0.01 -0.00 0.00 0.01 0.00 -0.01 -0.00 -0.00 0.00 -0.01 -0.00 0.00 0.01 0.00 -0.00 -0.00 -0.00 -0.12 -0.01 -0.20 -0.01 0.01 -0.00 0.01 0.02 -0.02 0.03 -0.06 0.00 -0.03 -0.04 0.07 -0.01 0.02 0.01 -0.00 -0.01 -0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.10 0.22 0.43 0.47 -0.06 0.29 -0.02 -0.08 0.42 0.02 0.00 0.01 -0.01 -0.00 0.02 -0.01 0.01 -0.00 0.02 -0.02 0.03 -0.05 -0.03 0.04 0.01 -0.04 0.03 -0.00 -0.01 0.01 0.01 -0.01 -0.01 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.01 0.00 0.01 0.03 0.00 -0.02 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.07 0.03 0.01 -0.01 0.05 0.01 0.03 -0.02 -0.00 -0.03 0.00 -0.00 0.01 0.00 0.01 0.03 -0.01 -0.04 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.03 -0.01 0.00 0.01 -0.00 -0.24 -0.18 -0.34 0.19 -0.01 0.53 -0.48 0.25 0.36 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 -0.00 -0.03 0.01 0.04 -0.01 -0.01 0.01 0.03 0.07 0.06 0.10 -0.00 -0.01 0.07 -0.01 0.10 -0.06 0.01 -0.01 0.02 -0.00 -0.03 -0.03 -0.02 0.01 -0.02 -0.00 -0.00 0.00 -0.02 0.02 0.01 -0.01 -0.00 -0.01 -0.00 -0.00 -0.00 0.01 0.00 0.00 -0.00 -0.01 -0.01 0.01 0.01 0.00 -0.00 -0.00 0.00 0.08 -0.04 -0.02 0.02 -0.06 -0.03 -0.02 0.03 0.01 0.02 -0.00 0.00 -0.02 -0.01 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.01 0.07 -0.03 -0.00 0.01 -0.00 -0.04 0.00 -0.04 0.05 0.02 0.05 -0.06 0.04 0.05 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.01 0.01 0.00 -0.04 -0.03 -0.01 0.02 -0.03 -0.04 0.27 -0.32 -0.25 -0.04 -0.05 0.59 -0.53 -0.21 0.20 0.05 -0.05 0.01 -0.04 -0.05 0.00 0.02 0.02 0.00 -0.03 -0.01 -0.01 0.01 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.01 0.01 0.00 -0.00 -0.01 -0.01 0.01 0.00 0.00 -0.00 -0.00 0.00 0.01 -0.01 0.02 -0.00 -0.03 -0.01 -0.01 0.02 0.00 0.01 -0.00 0.00 -0.03 -0.01 0.01 0.01 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.01 0.01 -0.05 -0.00 -0.01 -0.06 0.02 -0.05 0.05 0.03 0.03 -0.07 0.02 0.05 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.04 0.01 0.07 -0.03 -0.11 0.02 0.02 -0.02 -0.08 -0.12 -0.01 -0.07 0.01 0.04 -0.15 0.07 -0.07 0.03 0.36 -0.18 -0.40 -0.21 0.00 0.32 0.58 0.19 0.24 -0.01 -0.00 0.00 0.03 -0.02 -0.01 -0.00 -0.02 0.00 -0.00 0.01 0.00 0.00 0.00 -0.00 -0.00 0.00 0.01 -0.01 -0.01 -0.00 0.00 0.01 -0.00 -0.14 0.07 0.02 -0.02 0.10 0.02 0.03 -0.05 -0.01 -0.03 0.00 -0.01 0.01 -0.00 0.00 -0.01 0.01 0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.03 -0.00 0.00 -0.05 -0.04 -0.02 0.00 -0.00 0.05 0.05 0.08 -0.07 -0.00 -0.17 0.12 -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 0.00 -0.00 -0.00 0.02 -0.06 -0.21 0.15 0.34 -0.02 -0.12 0.14 0.26 0.35 0.07 0.25 -0.03 -0.14 0.38 -0.13 0.26 -0.13 0.14 -0.08 -0.14 -0.08 -0.02 0.10 0.21 0.09 0.07 -0.00 -0.00 0.00 -0.01 0.02 0.00 -0.01 -0.03 0.01 0.00 0.00 -0.00 0.01 0.00 0.00 -0.01 -0.01 -0.01 0.01 0.01 0.01 0.00 0.00 -0.00 0.05 -0.01 -0.02 0.01 -0.06 -0.01 -0.02 0.03 0.01 0.02 -0.00 0.00 -0.02 -0.01 0.01 0.01 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.01 -0.04 0.00 0.00 0.03 0.02 0.00 0.01 0.00 -0.07 0.04 -0.05 0.07 0.04 0.01 -0.07 0.00 0.05 0.01 0.01 -0.01 0.01 -0.00 0.00 0.01 -0.01 -0.00 -0.00 -0.01 -0.00 0.00 -0.00 -0.00 0.09 -0.09 -0.39 0.18 0.57 -0.08 -0.15 0.18 0.41 -0.22 -0.07 -0.18 0.02 0.09 -0.21 0.05 -0.19 0.09 0.05 -0.06 0.04 -0.03 -0.09 -0.05 -0.02 0.03 -0.03 -0.00 -0.01 0.01 -0.00 -0.00 -0.01 0.01 0.01 0.01 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.03 -0.00 0.03 -0.01 -0.00 -0.01 0.00 0.00 -0.00 -0.00 -0.01 0.02 0.00 0.00 0.00 0.01 -0.00 -0.00 -0.01 0.00 -0.00 0.02 -0.00 0.00 0.02 -0.04 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 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.01 -0.00 -0.40 0.50 -0.16 0.31 0.31 -0.41 -0.25 -0.31 0.11 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.03 0.03 0.04 -0.03 -0.06 -0.00 0.04 -0.06 -0.04 0.01 0.02 0.03 -0.00 -0.01 0.00 0.01 0.03 -0.02 0.01 -0.03 0.06 -0.01 -0.05 -0.05 -0.05 0.00 -0.04 -0.01 -0.01 0.02 0.01 -0.01 -0.01 -0.02 0.01 0.02 0.00 0.00 -0.01 0.01 0.01 -0.00 -0.01 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.03 0.01 0.01 -0.01 0.01 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.02 -0.03 0.01 -0.00 0.01 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.05 0.01 0.01 -0.00 -0.01 -0.00 0.00 0.02 -0.00 0.05 -0.04 0.03 -0.04 -0.03 0.01 0.05 0.02 -0.03 -0.00 0.00 -0.00 -0.01 0.00 0.00 -0.01 0.01 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 0.58 0.21 -0.12 -0.27 0.09 -0.22 0.37 -0.48 0.08 0.01 0.02 0.03 0.00 -0.01 -0.01 0.02 0.02 -0.02 0.12 -0.14 0.06 -0.08 -0.17 -0.08 -0.00 0.08 -0.06 0.01 -0.01 -0.04 -0.01 0.01 0.01 -0.01 -0.01 0.02 0.01 -0.00 -0.00 -0.01 0.00 0.01 0.01 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.03 0.04 -0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.02 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.05 -0.00 -0.05 0.03 -0.03 0.04 0.03 -0.01 -0.05 -0.02 0.03 0.00 0.00 0.01 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 -0.00 0.21 0.06 -0.10 -0.06 0.12 -0.09 0.10 -0.13 0.10 0.00 -0.03 -0.03 -0.00 0.01 0.03 -0.03 -0.02 0.02 -0.33 0.40 -0.24 0.20 0.52 0.31 0.09 -0.25 0.22 -0.01 -0.02 0.02 0.01 -0.04 -0.02 0.01 0.01 0.00 -0.01 0.01 -0.00 -0.00 0.00 -0.00 0.01 0.01 0.01 -0.02 -0.01 -0.01 0.00 0.01 -0.00 -0.21 0.08 0.04 0.04 0.18 0.06 0.09 -0.09 -0.01 -0.09 0.00 -0.02 0.02 0.00 0.00 -0.00 0.01 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 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 -0.04 0.01 0.00 0.01 -0.01 0.03 -0.02 0.02 -0.06 -0.02 -0.06 0.04 -0.06 -0.04 -0.00 0.01 0.00 -0.01 0.00 -0.00 -0.01 0.01 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 -0.00 0.01 0.03 0.00 -0.03 0.01 0.01 -0.01 -0.02 -0.33 -0.29 -0.41 0.02 0.42 -0.05 -0.23 -0.46 0.23 0.01 -0.00 0.01 -0.01 -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 0.00 0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.01 0.00 -0.00 0.00 0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.01 -0.00 -0.00 -0.00 0.00 -0.01 -0.00 -0.09 0.11 0.02 0.14 0.04 0.03 -0.14 -0.10 -0.04 -0.07 0.09 0.01 0.15 0.11 0.04 -0.06 -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 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.27 -0.07 0.37 -0.10 0.02 0.33 -0.51 -0.09 -0.11 -0.43 -0.12 0.17 -0.12 -0.01 0.02 0.01 0.01 -0.02 -0.02 -0.01 0.02 -0.02 -0.01 -0.01 -0.01 -0.01 0.00 0.02 -0.00 -0.01 -0.02 0.01 0.01 -0.01 -0.00 -0.00 -0.01 -0.00 0.01 0.01 -0.00 0.11 0.41 -0.24 -0.09 -0.02 0.05 -0.00 -0.00 0.07 0.16 -0.15 0.08 -0.22 -0.17 -0.01 0.07 0.06 0.03 -0.04 -0.02 -0.02 0.01 0.01 -0.01 0.20 -0.03 -0.27 0.05 0.01 0.00 0.03 -0.03 -0.00 -0.03 0.00 -0.01 0.36 0.22 -0.15 -0.01 -0.02 -0.01 -0.01 0.01 0.00 -0.00 -0.01 -0.00 -0.01 -0.00 -0.00 0.01 0.00 0.00 -0.00 -0.00 -0.00 -0.01 -0.00 -0.00 0.01 0.00 0.00 -0.01 -0.00 -0.03 -0.00 0.00 -0.00 -0.07 -0.12 0.14 -0.01 0.02 -0.01 0.01 -0.00 -0.01 -0.04 -0.03 0.01 0.01 0.03 0.00 -0.02 0.00 -0.00 -0.01 0.01 0.00 -0.00 0.01 0.00 -0.01 0.00 -0.00 0.09 0.04 -0.01 -0.05 0.03 -0.07 0.05 -0.07 0.06 -0.02 -0.03 -0.03 -0.01 0.06 0.02 -0.04 -0.03 0.02 0.11 -0.19 -0.07 -0.00 -0.18 -0.05 0.08 0.32 -0.09 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.11 -0.08 -0.03 0.01 0.14 0.04 0.15 -0.04 0.01 -0.08 -0.06 -0.02 -0.00 0.13 0.03 0.16 -0.03 0.01 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.26 -0.35 -0.11 -0.46 -0.08 -0.07 -0.14 -0.03 -0.02 -0.25 -0.32 -0.11 -0.50 -0.07 -0.07 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.01 -0.00 0.00 0.00 0.00 0.01 0.00 0.17 -0.28 -0.05 -0.01 0.24 0.06 0.18 -0.15 -0.02 -0.22 0.34 0.06 0.04 -0.24 -0.05 -0.18 0.11 0.01 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.24 -0.17 -0.07 -0.15 -0.19 -0.06 0.26 -0.37 -0.06 0.25 0.08 0.05 0.22 0.15 0.06 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 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 -0.00 0.00 -0.00 -0.00 -0.00 0.01 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.14 0.07 0.03 -0.21 -0.21 -0.07 0.33 0.08 0.06 -0.15 -0.07 -0.03 0.22 0.24 0.08 -0.31 -0.10 -0.06 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.03 0.28 0.07 -0.36 0.05 -0.03 -0.14 -0.13 -0.05 -0.07 -0.34 -0.09 0.33 -0.09 0.02 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.01 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.01 -0.01 -0.01 -0.00 0.02 -0.00 0.01 -0.00 0.01 0.00 0.00 -0.00 0.00 0.02 -0.00 -0.05 -0.05 -0.02 -0.03 -0.02 0.05 0.01 0.02 -0.03 0.12 -0.08 0.01 -0.21 -0.26 -0.10 0.66 0.28 0.21 -0.34 -0.03 -0.08 -0.02 -0.01 0.01 0.02 0.01 0.01 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.01 -0.00 0.01 0.00 0.00 -0.00 -0.00 -0.00 0.03 0.03 0.00 -0.00 -0.00 0.00 0.04 -0.03 0.01 -0.09 -0.07 -0.06 0.07 -0.05 -0.02 -0.01 -0.01 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 -0.00 0.00 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 -0.13 0.19 0.14 0.04 -0.02 0.02 -0.11 0.22 -0.07 -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.01 -0.00 -0.00 -0.01 0.01 0.00 0.01 -0.00 0.02 0.04 -0.02 0.01 0.00 -0.03 0.02 0.01 -0.02 0.02 0.01 -0.04 -0.26 -0.50 0.60 0.16 0.32 -0.38 0.02 0.00 0.03 0.01 0.00 0.00 -0.08 0.01 -0.01 0.04 0.00 0.01 -0.01 -0.01 -0.02 -0.01 -0.01 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.01 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.01 -0.01 0.05 0.04 0.01 0.02 0.05 0.09 -0.01 0.00 0.01 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.02 -0.03 0.01 -0.03 -0.02 0.01 -0.03 0.02 -0.10 0.02 -0.02 -0.02 -0.01 -0.01 -0.00 0.02 -0.03 0.02 0.00 0.00 0.01 -0.01 -0.00 0.00 -0.00 -0.01 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -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 0.01 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.01 0.06 -0.02 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.29 -0.58 0.60 0.25 0.03 0.02 -0.07 -0.13 -0.36 0.00 0.00 0.00 -0.01 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.00 -0.09 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.14 -0.29 0.27 -0.17 -0.01 -0.03 0.19 0.34 0.80 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.01 0.01 0.01 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.01 0.03 -0.04 -0.01 -0.00 0.01 0.01 -0.01 -0.00 -0.01 0.00 -0.01 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.01 -0.02 0.00 -0.01 0.01 0.01 0.01 0.01 -0.00 -0.00 -0.01 0.01 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.38 -0.39 -0.21 0.46 -0.30 0.25 -0.24 0.29 0.38 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 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 -0.04 -0.02 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 -0.00 0.27 0.11 -0.30 -0.40 0.51 0.13 0.24 -0.12 0.38 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.09 -0.22 0.05 -0.15 0.07 0.19 0.16 0.14 -0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.02 0.03 0.01 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.02 -0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.02 -0.00 0.04 0.00 0.00 0.00 0.00 0.00 -0.00 0.12 0.05 -0.13 -0.18 0.23 0.06 0.11 -0.05 0.17 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.19 0.49 -0.12 0.34 -0.16 -0.41 -0.36 -0.30 0.03 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.01 -0.01 -0.01 -0.01 0.02 -0.01 0.01 -0.01 0.01 0.01 -0.00 -0.00 0.00 -0.04 -0.06 -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 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.51 0.75 0.40 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.01 -0.01 -0.00 -0.00 0.00 -0.01 -0.01 0.01 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.01 -0.02 0.01 -0.01 0.01 0.02 0.00 0.00 0.00 0.00 0.01 -0.01 -0.01 0.00 -0.00 0.00 0.01 0.01 0.01 0.01 0.00 -0.01 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.09 -0.02 -0.02 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.04 0.09 -0.11 0.95 0.06 0.09 0.04 0.09 0.22 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.09 -0.00 -0.04 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.01 -0.00 -0.00 0.00 -0.00 -0.00 0.42 0.45 0.23 0.56 -0.37 0.31 0.04 -0.06 -0.09 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -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 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.02 -0.07 -0.05 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.01 -0.03 0.01 0.02 -0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.32 0.31 0.16 -0.22 0.13 -0.13 -0.37 0.44 0.60 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.06 -0.07 -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 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.25 0.65 -0.17 -0.42 0.19 0.52 0.00 -0.02 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.01 0.01 -0.01 0.01 -0.01 -0.02 0.02 0.02 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 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 0.08 -0.04 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.27 -0.13 0.31 -0.40 0.52 0.14 -0.30 0.14 -0.50 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -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 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.06 -0.06 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 0.00 -0.00 0.00 0.01 -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.14 0.33 -0.08 0.21 -0.11 -0.27 0.66 0.54 -0.04 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.01 0.02 0.03 -0.09 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.51 -0.21 0.54 -0.03 0.05 0.00 0.33 -0.15 0.50 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.01 -0.04 -0.09 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.02 -0.00 0.02 0.01 0.00 -0.04 0.02 0.00 0.01 -0.07 -0.02 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.04 -0.02 -0.00 -0.01 0.18 0.04 -0.19 -0.12 -0.05 0.44 -0.23 -0.01 -0.06 0.78 0.18 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.01 -0.04 -0.08 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.10 0.41 0.90 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.02 0.00 -0.02 -0.01 -0.00 0.04 -0.02 -0.00 -0.01 0.07 0.02 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.01 0.01 0.00 0.00 -0.06 -0.01 0.03 0.02 0.01 -0.01 0.00 -0.00 -0.00 0.03 0.01 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.11 -0.06 -0.00 -0.05 0.72 0.17 -0.41 -0.26 -0.11 0.13 -0.06 -0.00 0.03 -0.39 -0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -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 -0.00 0.04 0.01 0.02 0.01 0.00 -0.06 0.03 0.00 -0.00 0.04 0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.09 0.05 0.00 0.04 -0.49 -0.12 -0.22 -0.13 -0.06 0.63 -0.33 -0.01 0.03 -0.38 -0.09 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -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 0.01 -0.03 -0.01 -0.06 -0.04 -0.02 -0.04 0.02 0.00 0.00 0.01 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.12 -0.06 -0.00 -0.03 0.32 0.08 0.65 0.41 0.17 0.41 -0.22 -0.01 0.01 -0.14 -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 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 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 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.08 0.04 0.00 0.00 0.02 0.00 0.01 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.86 -0.45 -0.01 0.01 -0.19 -0.05 -0.05 -0.03 -0.01 -0.03 0.02 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 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:atomicNumber" size="41">6 6 6 6 6 6 6 8 1 6 6 8 1 6 16 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</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="41">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</array>
                        <array dataType="xsd:integer" dictRef="x:elementType" size="41">6 6 6 6 6 6 6 8 1 6 6 8 1 6 16 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:double" dictRef="cc:atomicmass" size="41">12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 1.00783 12.00000 12.00000 15.99491 1.00783 12.00000 31.97207 12.00000 12.00000 12.00000 12.00000 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 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">311.11058</scalar>
                     <matrix cols="3"
                             dataType="xsd:double"
                             dictRef="cc:moi.eigenvectors"
                             rows="3">0.99999 0.0024 0.00397 -0.0025 0.99966 0.02604 -0.0039 -0.02605 0.99965</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">0.02826 0.00855 0.00794</array>
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.58893 0.17807 0.16536</array>
                     <scalar dataType="xsd:double" dictRef="cc:zpe" units="u:jmol-1">866465.2</scalar>
                     <array dataType="xsd:double" dictRef="cc:vibtemp" size="117">38.86 70.66 89.16 139.16 167.15 173.44 186.68 205.63 211.22 232.68 241.47 274.60 283.62 294.68 318.00 327.53 346.79 386.62 419.75 436.98 451.18 582.41 604.12 605.71 615.40 633.29 693.73 708.87 726.07 742.00 798.13 869.92 901.57 944.92 981.49 1026.56 1039.81 1052.24 1092.42 1102.22 1150.36 1193.58 1229.86 1238.46 1260.23 1292.35 1303.64 1336.20 1344.68 1363.66 1384.62 1444.26 1449.21 1454.80 1472.94 1474.78 1496.94 1502.62 1519.60 1538.23 1569.40 1583.92 1596.53 1612.26 1622.50 1656.32 1663.13 1683.86 1700.84 1704.18 1720.92 1770.17 1810.07 1893.86 1896.68 1901.22 1941.81 1956.16 1979.20 2000.30 2002.74 2025.33 2062.04 2065.65 2068.93 2070.45 2072.85 2076.24 2079.98 2081.78 2112.94 2124.38 2164.35 2174.04 2380.00 2402.49 2467.41 2659.79 4253.95 4332.08 4375.78 4392.30 4393.50 4437.27 4490.12 4505.49 4520.18 4522.96 4529.01 4543.43 4558.60 4599.80 4600.40 4612.36 4623.63 4642.25 4668.03</array>
                  </list>
               </property>
               <property dictRef="cc:zeropoint">
                  <list id="l716.zeropoint">
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.correction"
                             units="nonsi:hartree">0.330019</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.thermalcorrener"
                             units="nonsi:hartree">0.350607</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.thermalcorrenthalpy"
                             units="nonsi:hartree">0.351551</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.thermalcorrgfe"
                             units="nonsi:hartree">0.281452</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectzpe"
                             units="nonsi:hartree">-1281.979928</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectthermal"
                             units="nonsi:hartree">-1281.959340</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectthermalent"
                             units="nonsi:hartree">-1281.958396</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectthermalfe"
                             units="nonsi:hartree">-1282.028495</scalar>
                  </list>
               </property>
               <property>
                  <module cmlx:templateRef="l716.thermoprops">
                     <list cmlx:templateRef="total">
                        <scalar dataType="xsd:double" dictRef="cc:ethermo.total">220.009</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:cv.total">79.811</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:s.total">147.536</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">43.101</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">34.182</scalar>
                     </list>
                     <list cmlx:templateRef="vib">
                        <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">218.232</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:cv.vib">73.850</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:s.vob">70.252</scalar>
                     </list>
                     <list cmlx:templateRef="vibn">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">1</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.593</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.984</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">6.038</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">2</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.595</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.978</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">4.853</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">3</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.597</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.972</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">4.393</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">4</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.603</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.952</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">3.519</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">5</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.608</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.936</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">3.163</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">6</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.609</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.932</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">3.092</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">7</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.612</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.924</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.950</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">8</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.616</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.910</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.764</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">9</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.617</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.906</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.713</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">10</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.622</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.889</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.530</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">11</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.625</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.882</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.460</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">12</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.634</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.852</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.219</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">13</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.637</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.844</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.160</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">14</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">2.089</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">15</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.648</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.809</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.951</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">16</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.651</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.799</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.897</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">17</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.658</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.778</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.795</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">18</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.673</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.731</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.604</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">19</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">1.464</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">20</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.695</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.667</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.396</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">21</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.701</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.648</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.343</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">22</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.770</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.460</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.945</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">23</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.783</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.427</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.892</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">24</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.783</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.425</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.889</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">25</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.789</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.410</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.866</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">26</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.800</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.383</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.826</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">27</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.838</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.290</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.704</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">28</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.848</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.266</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.677</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">29</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.860</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.240</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.647</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">30</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.871</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.215</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.620</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">31</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.910</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.129</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.534</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">32</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.963</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.022</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.442</scalar>
                        </list>
                     </list>
                     <list cmlx:templateRef="totalv0">
                        <scalar dataType="xsd:double" dictRef="cc:q.v0">0.218439e+23</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.v0">22.339331</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.v0">51.438211</scalar>
                     </list>
                     <list cmlx:templateRef="vibv0">
                        <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.153668e+08</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">7.186583</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">16.547719</scalar>
                     </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">0.215688e+09</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.trans">8.333826</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.trans">19.189344</scalar>
                     </list>
                     <list cmlx:templateRef="rot">
                        <scalar dataType="xsd:double" dictRef="cc:q.rot">0.659055e+07</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.rot">6.818922</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.rot">15.701148</scalar>
                     </list>
                  </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">15.5885 1.4368 -1.9703</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">15.7781</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-202.3081 -146.9126 -148.1179</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">4.8844 4.8580 6.2510</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">-36.5286 18.8669 17.6616 4.8844 4.8580 6.2510</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">330.0575 -1.1554 -13.2976 40.9200 -24.9353 15.1952 -0.0968 8.5856 -9.7071 -4.9141</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-7714.5739 -1741.3820 -1071.4442 97.5454 -39.2303 54.7468 7.8854 19.3492 10.1007 -1444.8950 -1438.6532 -487.2271 55.1817 38.8286 -15.3994</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">-1282.3099472</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsd" units="nonsi:unknown">3.944E-9</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsf" units="nonsi:unknown">5.866E-6</scalar>
                  <scalar dataType="xsd:string" dictRef="x:ZeroPoint">0.3300192</scalar>
                  <scalar dataType="xsd:string" dictRef="x:Thermal">0.3506068</scalar>
                  <scalar dataType="xsd:string" dictRef="x:ETot">-1281.9593404</scalar>
                  <scalar dataType="xsd:string" dictRef="x:HTot">-1281.9583963</scalar>
                  <scalar dataType="xsd:string" dictRef="x:GTot">-1282.0284952</scalar>
                  <scalar dataType="xsd:string" dictRef="x:Quadrupole">-27.1580951,14.0271005,13.1309946,3.6314348,3.6118401,4.6474355</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:pointgroup">C01 [X(C19H19O2S1)]</scalar>
                  <array dataType="xsd:double"
                         dictRef="cc:dipole"
                         size="3"
                         units="nonsi:debye">6.1291451 0.56469 -0.7793159</array>
                  <array dataType="xsd:double"
                         dictRef="cc:dipolederiv"
                         size="369"
                         units="nonsi:unknown">0.0513376 0.0007082 0.0647957 0.0722743 -0.0292474 -0.0981625 0.3963951 -0.3093312 0.2060809 0.3979682 0.1581448 -0.0246034 0.0275872 0.0266289 0.0923528 -0.0155201 0.1844766 0.1871691 -0.4116024 -0.1764613 0.1424228 0.0431097 -0.1298671 0.1197042 -0.0507966 0.0481314 0.0912115 -0.0778604 -0.1717616 -0.1984502 -0.0650124 -0.0018407 0.1127998 -0.327504 0.0511614 -0.0776477 0.0644404 -0.0008562 -0.074354 -0.1891017 -0.0224645 -0.1049578 0.077211 -0.0492385 0.0450326 -0.3844365 0.4584838 -0.2416556 0.4640954 -0.287171 0.1419052 -0.175087 0.1543128 -0.2923869 0.8889274 0.207375 -0.0055186 0.3963052 1.0988482 -0.7450122 0.1402919 -0.8993948 1.1878593 -0.5889893 -0.3547747 0.1704723 -0.3087755 -1.0892643 0.5813325 0.0894377 0.7438212 -1.1436715 -0.0216311 -0.1202059 -0.0546106 -0.1141503 -0.1087919 -0.0875437 -0.0417157 -0.0971984 0.0213283 -0.6538136 -0.0878184 -0.0544398 -0.3822752 -0.6901157 -0.0714167 -0.2873454 -0.1389281 -0.7744361 2.1163467 0.3410605 0.6455417 0.1056183 0.8494543 0.2445568 0.5856027 0.4448812 0.241792 -2.3559471 -0.3826905 -0.5413082 -0.0027318 -0.7758505 -0.1066528 -0.4323673 -0.1856732 -0.5702486 0.06925 0.0019312 0.0531093 -0.0398595 0.0898917 -0.0955925 0.0442138 -0.0752795 -0.0414402 0.0829499 -0.0438734 0.055802 -0.0199492 0.1406416 0.0286032 0.0363537 0.0282651 0.0409411 -0.3916167 -0.1229934 -0.0227132 -0.3714051 -0.0675126 -0.0005564 -0.2320086 0.0199853 -0.2237023 0.8961855 0.4338605 0.1912717 0.7359414 0.0746979 0.0862078 0.3529846 0.0466087 0.0086384 -0.2840423 -0.0735225 -0.0306769 -0.4006591 -0.2263877 -0.0598375 -0.1581796 -0.0370409 -0.1678466 0.1813483 -0.0262432 0.0193835 0.0358106 0.0896675 0.0522148 0.0530725 0.0594738 -0.1214244 -0.2095857 0.0640127 0.0167896 -0.0288689 -0.1686193 0.0024675 -0.0147868 0.0087163 -0.1698593 0.1272454 0.0182449 0.035704 0.0901501 0.1008056 0.0654579 0.0537582 0.0587339 -0.1181621 -0.5815033 -0.1435347 -0.078681 -0.1504332 0.0361168 0.027612 -0.0593925 0.0432756 -0.1418188 0.0323614 -0.0179575 0.0113046 0.026989 0.0552505 -0.0044626 0.026422 -0.0150711 0.0212469 -0.0168338 -0.1048344 -0.0608248 -0.0520788 0.4156857 -0.0058511 -0.0184815 -0.0162653 0.3416155 0.0278291 0.043578 -0.0030144 0.0722672 0.0668066 -0.0021401 0.0334062 0.0130279 -0.0087278 -0.0353118 -0.0682348 0.0566474 -0.0648771 0.0392265 -0.0020793 0.1271243 0.0740266 -0.0051015 -0.0153784 0.145904 0.0386911 0.0539273 -0.1442728 -0.074446 0.001751 -0.0549062 0.0599144 -0.0023767 -0.058066 -0.1234544 0.019746 0.0699779 0.0651539 -0.1014019 -0.0056071 -0.0693596 0.0733999 0.0703741 0.0106233 0.085166 0.0866176 -0.0128978 0.0121122 -0.0150803 0.1585723 0.0899089 0.0209831 -0.0006354 -0.0135565 -0.0729274 -0.0530189 -0.0035147 -0.0517686 0.1303207 -0.0391465 -0.0802607 -0.0397824 -0.08614 0.0555446 -0.033734 -0.0446791 -0.0350201 0.1429798 -0.0816905 0.0806439 -0.0041034 0.0776455 0.0693146 -0.0103841 -0.0085042 -0.0108573 0.1434587 0.1351343 -0.0427921 -0.0132282 0.0164267 -0.0438923 -0.0447887 0.0001127 -0.0504247 0.1380688 0.0437562 0.0579285 -0.0671703 0.0895656 -0.0887412 0.0766046 -0.0702091 0.0156295 0.0263663 0.0047381 0.0490937 0.123772 0.0283649 0.077307 -0.0524087 0.0589478 -0.0363382 -0.0883191 -0.0695426 -0.0882038 -0.061627 -0.1363753 -0.0055762 -0.0021841 -0.0259506 0.0314952 0.0589704 0.0607654 -0.0550523 0.0853923 0.017669 -0.353335 0.0814116 0.04724 0.2161237 -0.0778291 -0.1783226 0.109884 0.0142367 -0.0430667 0.097805 0.0058596 -0.0405304 0.0298408 0.0703967 0.0707946 0.0030483 -0.0610643 0.0507182 -0.1806724 -0.1243145 -0.0064471 -0.220379 -0.2075832 -0.0240834 -0.1451699 0.0017238 -0.1392343 -0.0533711 0.0028957 -0.0546811 -0.0415947 0.0166353 -0.0374479 0.0947185 -0.0880129 0.0601075 -0.0043828 0.0945067 -0.0686597 0.094159 0.0145617 0.0464757 0.0053294 0.1122449 0.0390655 0.0040152 -0.0892045 0.1013255 -0.0207488 -0.0535957</array>
                  <array dataType="xsd:double"
                         delimiter="|"
                         dictRef="cc:polarizability"
                         size="6"
                         units="nonsi:unknown">369.2568455|7.3235316|296.3262041|20.1165193|17.2813264|212.2358126</array>
               </module>
            </module>
            <molecule formalCharge="-1" id="mol9999" spinMultiplicity="1">
               <atomArray>
                  <atom elementType="C"
                        id="a1"
                        x3="-0.50943106"
                        y3="0.74400747"
                        z3="-0.98833472">
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.41" size="3">-0.000007047 -0.000000021 0.000004561</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.42" size="3">0.000003092 -0.000001141 0.000002632</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.43" size="3">-0.000000149 -0.000005654 -0.000010854</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.44" size="3">0.000008499 -0.000002533 0.000002037</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.45" size="3">0.000003425 0.000007467 -0.000001267</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.46" size="3">-0.000006159 0.000020604 -0.000001556</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.47" size="3">0.000005270 -0.000011065 0.000014958</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.48" size="3">0.000001418 -0.000000862 -0.000016613</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.49" size="3">-0.000002580 -0.000003214 0.000003981</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.50" size="3">0.000003092 -0.000001373 0.000002554</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.51" size="3">-0.000005656 -0.000012050 -0.000016097</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.52" size="3">0.000003162 0.000004913 0.000003364</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.53" size="3">-0.000001714 0.000003160 -0.000003064</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.54" size="3">0.000002187 -0.000012220 -0.000010033</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.55" size="3">-0.000002048 0.000011826 0.000000090</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.56" size="3">-0.000007411 -0.000019726 -0.000004436</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.57" size="3">0.000004900 0.000012029 0.000005555</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.58" size="3">-0.000002419 -0.000003248 0.000001597</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.59" size="3">0.000000850 -0.000002470 0.000002643</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.60" size="3">-0.000002458 -0.000001675 -0.000001902</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.61" size="3">0.000009280 0.000006313 -0.000000020</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.62" size="3">0.000001839 0.000002239 0.000006118</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.63" size="3">0.000001429 0.000002128 0.000007380</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.64" size="3">0.000001232 0.000006089 -0.000004593</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.65" size="3">-0.000000946 0.000000221 -0.000005261</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.66" size="3">-0.000001377 0.000005777 -0.000003757</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.67" size="3">-0.000001536 0.000007856 -0.000002603</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.68" size="3">0.000000272 -0.000003483 0.000001102</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.69" size="3">0.000000340 -0.000002018 0.000005789</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.70" size="3">0.000000693 -0.000002988 0.000002504</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.71" size="3">0.000000432 0.000000233 -0.000000988</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.72" size="3">-0.000003701 -0.000001120 -0.000005402</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.73" size="3">-0.000002727 -0.000007645 -0.000001414</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.74" size="3">0.000000599 -0.000006028 -0.000000796</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.75" size="3">-0.000001134 -0.000007304 -0.000003007</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.76" size="3">-0.000004901 0.000002188 0.000005293</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.77" size="3">-0.000001291 0.000004470 0.000006433</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.78" size="3">0.000002345 -0.000004817 0.000001827</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.79" size="3">0.000002791 0.000001970 0.000002563</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.80" size="3">0.000000101 0.000006967 0.000008650</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.81" size="3">-0.000001993 0.000006206 0.000002031</array>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a2"
                        x3="-1.09855483"
                        y3="1.19845203"
                        z3="0.36625819"/>
                  <atom elementType="C"
                        id="a3"
                        x3="-0.5999311"
                        y3="-0.15751252"
                        z3="1.01705257"/>
                  <atom elementType="C"
                        id="a4"
                        x3="0.07965712"
                        y3="-0.48524753"
                        z3="-0.335721"/>
                  <atom elementType="C"
                        id="a5"
                        x3="-1.16503291"
                        y3="-0.58144599"
                        z3="-1.21451912"/>
                  <atom elementType="C"
                        id="a6"
                        x3="-2.41314611"
                        y3="-0.91201727"
                        z3="-0.3782588"/>
                  <atom elementType="C"
                        id="a7"
                        x3="-1.80685735"
                        y3="-1.07985822"
                        z3="0.99929222"/>
                  <atom elementType="O"
                        id="a8"
                        x3="-2.17537475"
                        y3="-1.82064391"
                        z3="1.88335683"/>
                  <atom elementType="H"
                        id="a9"
                        x3="-0.53075961"
                        y3="2.03649758"
                        z3="0.80178026"/>
                  <atom elementType="C"
                        id="a10"
                        x3="-2.57945851"
                        y3="1.42637752"
                        z3="0.33236693"/>
                  <atom elementType="C"
                        id="a11"
                        x3="-3.32698215"
                        y3="0.36576937"
                        z3="-0.17880083"/>
                  <atom elementType="O"
                        id="a12"
                        x3="-4.54522005"
                        y3="0.29156888"
                        z3="-0.45860184"/>
                  <atom elementType="H"
                        id="a13"
                        x3="-1.05385258"
                        y3="-1.0350854"
                        z3="-2.20328538"/>
                  <atom elementType="C"
                        id="a14"
                        x3="-3.20450498"
                        y3="-2.10407756"
                        z3="-0.85465765"/>
                  <atom elementType="S"
                        id="a15"
                        x3="1.48505411"
                        y3="-1.48520284"
                        z3="-0.66436202"/>
                  <atom elementType="C"
                        id="a16"
                        x3="2.88118292"
                        y3="-0.48466252"
                        z3="-0.2318392"/>
                  <atom elementType="C"
                        id="a17"
                        x3="2.80047572"
                        y3="0.87537409"
                        z3="0.08858268"/>
                  <atom elementType="C"
                        id="a18"
                        x3="3.95805622"
                        y3="1.59085602"
                        z3="0.39224185"/>
                  <atom elementType="C"
                        id="a19"
                        x3="5.2058758"
                        y3="0.96820174"
                        z3="0.3769266"/>
                  <atom elementType="C"
                        id="a20"
                        x3="5.28669006"
                        y3="-0.38782023"
                        z3="0.05512831"/>
                  <atom elementType="C"
                        id="a21"
                        x3="4.13611704"
                        y3="-1.11236458"
                        z3="-0.2446335"/>
                  <atom elementType="C"
                        id="a22"
                        x3="0.169768"
                        y3="-0.11853204"
                        z3="2.30456194"/>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.17051021"
                        y3="2.78636615"
                        z3="0.52789727"/>
                  <atom elementType="C"
                        id="a24"
                        x3="-0.00652247"
                        y3="1.62526305"
                        z3="-2.08178773"/>
                  <atom elementType="H"
                        id="a25"
                        x3="-3.92184693"
                        y3="-2.40876381"
                        z3="-0.07974161"/>
                  <atom elementType="H"
                        id="a26"
                        x3="-2.54982624"
                        y3="-2.96319896"
                        z3="-1.07497768"/>
                  <atom elementType="H"
                        id="a27"
                        x3="-3.78111472"
                        y3="-1.84696516"
                        z3="-1.75494317"/>
                  <atom elementType="H"
                        id="a28"
                        x3="1.8315859"
                        y3="1.3749761"
                        z3="0.10112153"/>
                  <atom elementType="H"
                        id="a29"
                        x3="3.87777761"
                        y3="2.65212403"
                        z3="0.64294348"/>
                  <atom elementType="H"
                        id="a30"
                        x3="6.10935061"
                        y3="1.53439257"
                        z3="0.61588908"/>
                  <atom elementType="H"
                        id="a31"
                        x3="6.25666692"
                        y3="-0.89219951"
                        z3="0.04100932"/>
                  <atom elementType="H"
                        id="a32"
                        x3="4.20933434"
                        y3="-2.17625325"
                        z3="-0.48841505"/>
                  <atom elementType="H"
                        id="a33"
                        x3="0.56088684"
                        y3="-1.11618629"
                        z3="2.55983425"/>
                  <atom elementType="H"
                        id="a34"
                        x3="-0.49149279"
                        y3="0.1971248"
                        z3="3.12731043"/>
                  <atom elementType="H"
                        id="a35"
                        x3="1.01863797"
                        y3="0.57898927"
                        z3="2.25824247"/>
                  <atom elementType="H"
                        id="a36"
                        x3="-2.82491421"
                        y3="3.54165917"
                        z3="-0.21086201"/>
                  <atom elementType="H"
                        id="a37"
                        x3="-4.26563711"
                        y3="2.71705984"
                        z3="0.42439098"/>
                  <atom elementType="H"
                        id="a38"
                        x3="-2.95812445"
                        y3="3.22407127"
                        z3="1.52380714"/>
                  <atom elementType="H"
                        id="a39"
                        x3="0.71696604"
                        y3="2.36718358"
                        z3="-1.70692055"/>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.84325802"
                        y3="2.17570879"
                        z3="-2.54315484"/>
                  <atom elementType="H"
                        id="a41"
                        x3="0.48637595"
                        y3="1.03975528"
                        z3="-2.87403565"/>
               </atomArray>
               <bondArray/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">292.26709999999986</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1S/C19H19O2S/c1-10-12-17(3)14-16(2,13(10)20)15(21)18(12,4)19(14,17)22-11-8-6-5-7-9-11/h5-9,12,14H,1-4H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:23,14,24,22,19,18,20,17,21,10,16,2,11,5,7,6,1,3,4,12,8,15/E:(6,7)(8,9)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,13.3,15.3,20.1,21.1/rA:41CCCCCCC3O1HC3C3O1HCSC3C3C3C3C3C3CCCHHHHHHHHHHHHHHHHH/rB:s1;s2;s1s3;s1s4;s5;s3s6;s7;s2;s2;s6s10;s11;s5;s6;s4;s15;s16;s17;s18;s19;s16s20;s3;s10;s1;s14;s14;s14;s17;s18;s19;s20;s21;s22;s22;s22;s23;s23;s23;s24;s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
         </module>
      </module>
   </module>
</module>
