<?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-BELVIS4</scalar>
               </parameter>
               <parameter dictRef="cc:jobname">
                  <scalar dataType="xsd:string">APULGAR</scalar>
               </parameter>
               <parameter dictRef="cc:title">
                  <scalar dataType="xsd:string">Optimization Resmethrin_RS CONF10 gas</scalar>
               </parameter>
               <parameter dictRef="cc:version">
                  <scalar dataType="xsd:string">EM64L-G16RevC.01</scalar>
               </parameter>
               <parameter dictRef="cc:run.date">
                  <scalar dataType="xsd:string">9-Oct-2024</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">EM64L-G16RevC.01</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:nactiveatoms">
                  <scalar dataType="xsd:integer">51</scalar>
               </parameter>
               <parameter dictRef="cc:natoms">
                  <scalar dataType="xsd:integer">51</scalar>
               </parameter>
               <parameter dictRef="cc:betae">
                  <scalar dataType="xsd:integer">91</scalar>
               </parameter>
               <parameter dictRef="cc:alphae">
                  <scalar dataType="xsd:integer">91</scalar>
               </parameter>
               <parameter dictRef="cc:basiscount">
                  <scalar dataType="xsd:integer">706</scalar>
               </parameter>
               <parameter dictRef="cc:diffuse">
                  <scalar dataType="xsd:string">(5D, 7F)</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">6-311+G(d,p)</scalar>
               </parameter>
               <parameter dictRef="cc:degfreedom">
                  <scalar cmlx:templateRef="degfreedom" dataType="xsd:integer">147</scalar>
               </parameter>
               <parameter dictRef="cc:degfreedom">
                  <scalar cmlx:templateRef="degfreedom" dataType="xsd:integer">147</scalar>
               </parameter>
               <parameter dictRef="cc:frameworkgroup">
                  <scalar cmlx:templateRef="framework" dataType="xsd:string">C1[X(C22H26O3)]</scalar>
               </parameter>
               <parameter dictRef="cc:frameworkgroup">
                  <scalar cmlx:templateRef="framework" dataType="xsd:string">C1[X(C22H26O3)]</scalar>
               </parameter>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string">RB3LYP</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">6-311+G(d,p)</scalar>
               </parameter>
               <parameter dictRef="g:operation">
                  <scalar dataType="xsd:string">FOpt</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">#P</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">B3LYP</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">6-311+G(d,p)</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">EmpiricalDispersion=gd3</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">opt</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">freq</scalar>
               </parameter>
            </parameterList>
            <molecule cmlx:templateRef="mol"
                      formalCharge="0"
                      id="zmat"
                      spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="2.20396"
                        y3="2.03766"
                        z3="0.02161"/>
                  <atom elementType="O"
                        id="a2"
                        x3="1.8099"
                        y3="0.28527"
                        z3="1.35742"/>
                  <atom elementType="O"
                        id="a3"
                        x3="-1.99501"
                        y3="3.2508"
                        z3="-0.82818"/>
                  <atom elementType="C"
                        id="a4"
                        x3="4.24041"
                        y3="-1.03317"
                        z3="-0.05706"/>
                  <atom elementType="C"
                        id="a5"
                        x3="3.04427"
                        y3="-1.38735"
                        z3="-0.87059"/>
                  <atom elementType="C"
                        id="a6"
                        x3="3.30677"
                        y3="0.0753"
                        z3="-0.50078"/>
                  <atom elementType="C"
                        id="a7"
                        x3="4.33459"
                        y3="-1.44564"
                        z3="1.39165"/>
                  <atom elementType="C"
                        id="a8"
                        x3="5.57939"
                        y3="-1.05099"
                        z3="-0.75837"/>
                  <atom elementType="C"
                        id="a9"
                        x3="1.89783"
                        y3="-2.14142"
                        z3="-0.30952"/>
                  <atom elementType="C"
                        id="a10"
                        x3="2.37275"
                        y3="0.76656"
                        z3="0.40923"/>
                  <atom elementType="C"
                        id="a11"
                        x3="0.65429"
                        y3="-2.10956"
                        z3="-0.7877"/>
                  <atom elementType="C"
                        id="a12"
                        x3="-0.44128"
                        y3="-2.90574"
                        z3="-0.15065"/>
                  <atom elementType="C"
                        id="a13"
                        x3="0.23612"
                        y3="-1.25787"
                        z3="-1.94613"/>
                  <atom elementType="C"
                        id="a14"
                        x3="1.27222"
                        y3="2.83505"
                        z3="0.75389"/>
                  <atom elementType="C"
                        id="a15"
                        x3="-0.10667"
                        y3="2.71962"
                        z3="0.20768"/>
                  <atom elementType="C"
                        id="a16"
                        x3="-1.0129"
                        y3="1.61144"
                        z3="0.29158"/>
                  <atom elementType="C"
                        id="a17"
                        x3="-0.76575"
                        y3="3.67455"
                        z3="-0.48678"/>
                  <atom elementType="C"
                        id="a18"
                        x3="-2.13969"
                        y3="1.99165"
                        z3="-0.35655"/>
                  <atom elementType="C"
                        id="a19"
                        x3="-3.44687"
                        y3="1.33877"
                        z3="-0.64788"/>
                  <atom elementType="C"
                        id="a20"
                        x3="-3.60272"
                        y3="-0.02221"
                        z3="-0.02513"/>
                  <atom elementType="C"
                        id="a21"
                        x3="-3.56838"
                        y3="-0.18143"
                        z3="1.35831"/>
                  <atom elementType="C"
                        id="a22"
                        x3="-3.83296"
                        y3="-1.14136"
                        z3="-0.8166"/>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.75853"
                        y3="-1.42813"
                        z3="1.93228"/>
                  <atom elementType="C"
                        id="a24"
                        x3="-4.03592"
                        y3="-2.38971"
                        z3="-0.24485"/>
                  <atom elementType="C"
                        id="a25"
                        x3="-3.99821"
                        y3="-2.5370"
                        z3="1.13199"/>
                  <atom elementType="H"
                        id="a26"
                        x3="3.24462"
                        y3="-1.5863"
                        z3="-1.92038"/>
                  <atom elementType="H"
                        id="a27"
                        x3="3.67692"
                        y3="0.70153"
                        z3="-1.30416"/>
                  <atom elementType="H"
                        id="a28"
                        x3="3.38265"
                        y3="-1.42472"
                        z3="1.9127"/>
                  <atom elementType="H"
                        id="a29"
                        x3="4.73762"
                        y3="-2.4584"
                        z3="1.45751"/>
                  <atom elementType="H"
                        id="a30"
                        x3="5.01888"
                        y3="-0.78655"
                        z3="1.92884"/>
                  <atom elementType="H"
                        id="a31"
                        x3="6.01468"
                        y3="-2.05157"
                        z3="-0.72734"/>
                  <atom elementType="H"
                        id="a32"
                        x3="5.49676"
                        y3="-0.7606"
                        z3="-1.80671"/>
                  <atom elementType="H"
                        id="a33"
                        x3="6.28217"
                        y3="-0.36695"
                        z3="-0.27942"/>
                  <atom elementType="H"
                        id="a34"
                        x3="2.09887"
                        y3="-2.76997"
                        z3="0.55134"/>
                  <atom elementType="H"
                        id="a35"
                        x3="-0.07346"
                        y3="-3.52638"
                        z3="0.66561"/>
                  <atom elementType="H"
                        id="a36"
                        x3="-0.93567"
                        y3="-3.55699"
                        z3="-0.8760"/>
                  <atom elementType="H"
                        id="a37"
                        x3="-1.21657"
                        y3="-2.24899"
                        z3="0.25071"/>
                  <atom elementType="H"
                        id="a38"
                        x3="1.0607"
                        y3="-0.70088"
                        z3="-2.38733"/>
                  <atom elementType="H"
                        id="a39"
                        x3="-0.51965"
                        y3="-0.53239"
                        z3="-1.63284"/>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.22069"
                        y3="-1.86564"
                        z3="-2.7317"/>
                  <atom elementType="H"
                        id="a41"
                        x3="1.62919"
                        y3="3.85996"
                        z3="0.64998"/>
                  <atom elementType="H"
                        id="a42"
                        x3="1.29731"
                        y3="2.57446"
                        z3="1.81304"/>
                  <atom elementType="H"
                        id="a43"
                        x3="-0.83221"
                        y3="0.66542"
                        z3="0.77505"/>
                  <atom elementType="H"
                        id="a44"
                        x3="-0.49241"
                        y3="4.67164"
                        z3="-0.79358"/>
                  <atom elementType="H"
                        id="a45"
                        x3="-3.57912"
                        y3="1.26042"
                        z3="-1.73142"/>
                  <atom elementType="H"
                        id="a46"
                        x3="-4.2559"
                        y3="1.99102"
                        z3="-0.30011"/>
                  <atom elementType="H"
                        id="a47"
                        x3="-3.3913"
                        y3="0.67929"
                        z3="1.99195"/>
                  <atom elementType="H"
                        id="a48"
                        x3="-3.85936"
                        y3="-1.03632"
                        z3="-1.89467"/>
                  <atom elementType="H"
                        id="a49"
                        x3="-3.72477"
                        y3="-1.53407"
                        z3="3.00866"/>
                  <atom elementType="H"
                        id="a50"
                        x3="-4.21596"
                        y3="-3.24816"
                        z3="-0.87855"/>
                  <atom elementType="H"
                        id="a51"
                        x3="-4.1510"
                        y3="-3.50956"
                        z3="1.58069"/>
               </atomArray>
               <bondArray/>
               <formula concise="C22H26O3"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">312.2335999999998</scalar>
               </property>
               <list cmlx:templateRef="charge">
                  <list>
                     <scalar dataType="xsd:integer" dictRef="g:charge">0</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:mult">1</scalar>
                  </list>
               </list>
               <formula convention="iupac:inchi" inline="InChI=1/22C.3O.26H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;1;2;3;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/rA:51nO0O0O0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.204,2.0377,.0216;1.8099,.2853,1.3574;-1.995,3.2508,-.8282;4.2404,-1.0332,-.0571;3.0443,-1.3874,-.8706;3.3068,.0753,-.5008;4.3346,-1.4456,1.3917;5.5794,-1.051,-.7584;1.8978,-2.1414,-.3095;2.3727,.7666,.4092;.6543,-2.1096,-.7877;-.4413,-2.9057,-.1507;.2361,-1.2579,-1.9461;1.2722,2.835,.7539;-.1067,2.7196,.2077;-1.0129,1.6114,.2916;-.7658,3.6745,-.4868;-2.1397,1.9916,-.3565;-3.4469,1.3388,-.6479;-3.6027,-.0222,-.0251;-3.5684,-.1814,1.3583;-3.833,-1.1414,-.8166;-3.7585,-1.4281,1.9323;-4.0359,-2.3897,-.2449;-3.9982,-2.537,1.132;3.2446,-1.5863,-1.9204;3.6769,.7015,-1.3042;3.3826,-1.4247,1.9127;4.7376,-2.4584,1.4575;5.0189,-.7865,1.9288;6.0147,-2.0516,-.7273;5.4968,-.7606,-1.8067;6.2822,-.3669,-.2794;2.0989,-2.77,.5513;-.0735,-3.5264,.6656;-.9357,-3.557,-.876;-1.2166,-2.249,.2507;1.0607,-.7009,-2.3873;-.5196,-.5324,-1.6328;-.2207,-1.8656,-2.7317;1.6292,3.86,.65;1.2973,2.5745,1.813;-.8322,.6654,.7751;-.4924,4.6716,-.7936;-3.5791,1.2604,-1.7314;-4.2559,1.991,-.3001;-3.3913,.6793,1.992;-3.8594,-1.0363,-1.8947;-3.7248,-1.5341,3.0087;-4.216,-3.2482,-.8786;-4.151,-3.5096,1.5807;</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="3">/usr/local/gaussian/gaussian16/g16/l1.exe "/temporal/apulgar/opt-b3lyp-pople.com-6500858/Gau-1958522.inp" -scrdir="/temporal/apulgar/opt-b3lyp-pople.com-6500858/"</array>
               </module>
               <module cmlx:templateRef="l1" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l1.end">
                     <array dataType="xsd:string" dictRef="g:kk" size="1">chk=opt-b3lyp-pople.chk</array>
                     <scalar cmlx:templateRef="title" dataType="xsd:string" dictRef="cc:title">#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 opt freq</scalar>
                     <list cmlx:templateRef="control">
                        <scalar dataType="xsd:string" dictRef="g:control">1/18=20,19=15,26=3,38=1/1,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">2/9=110,12=2,17=6,18=5,40=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">3/5=4,6=6,7=111,11=2,25=1,30=1,71=1,74=-5,124=31/1,2,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">4//1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">5/5=2,38=5/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">6/7=2,8=2,9=2,10=2,28=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">7//1,2,3,16</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">1/18=20,19=15,26=3/3(2)</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">2/9=110/2</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=110/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">3/5=4,6=6,7=111,11=2,25=1,30=1,71=1,74=-5,124=31/1,2,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">4/5=5,16=3,69=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">5/5=2,38=5/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">7//1,2,3,16</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">1/18=20,19=15,26=3/3(-5)</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">2/9=110/2</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">Optimization Resmethrin_RS CONF10 gas</scalar>
                  </module>
                  <module cmlx:templateRef="l101.isotope2">
                     <array cmlx:templateRef="atom"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">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</array>
                     <array cmlx:templateRef="iatwgt"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">16 16 16 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 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</array>
                     <array cmlx:templateRef="atmwgt"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="51">15.9949146 15.9949146 15.9949146 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250</array>
                     <array cmlx:templateRef="nucspn"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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</array>
                     <array cmlx:templateRef="atzeff"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="51">-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000</array>
                  </module>
                  <list cmlx:templateRef="rest">
                     <scalar dataType="xsd:string" dictRef="x:l101">(Enter /usr/local/gaussian/gaussian16/g16/l101.exe)</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="53">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 R46 R47 R48 R49 R50 R51 R52 R53</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="53">1 1 2 3 3 4 4 4 4 5 5 5 6 6 7 7 7 8 8 8 9 9 11 11 12 12 12 13 13 13 14 14 14 15 15 16 16 17 18 19 19 19 20 20 21 21 22 22 23 23 24 24 25</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="53">10 14 10 17 18 5 6 7 8 6 9 26 10 27 28 29 30 31 32 33 11 34 12 13 35 36 37 38 39 40 15 41 42 16 17 18 43 44 19 20 45 46 21 22 23 47 24 48 25 49 25 50 51</array>
                        <array dataType="xsd:double" dictRef="cc:distance" size="53">1.3396 1.4284 1.2031 1.3443 1.3523 1.4893 1.5157 1.5092 1.5116 1.5313 1.4825 1.0871 1.4759 1.0838 1.0854 1.092 1.0914 1.0916 1.0909 1.0914 1.3327 1.0847 1.4967 1.4974 1.0894 1.093 1.0925 1.0885 1.0935 1.0932 1.4876 1.0903 1.091 1.434 1.3522 1.3544 1.0777 1.0784 1.4899 1.5048 1.0944 1.0959 1.393 1.3899 1.3856 1.0834 1.388 1.0835 1.3883 1.0821 1.3852 1.0821 1.0819</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="53">estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|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="92">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 A86 A87 A88 A89 A90 A91 A92</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="92">10 17 5 5 6 6 7 4 4 6 6 9 4 4 5 5 10 4 4 4 28 28 29 4 4 4 31 31 32 5 5 11 1 1 2 9 9 12 11 11 11 35 35 36 11 11 11 38 38 39 1 1 1 15 15 41 14 14 16 15 15 18 3 3 15 3 3 16 18 18 18 20 20 45 19 19 21 20 20 23 20 20 24 21 21 25 22 22 25 23 23 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="92">1 3 4 4 4 4 4 5 5 5 5 5 6 6 6 6 6 7 7 7 7 7 7 8 8 8 8 8 8 9 9 9 10 10 10 11 11 11 12 12 12 12 12 12 13 13 13 13 13 13 14 14 14 14 14 14 15 15 15 16 16 16 17 17 17 18 18 18 19 19 19 19 19 19 20 20 20 21 21 21 22 22 22 23 23 23 24 24 24 25 25 25</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="92">14 18 7 8 7 8 8 9 26 9 26 26 10 27 10 27 27 28 29 30 29 30 30 31 32 33 32 33 33 11 34 34 2 6 6 12 13 13 35 36 37 36 37 37 38 39 40 39 40 40 15 41 42 41 42 42 16 17 17 18 43 43 15 44 44 16 19 19 20 45 46 45 46 46 21 22 22 23 47 47 24 48 48 25 49 49 25 50 50 24 51 51</array>
                        <array dataType="xsd:double" dictRef="cc:angle" size="92">117.6181 107.6231 120.6283 117.0773 121.2869 114.7356 112.7587 122.3666 115.024 121.8035 112.1119 114.5135 123.4938 115.4173 119.1937 115.5583 113.738 113.6285 109.5355 110.2756 108.2163 107.5755 107.3964 110.5382 112.0617 111.0623 107.5476 107.7723 107.6765 125.0045 116.8578 118.1359 123.2768 110.2279 126.4855 121.1713 123.4884 115.3049 112.0143 111.4439 110.8584 108.0899 107.8683 106.3204 113.1453 110.4106 110.8791 107.4702 108.0444 106.6136 111.9059 105.2096 110.4476 109.9641 111.053 108.031 128.6272 125.8416 105.5312 106.3096 126.7753 126.915 110.7017 116.8048 132.4918 109.8327 115.7009 134.4662 113.9703 109.329 108.956 109.4195 109.3005 105.5219 120.7864 120.6455 118.5271 120.7213 119.6092 119.6695 120.9197 119.5085 119.571 120.2348 119.7264 120.038 120.0725 119.7766 120.1492 119.5199 120.2175 120.2622</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="92">estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|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="121">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</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="121">14 14 10 10 10 18 18 17 17 7 7 8 8 7 7 8 8 5 5 5 6 6 6 8 8 8 5 5 5 6 6 6 7 7 7 9 9 26 26 4 4 6 6 26 26 4 4 5 5 27 27 5 5 34 34 9 9 9 13 13 13 9 9 9 12 12 12 1 1 41 41 42 42 14 14 17 17 14 14 16 16 15 15 43 43 3 3 3 16 16 16 18 18 45 45 46 46 19 19 22 22 19 19 21 21 20 20 47 47 20 20 48 48 21 21 49 49 22 22 50 50</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="121">1 1 1 1 1 3 3 3 3 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 9 9 9 9 11 11 11 11 11 11 11 11 11 11 11 11 14 14 14 14 14 14 15 15 15 15 15 15 15 15 16 16 16 16 18 18 18 18 18 18 19 19 19 19 19 19 20 20 20 20 20 20 20 20 21 21 21 21 22 22 22 22 23 23 23 23 24 24 24 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="121">10 10 14 14 14 17 17 18 18 5 5 5 5 6 6 6 6 7 7 7 7 7 7 7 7 7 8 8 8 8 8 8 8 8 8 6 6 6 6 9 9 9 9 9 9 10 10 10 10 10 10 11 11 11 11 12 12 12 12 12 12 13 13 13 13 13 13 15 15 15 15 15 15 16 16 16 16 17 17 17 17 18 18 18 18 19 19 19 19 19 19 20 20 20 20 20 20 21 21 21 21 22 22 22 22 23 23 23 23 24 24 24 24 25 25 25 25 25 25 25 25</array>
                        <array dataType="xsd:integer" dictRef="g:atom4" size="121">2 6 15 41 42 15 44 16 19 9 26 9 26 10 27 10 27 28 29 30 28 29 30 28 29 30 31 32 33 31 32 33 31 32 33 10 27 10 27 11 34 11 34 11 34 1 2 1 2 1 2 12 13 12 13 35 36 37 35 36 37 38 39 40 38 39 40 16 17 16 17 16 17 18 43 18 43 3 44 3 44 3 19 3 19 20 45 46 20 45 46 21 22 21 22 21 22 23 47 23 47 24 48 24 48 25 49 25 49 25 50 25 50 24 51 24 51 23 51 23 51</array>
                        <array dataType="xsd:double" dictRef="cc:dihed" size="121">-2.1565 176.7699 -88.3595 152.2548 35.9144 -0.4311 179.9704 0.3809 -179.4907 0.4618 -146.4659 144.323 -2.6048 -3.9898 144.1022 -145.1021 2.99 -35.5026 85.6472 -156.3654 37.4034 158.5532 -83.4594 179.2085 -59.6416 58.3457 -87.1209 32.8285 153.3037 -156.0866 -36.1373 84.3379 59.4905 179.4398 -60.0849 -1.7526 -142.8623 139.4089 -1.7008 156.1255 -24.3622 83.5216 -96.9661 -56.7938 122.7184 148.2604 -32.8559 -142.081 36.8026 -0.3055 178.5781 -179.8856 -2.1509 0.6079 178.3426 -3.7501 -124.9916 116.7959 178.3396 57.0981 -61.1144 2.6077 -117.8847 124.1817 -179.5362 59.9714 -57.9622 72.1581 -107.8403 -171.2956 8.7059 -51.7771 128.2244 179.9322 -0.0263 -0.0691 179.9725 -179.6933 -0.1793 0.3079 179.8219 -0.1905 179.6475 179.7679 -0.3941 -175.9818 61.2289 -53.6265 4.1873 -118.6019 126.5426 61.5735 -120.7907 -175.6867 1.9491 -60.5926 117.0433 177.7346 -2.248 0.0497 -179.9329 -177.1501 2.5314 0.5383 -179.7803 -0.5598 179.764 179.4229 -0.2534 -0.6182 179.853 179.7005 0.1718 0.4814 -179.7292 -179.8433 -0.0539 0.1014 -179.688 179.6283 -0.161</array>
                        <array dataType="xsd:string"
                               delimiter="|"
                               dictRef="g:deriv"
                               size="121">estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|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="g:primbasis">
                  <module cmlx:templateRef="ernie">
                     <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                     <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                     <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                  </module>
                  <list cmlx:templateRef="symmadaptcart">
                     <array dataType="xsd:integer" dictRef="cc:adapted" size="1">731</array>
                     <array dataType="xsd:string" dictRef="cc:symm" size="1">A</array>
                  </list>
                  <list cmlx:templateRef="symmadapt">
                     <array dataType="xsd:integer" dictRef="cc:adapted" size="1">706</array>
                     <array dataType="xsd:string" dictRef="cc:symm" size="1">A</array>
                  </list>
                  <scalar dataType="xsd:integer" dictRef="g:primbasis">1108</scalar>
                  <scalar dataType="xsd:integer" dictRef="cc:cartesianbasis">731</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:nucrepener">2219.7889273804</scalar>
                  <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">51</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>
                  <scalar dataType="xsd:string" dictRef="g:misc">IExCor=  402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX=  0.200000</scalar>
                  <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  0.800000  0.720000  1.000000  0.810000 ScalE2=  1.000000  1.000000</scalar>
                  <scalar dataType="xsd:string" dictRef="g:misc">IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=131</scalar>
               </module>
               <module cmlx:templateRef="l302.basis" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="basis">
                     <array dataType="xsd:string" dictRef="g:basis" size="11">NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="8">NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0.</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="5">One-electron integrals computed using PRISM.</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="6">One-electron integral symmetry used in STVInt</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="8">NBasis= 706 RedAO= T EigKep= 1.19D-06 NBF= 706</array>
                     <array dataType="xsd:string" dictRef="g:basis" size="7">NBsUse= 705 1.00D-06 EigRej= 9.59D-07 NBFU= 705</array>
                  </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.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 20 out of a maximum of 276</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="147">0.00058 0.00247 0.00433 0.00610 0.00647 0.00828 0.00985 0.01036 0.01095 0.01440 0.01600 0.01686 0.01768 0.01893 0.01940 0.02066 0.02138 0.02169 0.02226 0.02232 0.02254 0.02260 0.02264 0.02273 0.02284 0.02452 0.02534 0.02669 0.02844 0.03080 0.03684 0.04350 0.04509 0.04898 0.04997 0.05562 0.05607 0.05778 0.05817 0.05939 0.06558 0.06992 0.07014 0.07083 0.07321 0.07411 0.07946 0.08695 0.09669 0.10437 0.10517 0.11896 0.12842 0.13951 0.14918 0.15335 0.15756 0.15936 0.15989 0.15998 0.16000 0.16000 0.16000 0.16000 0.16000 0.16001 0.16002 0.16007 0.16010 0.16018 0.16029 0.16032 0.16049 0.16126 0.16192 0.17863 0.18122 0.19081 0.21950 0.22009 0.22331 0.22790 0.23322 0.23464 0.23563 0.24048 0.24322 0.24902 0.24981 0.25405 0.25773 0.26541 0.26893 0.29129 0.29879 0.31240 0.31489 0.32208 0.32454 0.32836 0.32947 0.34073 0.34154 0.34307 0.34360 0.34408 0.34451 0.34501 0.34604 0.34636 0.34645 0.34674 0.34698 0.34763 0.34790 0.34896 0.34965 0.35101 0.35155 0.35357 0.35413 0.35532 0.35584 0.35593 0.35740 0.35750 0.35769 0.36119 0.36225 0.36240 0.36603 0.38800 0.40948 0.43072 0.43441 0.46648 0.47344 0.47698 0.47975 0.48778 0.49612 0.54821 0.55304 0.57575 0.59516 1.03245 1.73414</array>
                  </module>
                  <module cmlx:templateRef="rfo">
                     <list cmlx:templateRef="rfo">
                        <scalar dataType="xsd:double" dictRef="g:lambda">-3.40816459e-09</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="l103.deltas">
                     <list cmlx:templateRef="delta">
                        <array dataType="xsd:string" dictRef="cc:variable" size="266">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 R46 R47 R48 R49 R50 R51 R52 R53 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 A86 A87 A88 A89 A90 A91 A92 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</array>
                        <array dataType="xsd:double" dictRef="g:lastval" size="266">2.57091 2.74741 2.28915 2.57622 2.59478 2.83393 2.89210 2.86743 2.87192 2.93250 2.81299 2.05489 2.79116 2.04630 2.05513 2.06932 2.06800 2.06904 2.06591 2.06841 2.52832 2.05218 2.84286 2.84603 2.06348 2.07140 2.06757 2.06056 2.07037 2.07206 2.81874 2.05927 2.06168 2.72581 2.56728 2.56893 2.03542 2.03638 2.82541 2.86041 2.07010 2.07477 2.64565 2.64051 2.63150 2.04912 2.63514 2.05066 2.63645 2.04892 2.63100 2.04891 2.04846 2.03413 1.87199 2.09985 2.04689 2.10090 2.00485 1.97516 2.14348 2.00589 2.12896 1.94333 2.00029 2.15590 2.02622 2.08063 2.02117 1.97639 1.96526 1.91222 1.91952 1.90080 1.88318 1.88075 1.92315 1.95261 1.93311 1.88291 1.88409 1.88577 2.18613 2.03336 2.06367 2.14521 1.91992 2.21774 2.11864 2.15568 2.00822 1.95486 1.94034 1.92996 1.89161 1.88864 1.85480 1.97181 1.92115 1.92992 1.88087 1.89241 1.86383 1.95320 1.82344 1.89700 1.93271 1.94219 1.91128 2.23362 2.20059 1.84898 1.86008 2.20122 2.22186 1.92850 2.03062 2.32403 1.91519 1.99876 2.36924 2.01340 1.89496 1.88377 1.91278 1.90795 1.84325 2.11254 2.10099 2.06869 2.10686 2.08506 2.09126 2.11029 2.08516 2.08773 2.09855 2.08930 2.09534 2.09587 2.09040 2.09687 2.08605 2.09801 2.09911 -0.03615 3.07969 -1.50588 2.68525 0.64609 -0.00878 3.13991 0.00695 -3.13319 -0.00751 -2.58684 2.51470 -0.06463 -0.07367 2.51593 -2.53005 0.05954 -0.64597 1.47218 -2.74680 0.62442 2.74257 -1.47641 3.09150 -1.07354 0.99067 -1.52374 0.57088 2.67594 -2.73615 -0.64152 1.46353 1.04130 3.13593 -1.04220 -0.02119 -2.47471 2.43013 -0.02339 2.69402 -0.44021 1.42274 -1.71148 -1.00822 2.14075 2.62461 -0.54407 -2.44890 0.66561 0.02114 3.13564 -3.13499 -0.03385 -0.00088 3.10026 -0.05892 -2.17806 2.04913 3.11990 1.00076 -1.05523 0.01410 -2.08931 2.13867 3.11757 1.01416 -1.04105 1.24015 -1.90384 -3.01624 0.12295 -0.88608 2.25311 3.13691 -0.01082 -0.00266 3.13279 -3.13255 0.00032 0.00708 3.13995 -0.00264 3.13706 -3.13799 0.00170 -3.08078 1.04833 -0.94175 0.06278 -2.09130 2.20180 0.98362 -2.20574 3.12826 -0.06111 -1.14246 1.95136 3.09511 -0.04933 0.00043 3.13918 -3.08662 0.05335 0.00838 -3.13484 -0.00773 3.13487 3.13672 -0.00387 -0.00991 -3.14054 3.13330 0.00268 0.00623 3.14131 -3.13637 -0.00129 0.00250 -3.13258 3.13308 -0.00199</array>
                        <array dataType="xsd:double" dictRef="cc:deriv" size="266">-0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -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 0.00000 -0.00000 0.00001 0.00001 0.00000 -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 0.00000 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 -0.00000 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 -0.00001 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00001 0.00001 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 0.00001 -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 -0.00001 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</array>
                        <array dataType="xsd:double" dictRef="cc:delta.linear" size="266">-0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00001 -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 -0.00001 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 -0.00000 -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 -0.00001 -0.00001 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 0.00001 0.00001 -0.00001 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 0.00000 0.00000 -0.00001 0.00000 0.00001 -0.00000 0.00000 -0.00000 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 0.00001 -0.00000 -0.00001 0.00001 -0.00000 0.00001 -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 -0.00005 -0.00006 0.00001 0.00002 0.00002 -0.00003 0.00001 0.00003 0.00006 -0.00002 -0.00001 -0.00000 0.00000 0.00001 -0.00000 0.00001 -0.00001 -0.00001 -0.00001 -0.00001 -0.00003 -0.00002 -0.00002 -0.00002 -0.00002 -0.00002 -0.00002 -0.00002 -0.00001 -0.00001 -0.00001 -0.00001 -0.00001 -0.00001 -0.00001 0.00001 -0.00000 0.00001 -0.00000 0.00003 0.00004 0.00002 0.00004 0.00002 0.00004 -0.00006 -0.00007 -0.00006 -0.00007 -0.00005 -0.00006 0.00001 0.00001 -0.00001 -0.00001 0.00008 0.00009 0.00009 0.00008 0.00009 0.00009 0.00002 0.00002 0.00002 0.00002 0.00002 0.00002 -0.00001 0.00001 -0.00002 0.00000 -0.00002 0.00000 0.00003 0.00003 0.00001 0.00001 -0.00001 -0.00005 0.00001 -0.00003 -0.00002 -0.00007 -0.00003 -0.00007 0.00011 0.00012 0.00012 0.00016 0.00016 0.00016 -0.00010 -0.00011 -0.00009 -0.00010 -0.00010 -0.00011 -0.00002 -0.00001 -0.00000 -0.00000 0.00002 0.00001 0.00001 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00001 -0.00000 -0.00000 0.00000 0.00001 -0.00000 0.00000 -0.00001 -0.00000 0.00001 -0.00000 0.00000</array>
                        <array dataType="xsd:double" dictRef="cc:delta.quad" size="266">-0.00001 -0.00000 0.00001 0.00001 0.00001 0.00001 0.00000 0.00001 0.00000 -0.00001 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 0.00001 -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 0.00000 -0.00000 0.00000 -0.00001 0.00001 0.00001 0.00000 -0.00001 -0.00000 -0.00001 0.00000 0.00001 0.00000 0.00000 0.00000 -0.00000 -0.00001 -0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00001 -0.00001 0.00002 -0.00001 0.00003 -0.00000 -0.00000 0.00000 -0.00002 -0.00000 -0.00000 -0.00001 0.00001 -0.00000 0.00000 -0.00000 -0.00001 -0.00001 0.00001 0.00000 0.00001 0.00000 -0.00000 0.00000 -0.00001 0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00001 -0.00001 0.00001 0.00001 -0.00001 -0.00000 -0.00001 -0.00000 0.00000 0.00001 0.00000 -0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00000 0.00001 -0.00001 0.00000 0.00000 0.00001 -0.00001 0.00000 0.00000 -0.00001 -0.00000 -0.00001 0.00001 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00001 -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 0.00004 0.00009 0.00002 0.00001 0.00001 0.00010 0.00012 -0.00008 -0.00001 0.00002 0.00004 0.00001 0.00003 -0.00000 0.00001 -0.00002 -0.00001 0.00003 0.00005 0.00005 0.00003 0.00005 0.00004 0.00005 0.00006 0.00006 -0.00003 -0.00003 -0.00003 -0.00002 -0.00002 -0.00002 -0.00004 -0.00004 -0.00004 -0.00005 -0.00001 -0.00004 -0.00000 -0.00001 -0.00001 -0.00001 -0.00000 -0.00003 -0.00002 -0.00001 0.00005 0.00001 0.00007 -0.00002 0.00004 0.00003 0.00001 0.00002 0.00001 0.00001 -0.00000 0.00001 0.00002 0.00001 0.00002 0.00027 0.00027 0.00028 0.00026 0.00026 0.00026 0.00003 0.00006 0.00004 0.00007 0.00005 0.00008 0.00005 0.00008 0.00002 0.00005 -0.00010 -0.00013 -0.00007 -0.00011 0.00004 -0.00005 0.00001 -0.00008 -0.00008 -0.00008 -0.00007 0.00001 0.00001 0.00002 0.00001 0.00002 0.00001 0.00002 0.00001 0.00002 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 -0.00000 -0.00000 -0.00001 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000</array>
                        <array dataType="xsd:double" dictRef="cc:delta.total" size="266">-0.00001 -0.00000 0.00001 0.00001 0.00001 0.00001 -0.00000 0.00001 0.00000 -0.00001 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 0.00001 -0.00000 0.00000 -0.00001 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00002 0.00001 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00002 0.00002 0.00001 0.00000 -0.00001 -0.00000 -0.00001 0.00000 0.00001 -0.00000 -0.00000 -0.00000 -0.00001 -0.00001 0.00000 0.00000 -0.00000 0.00001 -0.00001 0.00001 -0.00000 0.00003 -0.00001 0.00002 -0.00000 -0.00000 0.00001 -0.00002 -0.00001 0.00000 -0.00001 0.00001 -0.00000 0.00001 -0.00001 -0.00001 -0.00001 0.00001 0.00001 0.00001 -0.00000 -0.00000 0.00000 -0.00001 0.00001 -0.00000 -0.00000 0.00000 -0.00000 -0.00001 0.00000 -0.00001 0.00001 0.00001 -0.00001 -0.00000 -0.00001 -0.00000 0.00001 0.00001 0.00000 -0.00001 0.00001 0.00000 0.00000 -0.00000 0.00000 0.00002 -0.00002 0.00000 0.00000 0.00001 -0.00001 -0.00000 0.00001 -0.00001 -0.00000 -0.00001 0.00001 0.00000 0.00000 -0.00001 -0.00000 0.00001 -0.00001 0.00002 -0.00002 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 -0.00000 0.00000 -0.00001 0.00003 0.00003 0.00003 0.00002 0.00007 0.00013 -0.00005 0.00005 0.00000 0.00003 0.00001 0.00003 0.00001 0.00000 -0.00001 -0.00001 0.00002 0.00004 0.00004 0.00001 0.00002 0.00002 0.00002 0.00004 0.00004 -0.00005 -0.00004 -0.00004 -0.00004 -0.00003 -0.00003 -0.00005 -0.00005 -0.00005 -0.00005 -0.00001 -0.00004 -0.00000 0.00001 0.00003 0.00002 0.00004 -0.00001 0.00002 -0.00007 -0.00002 -0.00005 -0.00000 -0.00007 -0.00002 0.00003 0.00002 0.00001 -0.00000 0.00009 0.00009 0.00010 0.00011 0.00010 0.00011 0.00029 0.00029 0.00030 0.00028 0.00028 0.00028 0.00001 0.00007 0.00002 0.00007 0.00002 0.00008 0.00008 0.00011 0.00003 0.00006 -0.00011 -0.00018 -0.00006 -0.00014 0.00001 -0.00012 -0.00002 -0.00015 0.00004 0.00004 0.00005 0.00017 0.00017 0.00018 -0.00008 -0.00009 -0.00008 -0.00009 -0.00008 -0.00009 -0.00001 -0.00001 -0.00001 -0.00001 0.00001 0.00001 0.00001 0.00001 -0.00000 -0.00000 -0.00000 -0.00000 -0.00001 -0.00001 -0.00000 -0.00000 0.00001 -0.00000 0.00001 -0.00000 -0.00000 0.00001 -0.00000 0.00001</array>
                        <array dataType="xsd:double" dictRef="cc:newval" size="266">2.57090 2.74741 2.28917 2.57623 2.59479 2.83395 2.89210 2.86743 2.87192 2.93249 2.81300 2.05489 2.79117 2.04631 2.05513 2.06931 2.06800 2.06904 2.06591 2.06841 2.52832 2.05218 2.84286 2.84604 2.06347 2.07140 2.06757 2.06056 2.07037 2.07206 2.81874 2.05927 2.06168 2.72579 2.56728 2.56893 2.03542 2.03638 2.82540 2.86041 2.07010 2.07478 2.64564 2.64053 2.63151 2.04912 2.63513 2.05066 2.63643 2.04892 2.63101 2.04891 2.04846 2.03412 1.87198 2.09984 2.04689 2.10091 2.00485 1.97517 2.14347 2.00590 2.12896 1.94335 2.00028 2.15592 2.02622 2.08063 2.02117 1.97637 1.96526 1.91222 1.91951 1.90081 1.88318 1.88076 1.92315 1.95260 1.93310 1.88292 1.88410 1.88578 2.18613 2.03336 2.06368 2.14520 1.91993 2.21774 2.11864 2.15568 2.00822 1.95486 1.94034 1.92995 1.89162 1.88865 1.85479 1.97180 1.92114 1.92992 1.88087 1.89242 1.86383 1.95318 1.82345 1.89700 1.93271 1.94219 1.91128 2.23363 2.20057 1.84898 1.86008 2.20123 2.22185 1.92850 2.03063 2.32402 1.91519 1.99875 2.36924 2.01340 1.89496 1.88376 1.91278 1.90796 1.84324 2.11256 2.10097 2.06869 2.10686 2.08507 2.09126 2.11029 2.08515 2.08774 2.09855 2.08929 2.09534 2.09587 2.09040 2.09686 2.08605 2.09801 2.09911 -0.03617 3.07973 -1.50584 2.68528 0.64612 -0.00871 3.14004 0.00690 -3.13314 -0.00751 -2.58681 2.51470 -0.06460 -0.07366 2.51593 -2.53006 0.05953 -0.64595 1.47221 -2.74677 0.62443 2.74259 -1.47639 3.09152 -1.07350 0.99070 -1.52379 0.57084 2.67589 -2.73619 -0.64156 1.46349 1.04125 3.13588 -1.04225 -0.02124 -2.47473 2.43009 -0.02340 2.69403 -0.44018 1.42276 -1.71144 -1.00822 2.14076 2.62454 -0.54409 -2.44895 0.66561 0.02107 3.13562 -3.13495 -0.03383 -0.00087 3.10026 -0.05883 -2.17798 2.04922 3.12001 1.00086 -1.05512 0.01440 -2.08902 2.13897 3.11785 1.01444 -1.04076 1.24016 -1.90378 -3.01622 0.12302 -0.88606 2.25319 3.13699 -0.01071 -0.00263 3.13285 -3.13265 0.00014 0.00701 3.13981 -0.00263 3.13694 -3.13801 0.00155 -3.08075 1.04836 -0.94171 0.06294 -2.09113 2.20198 0.98354 -2.20583 3.12818 -0.06119 -1.14254 1.95127 3.09510 -0.04934 0.00042 3.13917 -3.08661 0.05336 0.00839 -3.13483 -0.00773 3.13486 3.13671 -0.00388 -0.00992 -3.14054 3.13330 0.00268 0.00624 3.14131 -3.13636 -0.00129 0.00249 -3.13257 3.13308 -0.00199</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">0.000015 0.000003 0.000600 0.000132</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">-4.465561e-09</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="53">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 R46 R47 R48 R49 R50 R51 R52 R53</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="53">1 1 2 3 3 4 4 4 4 5 5 5 6 6 7 7 7 8 8 8 9 9 11 11 12 12 12 13 13 13 14 14 14 15 15 16 16 17 18 19 19 19 20 20 21 21 22 22 23 23 24 24 25</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="53">10 14 10 17 18 5 6 7 8 6 9 26 10 27 28 29 30 31 32 33 11 34 12 13 35 36 37 38 39 40 15 41 42 16 17 18 43 44 19 20 45 46 21 22 23 47 24 48 25 49 25 50 51</array>
                        <array dataType="xsd:double" dictRef="cc:distance" size="53">1.3605 1.4539 1.2114 1.3633 1.3731 1.4997 1.5304 1.5174 1.5198 1.5518 1.4886 1.0874 1.477 1.0829 1.0875 1.095 1.0943 1.0949 1.0932 1.0946 1.3379 1.086 1.5044 1.5061 1.0919 1.0961 1.0941 1.0904 1.0956 1.0965 1.4916 1.0897 1.091 1.4424 1.3585 1.3594 1.0771 1.0776 1.4951 1.5137 1.0954 1.0979 1.4 1.3973 1.3925 1.0843 1.3945 1.0852 1.3951 1.0842 1.3923 1.0842 1.084</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="53">-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-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="92">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 A86 A87 A88 A89 A90 A91 A92</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="92">10 17 5 5 6 6 7 4 4 6 6 9 4 4 5 5 10 4 4 4 28 28 29 4 4 4 31 31 32 5 5 11 1 1 2 9 9 12 11 11 11 35 35 36 11 11 11 38 38 39 1 1 1 15 15 41 14 14 16 15 15 18 3 3 15 3 3 16 18 18 18 20 20 45 19 19 21 20 20 23 20 20 24 21 21 25 22 22 25 23 23 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="92">1 3 4 4 4 4 4 5 5 5 5 5 6 6 6 6 6 7 7 7 7 7 7 8 8 8 8 8 8 9 9 9 10 10 10 11 11 11 12 12 12 12 12 12 13 13 13 13 13 13 14 14 14 14 14 14 15 15 15 16 16 16 17 17 17 18 18 18 19 19 19 19 19 19 20 20 20 21 21 21 22 22 22 23 23 23 24 24 24 25 25 25</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="92">14 18 7 8 7 8 8 9 26 9 26 26 10 27 10 27 27 28 29 30 29 30 30 31 32 33 32 33 33 11 34 34 2 6 6 12 13 13 35 36 37 36 37 37 38 39 40 39 40 40 15 41 42 41 42 42 16 17 17 18 43 43 15 44 44 16 19 19 20 45 46 45 46 46 21 22 22 23 47 47 24 48 48 25 49 49 25 50 50 24 51 51</array>
                        <array dataType="xsd:double" dictRef="cc:angle" size="92">116.5468 107.257 120.3123 117.2781 120.3728 114.8692 113.1684 122.8123 114.9291 121.9807 111.3446 114.6081 123.5239 116.0941 119.2111 115.8042 113.2389 112.6013 109.5623 109.9804 108.9076 107.8982 107.7593 110.1886 111.8766 110.759 107.8829 107.9503 108.0465 125.2561 116.5029 118.2398 122.9112 110.0031 127.0669 121.389 123.5114 115.0628 112.0054 111.173 110.5784 108.3814 108.2109 106.272 112.9763 110.0738 110.5763 107.7657 108.4271 106.7898 111.9099 104.4754 108.69 110.7363 111.2794 109.5083 127.9767 126.0844 105.9388 106.5748 126.1208 127.3034 110.4949 116.3462 133.1573 109.7323 114.5203 135.7473 115.3591 108.5731 107.9319 109.5942 109.3174 105.6102 121.0398 120.3779 118.5274 120.7143 119.4652 119.8203 120.9109 119.4707 119.6183 120.2379 119.7079 120.0542 120.0845 119.771 120.1415 119.5217 120.2071 120.2701</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="92">-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-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="120">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</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="120">14 14 10 10 10 18 18 17 17 7 7 8 8 7 7 8 8 5 5 5 6 6 6 8 8 8 5 5 5 6 6 6 7 7 7 9 9 26 26 4 4 6 6 26 26 4 4 5 5 27 27 5 5 34 34 9 9 9 13 13 13 9 9 9 12 12 12 1 1 41 41 42 42 14 14 17 17 14 14 16 16 15 15 43 43 3 3 3 16 16 16 18 18 45 45 46 46 19 19 22 22 19 19 21 21 20 20 47 47 20 20 48 48 21 21 49 49 22 22 50</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="120">1 1 1 1 1 3 3 3 3 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 9 9 9 9 11 11 11 11 11 11 11 11 11 11 11 11 14 14 14 14 14 14 15 15 15 15 15 15 15 15 16 16 16 16 18 18 18 18 18 18 19 19 19 19 19 19 20 20 20 20 20 20 20 20 21 21 21 21 22 22 22 22 23 23 23 23 24 24 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="120">10 10 14 14 14 17 17 18 18 5 5 5 5 6 6 6 6 7 7 7 7 7 7 7 7 7 8 8 8 8 8 8 8 8 8 6 6 6 6 9 9 9 9 9 9 10 10 10 10 10 10 11 11 11 11 12 12 12 12 12 12 13 13 13 13 13 13 15 15 15 15 15 15 16 16 16 16 17 17 17 17 18 18 18 18 19 19 19 19 19 19 20 20 20 20 20 20 21 21 21 21 22 22 22 22 23 23 23 23 24 24 24 24 25 25 25 25 25 25 25</array>
                        <array dataType="xsd:integer" dictRef="g:atom4" size="120">2 6 15 41 42 15 44 16 19 9 26 9 26 10 27 10 27 28 29 30 28 29 30 28 29 30 31 32 33 31 32 33 31 32 33 10 27 10 27 11 34 11 34 11 34 1 2 1 2 1 2 12 13 12 13 35 36 37 35 36 37 38 39 40 38 39 40 16 17 16 17 16 17 18 43 18 43 3 44 3 44 3 19 3 19 20 45 46 20 45 46 21 22 21 22 21 22 23 47 23 47 24 48 24 48 25 49 25 49 25 50 25 50 24 51 24 51 23 51 23</array>
                        <array dataType="xsd:double" dictRef="cc:dihed" size="120">-2.0715 176.4533 -86.2804 153.8535 37.0184 -0.5033 179.9034 0.3981 -179.5185 -0.4303 -148.2149 144.0816 -3.703 -4.2207 144.1522 -144.9613 3.4116 -37.0113 84.3495 -157.3803 35.7767 157.1375 -84.5923 177.13 -61.5092 56.7611 -87.3041 32.7093 153.3199 -156.77 -36.7566 83.8539 59.6623 179.6757 -59.7137 -1.2142 -141.7907 139.2362 -1.3403 154.3557 -25.222 81.517 -98.0607 -57.7665 122.6557 150.3792 -31.1728 -140.3114 38.1365 1.2111 179.6591 -179.6215 -1.9393 -0.0504 177.6318 -3.376 -124.7939 117.4062 178.7573 57.3395 -60.4604 0.8081 -119.7088 122.5367 178.6239 58.107 -59.6475 71.0554 -109.0823 -172.818 7.0444 -50.7686 129.0938 179.732 -0.6199 -0.1524 179.4958 -179.4818 0.0185 0.4054 179.9057 -0.1511 179.7401 -179.7938 0.0974 -176.5157 60.0647 -53.9585 3.5968 -119.8228 126.154 56.3575 -126.3799 179.2362 -3.5012 -65.4579 111.8048 177.3366 -2.8262 0.0245 179.8617 -176.8506 3.0565 0.48 -179.613 -0.4427 179.6146 179.7206 -0.222 -0.5679 -179.9395 179.5251 0.1535 0.357 179.9837 -179.7006 -0.0738 0.143 -179.4835 179.5123</array>
                        <array dataType="xsd:string"
                               delimiter="|"
                               dictRef="g:deriv"
                               size="120">-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-DE/DX =    0.0|-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="l301">
                  <module cmlx:templateRef="l301.dispersion">
                     <scalar dataType="xsd:string" dictRef="g:empdispersion">Grimme-D3</scalar>
                     <scalar dataType="xsd:double" dictRef="g:dispenergy" units="nonsi:hartree">-0.0572564444</scalar>
                  </module>
               </module>
               <module cmlx:templateRef="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.stoich">
                     <scalar cmlx:templateRef="stoich"
                             dataType="xsd:string"
                             dictRef="g:stoichiometry">C22H26O3</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:pointgroup">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestconciseabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                  </module>
                  <module cmlx:templateRef="l202.orient">
                     <molecule cmlx:templateRef="atom"
                               formalCharge="0"
                               id="mol.l202.orient"
                               spinMultiplicity="1">
                        <atomArray>
                           <atom elementType="O"
                                 id="a1"
                                 x3="2.07485"
                                 y3="2.178638"
                                 z3="0.143377">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="O"
                                 id="a2"
                                 x3="1.719463"
                                 y3="0.378108"
                                 z3="1.424918">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="O"
                                 id="a3"
                                 x3="-2.146781"
                                 y3="3.228826"
                                 z3="-0.805366">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a4"
                                 x3="4.246486"
                                 y3="-0.797851"
                                 z3="0.054621">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a5"
                                 x3="3.091644"
                                 y3="-1.183367"
                                 z3="-0.803142">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a6"
                                 x3="3.278235"
                                 y3="0.279669"
                                 z3="-0.391167">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a7"
                                 x3="4.31609"
                                 y3="-1.241714"
                                 z3="1.495423">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a8"
                                 x3="5.605014"
                                 y3="-0.740002"
                                 z3="-0.605731">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a9"
                                 x3="1.963627"
                                 y3="-2.00028"
                                 z3="-0.295232">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a10"
                                 x3="2.288177"
                                 y3="0.906836"
                                 z3="0.505934">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a11"
                                 x3="0.734528"
                                 y3="-2.010639"
                                 z3="-0.810251">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a12"
                                 x3="-0.343074"
                                 y3="-2.869285"
                                 z3="-0.225847">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a13"
                                 x3="0.313416"
                                 y3="-1.149407"
                                 z3="-1.960529">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a14"
                                 x3="1.087614"
                                 y3="2.916315"
                                 z3="0.865448">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a15"
                                 x3="-0.268138"
                                 y3="2.754662"
                                 z3="0.274846">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a16"
                                 x3="-1.126582"
                                 y3="1.606387"
                                 z3="0.304944">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a17"
                                 x3="-0.94804"
                                 y3="3.697003"
                                 z3="-0.416733">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a18"
                                 x3="-2.249493"
                                 y3="1.953244"
                                 z3="-0.368139">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a19"
                                 x3="-3.517392"
                                 y3="1.251587"
                                 z3="-0.71452">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a20"
                                 x3="-3.6312"
                                 y3="-0.129938"
                                 z3="-0.129017">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a21"
                                 x3="-3.630619"
                                 y3="-0.321853"
                                 z3="1.250689">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a22"
                                 x3="-3.788341"
                                 y3="-1.238023"
                                 z3="-0.953277">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a23"
                                 x3="-3.782301"
                                 y3="-1.589519"
                                 z3="1.789083">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a24"
                                 x3="-3.952668"
                                 y3="-2.507837"
                                 z3="-0.417534">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a25"
                                 x3="-3.949065"
                                 y3="-2.687524"
                                 z3="0.955971">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a26"
                                 x3="3.331433"
                                 y3="-1.34727"
                                 z3="-1.850724">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a27"
                                 x3="3.643845"
                                 y3="0.941176"
                                 z3="-1.167919">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a28"
                                 x3="3.349222"
                                 y3="-1.275166"
                                 z3="1.987523">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a29"
                                 x3="4.761375"
                                 y3="-2.237324"
                                 z3="1.549693">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a30"
                                 x3="4.954453"
                                 y3="-0.567056"
                                 z3="2.068605">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a31"
                                 x3="6.083003"
                                 y3="-1.721173"
                                 z3="-0.584991">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a32"
                                 x3="5.54055"
                                 y3="-0.427519"
                                 z3="-1.648978">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a33"
                                 x3="6.262458"
                                 y3="-0.038174"
                                 z3="-0.089583">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a34"
                                 x3="2.166817"
                                 y3="-2.6407"
                                 z3="0.556329">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.027623"
                                 y3="-3.493442"
                                 z3="0.586419">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a36"
                                 x3="-0.78661"
                                 y3="-3.523184"
                                 z3="-0.981075">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a37"
                                 x3="-1.158118"
                                 y3="-2.25704"
                                 z3="0.167014">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a38"
                                 x3="1.125208"
                                 y3="-0.546296"
                                 z3="-2.363128">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a39"
                                 x3="-0.482577"
                                 y3="-0.465478"
                                 z3="-1.653466">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a40"
                                 x3="-0.092746"
                                 y3="-1.756744"
                                 z3="-2.773762">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a41"
                                 x3="1.401838"
                                 y3="3.958043"
                                 z3="0.79663">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a42"
                                 x3="1.092993"
                                 y3="2.630816"
                                 z3="1.918437">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-0.918569"
                                 y3="0.657391"
                                 z3="0.771292">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a44"
                                 x3="-0.710129"
                                 y3="4.712348"
                                 z3="-0.69149">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a45"
                                 x3="-3.614072"
                                 y3="1.194517"
                                 z3="-1.803127">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a46"
                                 x3="-4.364353"
                                 y3="1.859205"
                                 z3="-0.37634">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a47"
                                 x3="-3.5105"
                                 y3="0.529741"
                                 z3="1.909523">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a48"
                                 x3="-3.787591"
                                 y3="-1.107462"
                                 z3="-2.028876">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a49"
                                 x3="-3.775612"
                                 y3="-1.720616"
                                 z3="2.863201">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a50"
                                 x3="-4.07585"
                                 y3="-3.357292"
                                 z3="-1.076457">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a51"
                                 x3="-4.07186"
                                 y3="-3.676664"
                                 z3="1.376782">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                        </atomArray>
                        <bondArray/>
                        <formula concise="C22H26O3"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">312.2335999999998</scalar>
                        </property>
                        <formula convention="iupac:inchi" inline="InChI=1/22C.3O.26H">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;1;2;3;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/rA:51nO0O0O0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.0749,2.1786,.1434;1.7195,.3781,1.4249;-2.1468,3.2288,-.8054;4.2465,-.7979,.0546;3.0916,-1.1834,-.8031;3.2782,.2797,-.3912;4.3161,-1.2417,1.4954;5.605,-.74,-.6057;1.9636,-2.0003,-.2952;2.2882,.9068,.5059;.7345,-2.0106,-.8103;-.3431,-2.8693,-.2258;.3134,-1.1494,-1.9605;1.0876,2.9163,.8654;-.2681,2.7547,.2748;-1.1266,1.6064,.3049;-.948,3.697,-.4167;-2.2495,1.9532,-.3681;-3.5174,1.2516,-.7145;-3.6312,-.1299,-.129;-3.6306,-.3219,1.2507;-3.7883,-1.238,-.9533;-3.7823,-1.5895,1.7891;-3.9527,-2.5078,-.4175;-3.9491,-2.6875,.956;3.3314,-1.3473,-1.8507;3.6438,.9412,-1.1679;3.3492,-1.2752,1.9875;4.7614,-2.2373,1.5497;4.9545,-.5671,2.0686;6.083,-1.7212,-.585;5.5405,-.4275,-1.649;6.2625,-.0382,-.0896;2.1668,-2.6407,.5563;.0276,-3.4934,.5864;-.7866,-3.5232,-.9811;-1.1581,-2.257,.167;1.1252,-.5463,-2.3631;-.4826,-.4655,-1.6535;-.0927,-1.7567,-2.7738;1.4018,3.958,.7966;1.093,2.6308,1.9184;-.9186,.6574,.7713;-.7101,4.7123,-.6915;-3.6141,1.1945,-1.8031;-4.3644,1.8592,-.3763;-3.5105,.5297,1.9095;-3.7876,-1.1075,-2.0289;-3.7756,-1.7206,2.8632;-4.0758,-3.3573,-1.0765;-4.0719,-3.6767,1.3768;</scalar>
                        </formula>
                     </molecule>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.3112753 0.1543722 0.1181178</array>
                  </module>
               </module>
               <module cmlx:templateRef="l601.popanal" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="g:alphaocc" size="91">-19.19166 -19.16309 -19.10114 -10.29416 -10.23305 -10.22853 -10.22105 -10.19405 -10.19152 -10.19026 -10.18397 -10.18352 -10.17886 -10.17863 -10.17801 -10.17739 -10.17713 -10.17703 -10.16748 -10.16514 -10.16406 -10.15491 -10.15436 -10.15258 -10.15059 -1.12819 -1.11150 -1.02095 -0.88926 -0.87315 -0.82314 -0.81061 -0.80573 -0.75976 -0.75562 -0.74864 -0.73158 -0.69811 -0.69291 -0.68778 -0.68481 -0.64152 -0.61705 -0.60393 -0.59140 -0.57519 -0.55756 -0.54442 -0.53113 -0.52684 -0.51658 -0.49561 -0.48458 -0.48162 -0.47414 -0.46817 -0.45985 -0.45928 -0.45352 -0.44349 -0.44215 -0.43130 -0.43010 -0.42981 -0.41883 -0.41670 -0.41175 -0.40503 -0.39975 -0.39434 -0.38716 -0.38265 -0.38146 -0.37538 -0.36953 -0.36615 -0.35870 -0.35353 -0.35286 -0.35192 -0.34987 -0.32969 -0.31102 -0.29885 -0.28527 -0.28194 -0.27405 -0.26362 -0.25848 -0.23173 -0.22522</array>
                  <array dataType="xsd:double" dictRef="g:alphavirt" size="614">-0.02241 -0.01875 -0.00713 -0.00399 0.00019 0.00368 0.01177 0.01265 0.01826 0.02205 0.02502 0.02991 0.03047 0.03712 0.03744 0.04217 0.04433 0.04588 0.04727 0.05042 0.05328 0.05722 0.06035 0.06500 0.06983 0.07033 0.07571 0.07823 0.08118 0.08305 0.08541 0.08951 0.09806 0.09934 0.10183 0.10605 0.10886 0.11213 0.11405 0.11534 0.12147 0.12329 0.12395 0.12670 0.13044 0.13409 0.13884 0.14125 0.14275 0.14593 0.14624 0.14975 0.15093 0.15319 0.15964 0.16072 0.16555 0.16701 0.17034 0.17079 0.17420 0.17541 0.17833 0.18136 0.18252 0.18489 0.18690 0.19100 0.19187 0.19324 0.19724 0.19945 0.20008 0.20149 0.20424 0.20579 0.20829 0.20893 0.21043 0.21232 0.21589 0.21842 0.22060 0.22562 0.22724 0.23004 0.23042 0.23169 0.23369 0.23708 0.23841 0.24252 0.24358 0.24628 0.24786 0.24893 0.25205 0.25292 0.25715 0.25972 0.26372 0.26556 0.26850 0.27104 0.27151 0.27774 0.28035 0.28346 0.28450 0.28925 0.29201 0.29285 0.29608 0.29950 0.30378 0.30681 0.30850 0.31258 0.31520 0.31851 0.32194 0.32273 0.32393 0.32610 0.32929 0.33192 0.33644 0.33904 0.34246 0.34466 0.35094 0.35380 0.35503 0.35851 0.36278 0.36623 0.37758 0.37789 0.38365 0.38738 0.39263 0.39695 0.40035 0.40831 0.41142 0.41843 0.42101 0.42940 0.43401 0.44159 0.44641 0.45445 0.45869 0.46210 0.46629 0.47038 0.47410 0.48890 0.49651 0.50258 0.50960 0.51507 0.52274 0.52913 0.53417 0.53940 0.54617 0.54976 0.55812 0.56934 0.57120 0.57414 0.57973 0.58495 0.58715 0.58963 0.59483 0.60032 0.60436 0.60964 0.61082 0.61923 0.62248 0.62732 0.63363 0.63806 0.64095 0.64454 0.64920 0.65119 0.65645 0.65783 0.66326 0.66846 0.67263 0.67388 0.67888 0.68260 0.68529 0.68878 0.69133 0.69494 0.69845 0.70119 0.70429 0.70660 0.70877 0.71114 0.71586 0.72215 0.72550 0.72724 0.72834 0.73328 0.73906 0.74150 0.74471 0.75177 0.75337 0.76116 0.76335 0.76582 0.77484 0.77961 0.78417 0.78721 0.79221 0.79430 0.79697 0.80235 0.80478 0.81182 0.81496 0.82618 0.83370 0.83774 0.84537 0.85527 0.85716 0.86029 0.86197 0.87348 0.88122 0.88961 0.90215 0.91060 0.91369 0.91981 0.92616 0.93029 0.93885 0.94761 0.95381 0.95769 0.96681 0.97356 0.98109 0.99661 1.00130 1.00918 1.01353 1.03581 1.03702 1.03907 1.04669 1.05561 1.06357 1.06926 1.08022 1.08758 1.10160 1.11034 1.11541 1.11983 1.12585 1.13628 1.14079 1.15214 1.15686 1.16620 1.18030 1.19376 1.19770 1.20278 1.21556 1.22253 1.22717 1.24653 1.26079 1.27926 1.28776 1.29249 1.30893 1.31305 1.32266 1.32944 1.33495 1.35201 1.35723 1.37035 1.38113 1.40210 1.40533 1.41279 1.42373 1.42819 1.44260 1.45331 1.45511 1.46311 1.46798 1.47713 1.48313 1.49256 1.49552 1.50504 1.51060 1.51477 1.51775 1.52383 1.52973 1.54104 1.54388 1.54931 1.55844 1.57203 1.57752 1.58182 1.58677 1.59061 1.61139 1.61458 1.61608 1.62992 1.63262 1.63656 1.64230 1.64957 1.65195 1.65801 1.66174 1.66523 1.66626 1.67101 1.67675 1.68427 1.68996 1.69493 1.70724 1.70941 1.71436 1.72127 1.72823 1.73032 1.73379 1.73992 1.75272 1.76158 1.76651 1.77617 1.77725 1.78416 1.78576 1.79686 1.79989 1.81404 1.81725 1.82728 1.83214 1.83404 1.83928 1.85141 1.85433 1.86510 1.86709 1.88246 1.88574 1.89784 1.90273 1.90808 1.91612 1.92008 1.92438 1.93509 1.94084 1.95203 1.95780 1.96314 1.96851 1.97359 1.99543 1.99879 2.00122 2.00446 2.01363 2.01671 2.02459 2.02725 2.04421 2.05429 2.06824 2.07877 2.08195 2.08726 2.09625 2.10435 2.11241 2.12041 2.14101 2.14259 2.16210 2.16590 2.17761 2.18867 2.19756 2.20827 2.21971 2.22792 2.23149 2.24013 2.25915 2.26387 2.26788 2.30777 2.31358 2.32895 2.35329 2.36080 2.36922 2.39310 2.39419 2.40689 2.41646 2.42400 2.43801 2.44451 2.45073 2.45959 2.46329 2.47821 2.48679 2.49360 2.51032 2.52258 2.52585 2.53472 2.53617 2.53869 2.54359 2.55350 2.55400 2.56587 2.57292 2.57836 2.59555 2.60875 2.60969 2.63470 2.64275 2.65171 2.65689 2.66197 2.66687 2.68517 2.68675 2.70591 2.71364 2.71663 2.72931 2.73687 2.74187 2.74402 2.74982 2.75337 2.75923 2.76430 2.76912 2.77399 2.78161 2.78601 2.80035 2.80759 2.82150 2.82995 2.84403 2.84819 2.86285 2.86673 2.87199 2.87520 2.87998 2.88756 2.89807 2.91461 2.91611 2.92904 2.93433 2.93924 2.94563 2.95297 2.96182 2.97020 2.97372 2.97471 2.98967 3.01498 3.03174 3.04185 3.04683 3.05559 3.07112 3.08146 3.09990 3.11212 3.12813 3.13255 3.13793 3.16238 3.17610 3.18707 3.19657 3.19970 3.20921 3.21934 3.22288 3.23552 3.25755 3.26566 3.27268 3.28340 3.35079 3.38096 3.39512 3.40207 3.41832 3.42740 3.45463 3.49630 3.53233 3.56671 3.58375 3.62340 3.63755 3.64443 3.65056 3.66416 3.71396 3.72117 3.74671 3.75022 3.79375 3.80245 3.82404 3.84085 3.84902 3.86332 3.86391 3.86891 3.87755 3.89138 3.96558 3.99301 4.03522 4.04380 4.06762 4.09745 4.14835 4.15537 4.15964 4.16250 4.22974 4.29497 4.32949 4.36036 4.36822 4.37373 4.48950 4.59594 4.64754 4.85842 5.00955 5.12164 5.19128 5.32763 5.42955 5.47141 5.69742 5.86492 5.94090 23.64684 23.72286 23.73786 23.84842 23.85018 23.87591 23.89377 23.92441 23.93851 23.96756 23.98119 23.98795 24.00995 24.02194 24.02456 24.03070 24.11116 24.12040 24.19228 24.22149 24.23484 24.31486 49.91968 49.93919 50.06836</array>
                  <module cmlx:templateRef="l601.state">
                     <scalar dataType="xsd:string" dictRef="g:l601.state">1-A.</scalar>
                  </module>
                  <list cmlx:templateRef="multipole" dictRef="cc:multipole">
                     <array dataType="xsd:double" dictRef="cc:dipole" size="3">-0.0189 0.1353 -0.8637</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">0.8744</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-145.7142 -143.1287 -148.3901</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">3.3688 -1.3292 1.4316</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">0.0301 2.6156 -2.6458 3.3688 -1.3292 1.4316</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">69.6069 43.6039 0.6785 -0.9853 -2.5151 -6.1183 -9.1076 0.1048 12.8753 -0.2950</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-8491.9092 -3451.6786 -1043.6927 -79.1634 43.3107 123.9888 -26.7849 -10.3525 -5.0383 -1994.9931 -1517.0705 -780.3588 5.2009 19.7523 33.3070</array>
                  </list>
               </module>
               <module cmlx:templateRef="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.stoich">
                     <scalar cmlx:templateRef="stoich"
                             dataType="xsd:string"
                             dictRef="g:stoichiometry">C22H26O3</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:pointgroup">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestconciseabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                  </module>
                  <module cmlx:templateRef="l202.orient">
                     <molecule cmlx:templateRef="atom"
                               formalCharge="0"
                               id="mol.l202.orient"
                               spinMultiplicity="1">
                        <atomArray>
                           <atom elementType="O"
                                 id="a1"
                                 x3="2.184856"
                                 y3="2.180139"
                                 z3="0.120011">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="O"
                                 id="a2"
                                 x3="1.732449"
                                 y3="0.390783"
                                 z3="1.424881">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="O"
                                 id="a3"
                                 x3="-2.087731"
                                 y3="3.264701"
                                 z3="-0.773666">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a4"
                                 x3="4.208753"
                                 y3="-0.945484"
                                 z3="0.064266">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a5"
                                 x3="3.043546"
                                 y3="-1.252874"
                                 z3="-0.828348">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a6"
                                 x3="3.311906"
                                 y3="0.210086"
                                 z3="-0.385797">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a7"
                                 x3="4.205466"
                                 y3="-1.400345"
                                 z3="1.511857">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a8"
                                 x3="5.591992"
                                 y3="-0.963485"
                                 z3="-0.564999">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a9"
                                 x3="1.849441"
                                 y3="-2.010627"
                                 z3="-0.363839">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a10"
                                 x3="2.342657"
                                 y3="0.88395"
                                 z3="0.501926">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a11"
                                 x3="0.622349"
                                 y3="-1.915686"
                                 z3="-0.888517">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a12"
                                 x3="-0.527098"
                                 y3="-2.718805"
                                 z3="-0.343617">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a13"
                                 x3="0.269716"
                                 y3="-0.980116"
                                 z3="-2.01482">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a14"
                                 x3="1.197782"
                                 y3="2.957507"
                                 z3="0.851531">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a15"
                                 x3="-0.170656"
                                 y3="2.799164"
                                 z3="0.279507">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a16"
                                 x3="-1.0268"
                                 y3="1.639568"
                                 z3="0.334139">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a17"
                                 x3="-0.865368"
                                 y3="3.743824"
                                 z3="-0.40652">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a18"
                                 x3="-2.172108"
                                 y3="1.972037"
                                 z3="-0.318358">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a19"
                                 x3="-3.456984"
                                 y3="1.281326"
                                 z3="-0.646164">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a20"
                                 x3="-3.603974"
                                 y3="-0.1159"
                                 z3="-0.082841">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a21"
                                 x3="-3.48632"
                                 y3="-0.356294"
                                 z3="1.291358">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a22"
                                 x3="-3.917646"
                                 y3="-1.187235"
                                 z3="-0.923257">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a23"
                                 x3="-3.67725"
                                 y3="-1.635013"
                                 z3="1.808621">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a24"
                                 x3="-4.119767"
                                 y3="-2.466942"
                                 z3="-0.407497">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="C"
                                 id="a25"
                                 x3="-3.998651"
                                 y3="-2.695187"
                                 z3="0.960584">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a26"
                                 x3="3.295295"
                                 y3="-1.402073"
                                 z3="-1.875633">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a27"
                                 x3="3.722808"
                                 y3="0.86425"
                                 z3="-1.144616">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a28"
                                 x3="3.220156"
                                 y3="-1.336647"
                                 z3="1.967741">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a29"
                                 x3="4.55792"
                                 y3="-2.435379"
                                 z3="1.571759">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a30"
                                 x3="4.888951"
                                 y3="-0.780411"
                                 z3="2.100164">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a31"
                                 x3="6.006217"
                                 y3="-1.976636"
                                 z3="-0.53805">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a32"
                                 x3="5.569141"
                                 y3="-0.637796"
                                 z3="-1.60834">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a33"
                                 x3="6.275117"
                                 y3="-0.305124"
                                 z3="-0.019152">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a34"
                                 x3="1.999586"
                                 y3="-2.686196"
                                 z3="0.473054">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a35"
                                 x3="-0.212212"
                                 y3="-3.394559"
                                 z3="0.454222">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a36"
                                 x3="-1.003758"
                                 y3="-3.312981"
                                 z3="-1.131823">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a37"
                                 x3="-1.303325"
                                 y3="-2.058286"
                                 z3="0.054213">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a38"
                                 x3="1.121841"
                                 y3="-0.398319"
                                 z3="-2.367489">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a39"
                                 x3="-0.504497"
                                 y3="-0.276066"
                                 z3="-1.690429">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a40"
                                 x3="-0.144466"
                                 y3="-1.537464"
                                 z3="-2.863405">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a41"
                                 x3="1.538486"
                                 y3="3.988292"
                                 z3="0.75724">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a42"
                                 x3="1.225361"
                                 y3="2.659194"
                                 z3="1.900586">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-0.790477"
                                 y3="0.697186"
                                 z3="0.799118">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a44"
                                 x3="-0.642769"
                                 y3="4.757893"
                                 z3="-0.695218">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a45"
                                 x3="-3.569307"
                                 y3="1.251956"
                                 z3="-1.735442">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a46"
                                 x3="-4.280731"
                                 y3="1.908661"
                                 z3="-0.281022">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a47"
                                 x3="-3.241182"
                                 y3="0.463674"
                                 z3="1.957218">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a48"
                                 x3="-4.006361"
                                 y3="-1.019434"
                                 z3="-1.99169">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a49"
                                 x3="-3.575992"
                                 y3="-1.803988"
                                 z3="2.874819">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a50"
                                 x3="-4.3614"
                                 y3="-3.285109"
                                 z3="-1.076666">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                           <atom elementType="H"
                                 id="a51"
                                 x3="-4.146911"
                                 y3="-3.69044"
                                 z3="1.363744">
                              <property dictRef="g:atomicType">
                                 <scalar dataType="xsd:integer">0</scalar>
                              </property>
                           </atom>
                        </atomArray>
                        <bondArray/>
                        <formula concise="C22H26O3"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">312.2335999999998</scalar>
                        </property>
                        <formula convention="iupac:inchi" inline="InChI=1/22C.3O.26H">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;1;2;3;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/rA:51nO0O0O0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.1849,2.1801,.12;1.7324,.3908,1.4249;-2.0877,3.2647,-.7737;4.2088,-.9455,.0643;3.0435,-1.2529,-.8283;3.3119,.2101,-.3858;4.2055,-1.4003,1.5119;5.592,-.9635,-.565;1.8494,-2.0106,-.3638;2.3427,.884,.5019;.6223,-1.9157,-.8885;-.5271,-2.7188,-.3436;.2697,-.9801,-2.0148;1.1978,2.9575,.8515;-.1707,2.7992,.2795;-1.0268,1.6396,.3341;-.8654,3.7438,-.4065;-2.1721,1.972,-.3184;-3.457,1.2813,-.6462;-3.604,-.1159,-.0828;-3.4863,-.3563,1.2914;-3.9176,-1.1872,-.9233;-3.6772,-1.635,1.8086;-4.1198,-2.4669,-.4075;-3.9987,-2.6952,.9606;3.2953,-1.4021,-1.8756;3.7228,.8642,-1.1446;3.2202,-1.3366,1.9677;4.5579,-2.4354,1.5718;4.889,-.7804,2.1002;6.0062,-1.9766,-.5381;5.5691,-.6378,-1.6083;6.2751,-.3051,-.0192;1.9996,-2.6862,.4731;-.2122,-3.3946,.4542;-1.0038,-3.313,-1.1318;-1.3033,-2.0583,.0542;1.1218,-.3983,-2.3675;-.5045,-.2761,-1.6904;-.1445,-1.5375,-2.8634;1.5385,3.9883,.7572;1.2254,2.6592,1.9006;-.7905,.6972,.7991;-.6428,4.7579,-.6952;-3.5693,1.252,-1.7354;-4.2807,1.9087,-.281;-3.2412,.4637,1.9572;-4.0064,-1.0194,-1.9917;-3.576,-1.804,2.8748;-4.3614,-3.2851,-1.0767;-4.1469,-3.6904,1.3637;</scalar>
                        </formula>
                     </molecule>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.3082482 0.1551150 0.1183910</array>
                  </module>
               </module>
               <module cmlx:templateRef="l302">
                  <module cmlx:templateRef="l302.basis2">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="5">Precomputing XC quadrature grid using</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">NSgBfM= 726 725 726 726 726 MxSgAt= 51 MxSgA2= 51.</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l302">
                  <module cmlx:templateRef="l302.basis">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="11">NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="5">One-electron integrals computed using PRISM.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="6">One-electron integral symmetry used in STVInt</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NBasis= 706 RedAO= T EigKep= 1.11D-06 NBF= 706</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="7">NBsUse= 705 1.00D-06 EigRej= 9.72D-07 NBFU= 705</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l302.basis2">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="5">Precomputing XC quadrature grid using</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">NSgBfM= 726 726 726 726 726 MxSgAt= 51 MxSgA2= 51.</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l303.basis">
                  <list cmlx:templateRef="l303">
                     <scalar dataType="xsd:integer" dictRef="g:dipdrv">1</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l401"/>
               <module cmlx:templateRef="l716.dipole">
                  <array cmlx:templateRef="dipole"
                         dataType="xsd:double"
                         dictRef="x:d"
                         size="3">-7.43431621e-03 5.32164124e-02 -3.39786962e-01</array>
               </module>
               <module cmlx:templateRef="l716.forces">
                  <list cmlx:templateRef="force">
                     <array dataType="xsd:integer" dictRef="x:serial" size="51">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</array>
                     <array dataType="xsd:integer" dictRef="x:elementType" size="51">8 8 8 6 6 6 6 6 6 6 6 6 6 6 6 6 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 1 1 1 1 1 1 1 1 1</array>
                     <list>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.006515901 0.008416626 -0.009542705</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.007281135 -0.005653419 0.012050308</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.012344900 0.009025166 -0.009176659</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.005198401 -0.002668161 0.002336288</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.002574642 -0.007301093 -0.004462332</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000451298 0.009527300 -0.002720439</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000128888 -0.000929012 0.004280374</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.003345934 0.000356504 -0.002402375</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.001847157 -0.002754064 0.000797119</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.007756665 -0.007275942 -0.004741528</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001236346 -0.000755656 -0.000039999</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.002540500 -0.001444500 0.002178202</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000565064 0.002974062 -0.002768375</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.006459521 0.009757199 0.006954973</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.003555092 -0.001573179 0.002867377</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.003372822 -0.007366526 0.004285791</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.010626037 0.012459030 -0.000866404</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.005868266 -0.010406903 0.001949776</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001504831 0.000852743 -0.001945721</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000908992 0.001277651 -0.000863947</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000798607 0.003761568 0.003674526</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000176528 -0.000091081 -0.005223519</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000048965 -0.000501382 0.005193278</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000897722 -0.003939025 -0.003157285</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000720262 -0.004777883 0.002138044</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000170948 0.000160035 -0.000385593</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000922819 0.000917060 0.000880079</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.002037253 0.001180791 -0.000335048</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000911092 -0.002052964 -0.000222674</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.001352899 0.001531607 0.000705257</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000620816 -0.002179934 0.000404228</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000463927 0.000464322 -0.001610331</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.001261197 0.001408324 0.001349675</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000340405 0.000038465 0.000794696</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000855017 -0.001003991 0.001386879</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001124509 -0.001003847 -0.001752394</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001291269 0.001142686 0.000080697</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.001230105 0.000728569 -0.000306980</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001413835 0.000966347 0.000896998</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.001089588 -0.001487542 -0.001252254</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000740528 0.000203962 -0.000979342</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.001103567 -0.002768523 -0.000115660</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000521429 0.000400878 -0.000150101</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000454650 -0.000257623 -0.000119225</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000584245 0.000696110 -0.001015693</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000119179 0.001610145 0.000644997</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000361462 0.000965003 0.000231264</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000058727 0.000192727 -0.001256392</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">0.000051257 -0.000163065 0.001594185</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000194454 -0.001255629 -0.000909495</array>
                        <array dataType="xsd:double" dictRef="cc:force" size="3">-0.000117002 -0.001403935 0.000647460</array>
                     </list>
                  </list>
                  <list cmlx:templateRef="cartesianforce">
                     <scalar dataType="xsd:double" dictRef="cc:maxforce">0.012459030</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:rmsforce">0.003724918</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l716">
                  <list cmlx:templateRef="l716">
                     <scalar dataType="xsd:string" dictRef="g:l716">(Enter /usr/local/gaussian/gaussian16/g16/l716.exe)</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l502">
                  <scalar dataType="xsd:string" dictRef="g:l502.type">Closed</scalar>
                  <module cmlx:templateRef="l502.cycle">
                     <list cmlx:templateRef="cycle">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="cc:cycle">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:pass">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:idiag">1</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="l502.e">
                        <list cmlx:templateRef="l502.e">
                           <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97552960142</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553053891</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000937491</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553053859</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000000000319</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553054769</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000009099</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553054807</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000383</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553054840</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000324</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553054838</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000000000014</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553054848</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000096</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <module cmlx:templateRef="l502.footer">
                     <list cmlx:templateRef="scfdone">
                        <list>
                           <scalar dataType="xsd:double" dictRef="g:rbhflyp" units="nonsi:hartree">-1079.97553055</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:ncycle">8</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="scfdone">
                        <list cmlx:templateRef="scfdone">
                           <list>
                              <scalar dataType="xsd:double" dictRef="cc:kinener">1.075265705279e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:potener">-6.946104993597e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:eener">2.574682725398e+03</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <list cmlx:templateRef="l502">
                     <scalar dataType="xsd:string" dictRef="g:l502">Using DIIS extrapolation, IDIIS=  1040.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NGot=  1415577600 LenX=  1414494764 LenY=  1413959672</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on RMS density matrix=1.00D-08 within 128 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on MAX density matrix=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on             energy=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">No special actions if energy rises.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Fock matrices will be formed incrementally for  20 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502"/>
                  </list>
               </module>
               <module cmlx:templateRef="l716">
                  <list cmlx:templateRef="l716">
                     <scalar dataType="xsd:string" dictRef="g:l716">(Enter /usr/local/gaussian/gaussian16/g16/l716.exe)</scalar>
                  </list>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:jobtime">
                  <scalar dataType="xsd:string">PT228402.500S</scalar>
               </property>
               <property dictRef="cc:jobdatetime.end">
                  <scalar dataType="xsd:string">Wed Oct  9 21:13:09 2024</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="51">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</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="51">O O O C C C C C C C C C C C C C 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 H H H H H H H H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="51">0.110299 -0.173624 0.005443 0.078086 0.113836 -0.007403 -0.622337 -0.216258 -0.026195 -0.625158 0.474186 -0.668484 -0.908179 -0.364700 0.330626 0.618692 -0.119821 -0.876465 -0.627436 1.106479 -0.519478 -0.182116 -0.273850 -0.298246 -0.083870 0.161095 0.159854 0.164892 0.138982 0.139463 0.148504 0.130778 0.146866 0.108933 0.131903 0.142508 0.176735 0.141897 0.172213 0.144967 0.150542 0.178983 0.147681 0.121156 0.161229 0.189736 0.126450 0.106944 0.123825 0.119169 0.120671</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">-0.00000</scalar>
                  </module>
               </property>
               <property dictRef="cc:popanal">
                  <module cmlx:templateRef="l601.popanal">
                     <array dataType="xsd:double" dictRef="g:alphaocc" size="91">-19.18979 -19.16124 -19.10365 -10.29666 -10.23436 -10.23152 -10.22377 -10.19779 -10.19408 -10.19374 -10.18736 -10.18679 -10.18153 -10.18138 -10.18097 -10.18074 -10.17982 -10.17955 -10.17061 -10.16775 -10.16643 -10.15620 -10.15589 -10.15514 -10.15187 -1.11491 -1.10027 -1.01518 -0.88334 -0.87016 -0.82025 -0.80760 -0.80344 -0.75731 -0.75400 -0.74529 -0.72803 -0.69683 -0.69202 -0.68629 -0.68338 -0.64005 -0.61648 -0.60296 -0.58840 -0.57220 -0.55683 -0.54070 -0.52832 -0.52466 -0.51435 -0.49491 -0.48091 -0.47811 -0.47144 -0.46639 -0.45923 -0.45461 -0.45277 -0.44219 -0.44037 -0.43104 -0.42975 -0.42923 -0.41836 -0.41645 -0.41153 -0.40542 -0.39943 -0.39312 -0.38730 -0.38276 -0.38085 -0.37487 -0.36938 -0.36583 -0.35871 -0.35470 -0.35357 -0.35133 -0.35043 -0.32915 -0.30941 -0.29711 -0.28638 -0.28112 -0.27423 -0.26341 -0.25853 -0.23237 -0.22562</array>
                     <array dataType="xsd:double" dictRef="g:alphavirt" size="614">-0.02411 -0.02077 -0.01072 -0.00482 -0.00303 0.00336 0.01154 0.01269 0.01805 0.02183 0.02423 0.02974 0.03011 0.03651 0.03723 0.04193 0.04309 0.04567 0.04666 0.05001 0.05295 0.05721 0.06063 0.06549 0.06975 0.07015 0.07520 0.07817 0.08054 0.08309 0.08585 0.08885 0.09743 0.10021 0.10120 0.10644 0.10844 0.11227 0.11357 0.11512 0.12080 0.12292 0.12353 0.12700 0.13006 0.13321 0.13798 0.14129 0.14240 0.14485 0.14600 0.14886 0.15125 0.15323 0.15842 0.16053 0.16357 0.16556 0.16821 0.17099 0.17212 0.17453 0.17733 0.17952 0.18106 0.18276 0.18507 0.18935 0.19263 0.19341 0.19709 0.19768 0.19881 0.20064 0.20298 0.20541 0.20755 0.20812 0.21089 0.21101 0.21453 0.21853 0.22008 0.22509 0.22600 0.22822 0.22934 0.23066 0.23211 0.23707 0.23910 0.24217 0.24442 0.24477 0.24635 0.24872 0.25142 0.25205 0.25517 0.26004 0.26361 0.26456 0.26758 0.27033 0.27137 0.27749 0.27906 0.28143 0.28266 0.28665 0.28883 0.29047 0.29421 0.29780 0.30000 0.30225 0.30768 0.31085 0.31289 0.31802 0.31949 0.32030 0.32163 0.32345 0.32839 0.32990 0.33579 0.33708 0.33989 0.34297 0.35082 0.35096 0.35437 0.35698 0.36173 0.36864 0.37225 0.37552 0.38115 0.38307 0.38955 0.39760 0.39888 0.40507 0.41110 0.41532 0.41903 0.42694 0.43392 0.43708 0.44685 0.45190 0.45575 0.45977 0.46495 0.46906 0.47074 0.48651 0.49451 0.49759 0.50794 0.51700 0.52381 0.52527 0.53132 0.53689 0.54536 0.54788 0.55514 0.56615 0.56957 0.57055 0.57809 0.58230 0.58433 0.58814 0.59683 0.60079 0.60224 0.60780 0.61203 0.61779 0.62306 0.62869 0.63117 0.63525 0.63738 0.64094 0.64686 0.64802 0.65418 0.65687 0.65935 0.66588 0.66890 0.67294 0.67701 0.67994 0.68169 0.68629 0.68893 0.69447 0.69637 0.69715 0.70379 0.70562 0.70730 0.70881 0.71346 0.71890 0.72267 0.72420 0.72754 0.73185 0.73683 0.74027 0.74325 0.74967 0.75350 0.76118 0.76499 0.76691 0.77161 0.77736 0.78409 0.78571 0.79080 0.79589 0.79813 0.80109 0.80414 0.81290 0.81610 0.82406 0.83282 0.83667 0.84455 0.84995 0.85240 0.85718 0.85982 0.87226 0.87595 0.88690 0.89535 0.91226 0.91339 0.91810 0.92673 0.93218 0.93742 0.94378 0.95319 0.96260 0.96969 0.97277 0.98400 0.99682 1.00047 1.00805 1.01580 1.02726 1.02824 1.03947 1.04669 1.05589 1.06167 1.07057 1.08344 1.08669 1.10046 1.11101 1.11426 1.11525 1.12028 1.13530 1.13717 1.14909 1.16045 1.16765 1.18074 1.19253 1.20470 1.20561 1.21230 1.22183 1.22947 1.24427 1.25708 1.27293 1.28893 1.29377 1.30913 1.31253 1.32029 1.32905 1.33195 1.34794 1.36018 1.36773 1.38075 1.40202 1.40417 1.41065 1.41876 1.42374 1.43764 1.45003 1.45264 1.46052 1.46612 1.47149 1.47712 1.48504 1.49406 1.50414 1.50505 1.51154 1.51436 1.51981 1.52271 1.53476 1.54155 1.54493 1.55561 1.56460 1.57145 1.57623 1.58000 1.58210 1.60478 1.60991 1.61134 1.61943 1.62449 1.62916 1.63713 1.64434 1.64717 1.65307 1.65437 1.65989 1.66191 1.66879 1.66992 1.67669 1.68461 1.68759 1.70098 1.70493 1.70987 1.71666 1.72386 1.72707 1.72930 1.73806 1.75018 1.75882 1.76828 1.77313 1.77631 1.78081 1.78313 1.79239 1.79657 1.80878 1.81266 1.82338 1.83067 1.83269 1.83388 1.84392 1.84810 1.86122 1.86783 1.87280 1.88087 1.88996 1.89629 1.90313 1.91096 1.91659 1.91874 1.92815 1.93513 1.94716 1.94865 1.95806 1.96493 1.97130 1.99026 1.99392 1.99613 1.99895 2.00641 2.01221 2.01737 2.02506 2.03590 2.05229 2.06345 2.07260 2.07572 2.08299 2.09112 2.09588 2.10543 2.11439 2.13341 2.13742 2.15257 2.15939 2.16765 2.18011 2.19179 2.20177 2.21522 2.22104 2.22905 2.23442 2.24836 2.25458 2.26276 2.29615 2.30527 2.32280 2.34504 2.35503 2.36154 2.38515 2.38982 2.40281 2.40351 2.41397 2.43260 2.44025 2.44550 2.45380 2.45680 2.47069 2.48131 2.48874 2.50938 2.52190 2.52414 2.52619 2.53088 2.53214 2.53817 2.54751 2.54941 2.55854 2.56655 2.57334 2.59020 2.59803 2.61042 2.62639 2.63396 2.64167 2.64728 2.65268 2.65859 2.67758 2.68018 2.70749 2.70816 2.71694 2.72529 2.73125 2.73801 2.74153 2.74867 2.75427 2.76166 2.76772 2.77048 2.77220 2.77794 2.79043 2.79333 2.80498 2.80966 2.82532 2.83824 2.84339 2.84499 2.85487 2.86422 2.86631 2.87205 2.88226 2.88962 2.90348 2.90761 2.91207 2.92247 2.93147 2.94029 2.94419 2.95628 2.95851 2.96105 2.96589 2.98481 3.00491 3.02108 3.02807 3.03561 3.04557 3.06239 3.06982 3.08577 3.09967 3.10945 3.11819 3.12649 3.14412 3.16298 3.16958 3.17818 3.18318 3.18940 3.20079 3.20738 3.22162 3.23774 3.24762 3.25701 3.26873 3.33491 3.36817 3.37192 3.38142 3.40301 3.41200 3.43949 3.48327 3.52264 3.55024 3.56687 3.59831 3.61782 3.62199 3.63099 3.64003 3.70356 3.70773 3.72628 3.74033 3.78895 3.79276 3.81466 3.83616 3.84219 3.85774 3.85975 3.86168 3.87474 3.88901 3.95688 3.98709 4.02686 4.03491 4.04678 4.08390 4.13252 4.14841 4.15277 4.15696 4.21061 4.27967 4.31141 4.34623 4.35614 4.36098 4.49016 4.57103 4.61925 4.84487 5.01195 5.11859 5.18912 5.32067 5.41026 5.45337 5.65711 5.82665 5.92183 23.64868 23.70963 23.72891 23.82265 23.83220 23.85461 23.87042 23.90729 23.91961 23.95655 23.96597 23.97594 23.99740 24.00664 24.00990 24.02007 24.08462 24.09577 24.17171 24.19289 24.20730 24.29041 49.91280 49.93752 50.05747</array>
                     <module cmlx:templateRef="l601.state">
                        <scalar dataType="xsd:string" dictRef="g:l601.state">1-A.</scalar>
                     </module>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l601.mullik">
                     <scalar dataType="xsd:string" dictRef="g:title">Mulliken charges:</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:serial">1</scalar>
                     <list cmlx:templateRef="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="51">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</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="51">O O O C C C C C C C C C C C C C 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 H H H H H H H H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="51">0.087941 -0.172179 -0.005157 0.065096 0.135753 -0.012674 -0.630226 -0.214020 -0.061516 -0.594534 0.467799 -0.670412 -0.876958 -0.347598 0.267637 0.748538 -0.128692 -0.889096 -0.640470 1.155475 -0.610099 -0.232677 -0.246153 -0.300402 -0.098889 0.162237 0.162076 0.166901 0.139417 0.139209 0.149992 0.132074 0.148632 0.111687 0.132534 0.146695 0.165808 0.144641 0.171730 0.146599 0.153542 0.180557 0.155301 0.124436 0.163933 0.195056 0.132093 0.110715 0.125365 0.120766 0.121519</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">-0.00000</scalar>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l716.dipole">
                     <array cmlx:templateRef="dipole"
                            dataType="xsd:double"
                            dictRef="x:d"
                            size="3">3.41486091e-03 -1.70635813e-02 -3.29224665e-01</array>
                  </module>
               </property>
               <property dictRef="cc:forces">
                  <scalar dictRef="cc:linkToAtoms">./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999']</scalar>
               </property>
               <property dictRef="cc:multipole">
                  <list cmlx:templateRef="multipole">
                     <array dataType="xsd:double" dictRef="cc:dipole" size="3">0.0087 -0.0434 -0.8368</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">0.8380</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-145.5340 -143.2829 -148.6992</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">3.6620 -0.5961 1.2056</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">0.3047 2.5558 -2.8605 3.6620 -0.5961 1.2056</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">69.6613 44.9846 0.6973 -0.2609 -9.1503 -11.4294 -8.1734 -0.2555 13.4011 -0.2371</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-8427.1342 -3468.4504 -1059.4939 -60.8802 71.6234 135.7645 -33.6727 -5.9333 -5.7029 -1976.9070 -1514.2346 -790.4392 13.5707 19.8375 35.0563</array>
                  </list>
               </property>
               <property dictRef="cc:virtualorbs">
                  <array dataType="xsd:string" delimiter="|" size="614">(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)|(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)|(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)|(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)|(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)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)</array>
               </property>
               <property dictRef="cc:virtualorbs">
                  <array dataType="xsd:string" delimiter="|" size="614">(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)|(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)|(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)|(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)|(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)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)</array>
               </property>
               <property dictRef="cc:occupiedorbs">
                  <array dataType="xsd:string" delimiter="|" size="91">(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>
               </property>
               <property dictRef="cc:occupiedorbs">
                  <array dataType="xsd:string" delimiter="|" size="91">(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>
               </property>
            </propertyList>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l9999.archive" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:string" dictRef="g:zmat">0</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:electronicstate">1-A</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:hfenergy" units="nonsi:hartree">-1079.9755305</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsd" units="nonsi:unknown">5.884E-9</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsf" units="nonsi:unknown">3.236E-6</scalar>
                  <scalar dataType="xsd:string" dictRef="x:Quadrupole">0.2823853,1.8800592,-2.1624445,2.7467301,-0.6026708,0.6722227</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:pointgroup">C01 [X(C22H26O3)]</scalar>
                  <array dataType="xsd:double"
                         dictRef="cc:dipole"
                         size="3"
                         units="nonsi:debye">-0.0054226 -0.0301945 -0.3282539</array>
               </module>
            </module>
            <molecule formalCharge="0" id="mol9999" spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="2.25656683"
                        y3="2.09561415"
                        z3="-0.03198735">
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.0" size="3">-0.000001972 -0.000004790 0.000003824</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.1" size="3">0.000000261 0.000002504 0.000005369</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.2" size="3">-0.000000278 0.000001451 -0.000008406</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.3" size="3">-0.000000752 0.000001644 -0.000002814</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.4" size="3">0.000001818 0.000003377 -0.000004789</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.5" size="3">0.000007333 -0.000003404 0.000007712</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.6" size="3">-0.000001843 -0.000005639 0.000003240</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.7" size="3">0.000002815 -0.000000473 -0.000003738</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.8" size="3">-0.000002845 0.000001555 0.000003174</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.9" size="3">-0.000005087 -0.000000721 -0.000013421</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.10" size="3">0.000001767 -0.000001126 0.000000797</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.11" size="3">0.000000522 -0.000004081 -0.000001231</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.12" size="3">-0.000000351 0.000001563 -0.000005277</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.13" size="3">0.000004435 0.000003938 -0.000001147</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.14" size="3">-0.000003522 -0.000005504 0.000002648</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.15" size="3">0.000006954 0.000004971 -0.000002469</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.16" size="3">0.000004355 0.000000979 0.000001014</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.17" size="3">-0.000004386 -0.000002251 0.000010766</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.18" size="3">-0.000000717 -0.000000556 -0.000004754</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.19" size="3">0.000001794 0.000004558 0.000010296</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.20" size="3">0.000000205 0.000003658 -0.000007200</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.21" size="3">-0.000003748 -0.000008864 -0.000002070</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.22" size="3">-0.000002282 -0.000008599 -0.000000149</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.23" size="3">-0.000000286 0.000004414 -0.000005554</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.24" size="3">0.000000692 0.000002846 0.000005245</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.25" size="3">-0.000001078 -0.000001111 -0.000000294</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.26" size="3">-0.000000456 0.000001900 0.000000188</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.27" size="3">0.000001610 -0.000000216 -0.000001011</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.28" size="3">0.000000376 0.000001267 -0.000001459</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.29" size="3">-0.000000166 0.000000155 -0.000000650</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.30" size="3">-0.000000729 0.000000677 -0.000000277</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.31" size="3">-0.000001261 -0.000000080 0.000000786</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.32" size="3">-0.000000992 -0.000000277 -0.000000379</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.33" size="3">0.000000053 -0.000000257 -0.000001409</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.34" size="3">0.000000509 0.000000462 -0.000001835</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.35" size="3">-0.000000232 0.000002063 0.000000607</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.36" size="3">0.000000886 0.000000443 -0.000001091</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.37" size="3">-0.000000522 -0.000001159 -0.000000443</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.38" size="3">0.000000880 0.000001220 0.000001192</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.39" size="3">-0.000001348 0.000001293 0.000001484</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.40" size="3">0.000000048 0.000000354 0.000001657</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.41" size="3">0.000000007 -0.000001667 -0.000000966</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.42" size="3">-0.000001875 -0.000000238 0.000003203</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.43" size="3">-0.000001893 0.000002266 0.000006453</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.44" size="3">0.000000608 0.000000780 0.000001631</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.45" size="3">-0.000000032 0.000000685 0.000000332</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.46" size="3">0.000000414 -0.000000574 0.000000961</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.47" size="3">0.000000333 0.000001364 0.000000513</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.48" size="3">0.000000460 -0.000000399 0.000000107</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.49" size="3">-0.000000360 -0.000000131 0.000000017</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.50" size="3">-0.000000120 -0.000000269 -0.000000384</array>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a2"
                        x3="1.81224366"
                        y3="0.36686497"
                        z3="1.35479118"/>
                  <atom elementType="O"
                        id="a3"
                        x3="-2.02156712"
                        y3="3.21049056"
                        z3="-0.85936052"/>
                  <atom elementType="C"
                        id="a4"
                        x3="4.23242527"
                        y3="-1.06103534"
                        z3="-0.01370601"/>
                  <atom elementType="C"
                        id="a5"
                        x3="3.03996679"
                        y3="-1.38541358"
                        z3="-0.86328071"/>
                  <atom elementType="C"
                        id="a6"
                        x3="3.34112958"
                        y3="0.08961139"
                        z3="-0.48681963"/>
                  <atom elementType="C"
                        id="a7"
                        x3="4.26024772"
                        y3="-1.45786023"
                        z3="1.45059784"/>
                  <atom elementType="C"
                        id="a8"
                        x3="5.5983711"
                        y3="-1.12568747"
                        z3="-0.67677605"/>
                  <atom elementType="C"
                        id="a9"
                        x3="1.84743565"
                        y3="-2.1053184"
                        z3="-0.3384449"/>
                  <atom elementType="C"
                        id="a10"
                        x3="2.40531525"
                        y3="0.81332877"
                        z3="0.39752975"/>
                  <atom elementType="C"
                        id="a11"
                        x3="0.60859611"
                        y3="-2.01213181"
                        z3="-0.83508011"/>
                  <atom elementType="C"
                        id="a12"
                        x3="-0.53786331"
                        y3="-2.77486228"
                        z3="-0.22926095"/>
                  <atom elementType="C"
                        id="a13"
                        x3="0.24041862"
                        y3="-1.11669155"
                        z3="-1.98869786"/>
                  <atom elementType="C"
                        id="a14"
                        x3="1.30037411"
                        y3="2.91680672"
                        z3="0.69263227"/>
                  <atom elementType="C"
                        id="a15"
                        x3="-0.08468514"
                        y3="2.75726907"
                        z3="0.16247688"/>
                  <atom elementType="C"
                        id="a16"
                        x3="-0.9559684"
                        y3="1.61430098"
                        z3="0.28542818"/>
                  <atom elementType="C"
                        id="a17"
                        x3="-0.78317335"
                        y3="3.68465242"
                        z3="-0.5430121"/>
                  <atom elementType="C"
                        id="a18"
                        x3="-2.11292367"
                        y3="1.93843486"
                        z3="-0.35050502"/>
                  <atom elementType="C"
                        id="a19"
                        x3="-3.41586981"
                        y3="1.2554217"
                        z3="-0.61746743"/>
                  <atom elementType="C"
                        id="a20"
                        x3="-3.56852208"
                        y3="-0.11582558"
                        z3="0.00507509"/>
                  <atom elementType="C"
                        id="a21"
                        x3="-3.41859266"
                        y3="-0.30318977"
                        z3="1.38437588"/>
                  <atom elementType="C"
                        id="a22"
                        x3="-3.9196297"
                        y3="-1.21469663"
                        z3="-0.78337427"/>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.61463487"
                        y3="-1.55718145"
                        z3="1.95727115"/>
                  <atom elementType="C"
                        id="a24"
                        x3="-4.12691096"
                        y3="-2.4695613"
                        z3="-0.21165575"/>
                  <atom elementType="C"
                        id="a25"
                        x3="-3.97350371"
                        y3="-2.64508418"
                        z3="1.16095737"/>
                  <atom elementType="H"
                        id="a26"
                        x3="3.26210856"
                        y3="-1.58006476"
                        z3="-1.90980279"/>
                  <atom elementType="H"
                        id="a27"
                        x3="3.74161741"
                        y3="0.70657121"
                        z3="-1.28151926"/>
                  <atom elementType="H"
                        id="a28"
                        x3="3.28819904"
                        y3="-1.36067442"
                        z3="1.92850895"/>
                  <atom elementType="H"
                        id="a29"
                        x3="4.59897921"
                        y3="-2.49507973"
                        z3="1.54301873"/>
                  <atom elementType="H"
                        id="a30"
                        x3="4.96783106"
                        y3="-0.82578926"
                        z3="1.9959298"/>
                  <atom elementType="H"
                        id="a31"
                        x3="5.99830691"
                        y3="-2.14332129"
                        z3="-0.61972215"/>
                  <atom elementType="H"
                        id="a32"
                        x3="5.55307847"
                        y3="-0.84143115"
                        z3="-1.73143405"/>
                  <atom elementType="H"
                        id="a33"
                        x3="6.30504858"
                        y3="-0.45690711"
                        z3="-0.17538928"/>
                  <atom elementType="H"
                        id="a34"
                        x3="2.00946757"
                        y3="-2.74933597"
                        z3="0.52080646"/>
                  <atom elementType="H"
                        id="a35"
                        x3="-0.21218552"
                        y3="-3.42319595"
                        z3="0.58679118"/>
                  <atom elementType="H"
                        id="a36"
                        x3="-1.04355082"
                        y3="-3.39238439"
                        z3="-0.98056932"/>
                  <atom elementType="H"
                        id="a37"
                        x3="-1.29371383"
                        y3="-2.08698079"
                        z3="0.16136835"/>
                  <atom elementType="H"
                        id="a38"
                        x3="1.09146746"
                        y3="-0.56278329"
                        z3="-2.38604084"/>
                  <atom elementType="H"
                        id="a39"
                        x3="-0.51469892"
                        y3="-0.38827092"
                        z3="-1.67322456"/>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.20385601"
                        y3="-1.70079805"
                        z3="-2.80338789"/>
                  <atom elementType="H"
                        id="a41"
                        x3="1.65353177"
                        y3="3.9375693"
                        z3="0.54837191"/>
                  <atom elementType="H"
                        id="a42"
                        x3="1.35094135"
                        y3="2.66005516"
                        z3="1.75177799"/>
                  <atom elementType="H"
                        id="a43"
                        x3="-0.72139657"
                        y3="0.68757409"
                        z3="0.78170607"/>
                  <atom elementType="H"
                        id="a44"
                        x3="-0.55338292"
                        y3="4.68283072"
                        z3="-0.87777881"/>
                  <atom elementType="H"
                        id="a45"
                        x3="-3.55698069"
                        y3="1.18451562"
                        z3="-1.70147206"/>
                  <atom elementType="H"
                        id="a46"
                        x3="-4.22055647"
                        y3="1.90959269"
                        z3="-0.25694652"/>
                  <atom elementType="H"
                        id="a47"
                        x3="-3.14421445"
                        y3="0.53867537"
                        z3="2.01030734"/>
                  <atom elementType="H"
                        id="a48"
                        x3="-4.03371847"
                        y3="-1.08815215"
                        z3="-1.85507739"/>
                  <atom elementType="H"
                        id="a49"
                        x3="-3.48808383"
                        y3="-1.68518419"
                        z3="3.02646896"/>
                  <atom elementType="H"
                        id="a50"
                        x3="-4.39784658"
                        y3="-3.309813"
                        z3="-0.8410548"/>
                  <atom elementType="H"
                        id="a51"
                        x3="-4.12572785"
                        y3="-3.62107526"
                        z3="1.60740774"/>
               </atomArray>
               <bondArray/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">312.2335999999998</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1/22C.3O.26H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;1;2;3;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/rA:51nO0O0O0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.2566,2.0956,-.032;1.8122,.3669,1.3548;-2.0216,3.2105,-.8594;4.2324,-1.061,-.0137;3.04,-1.3854,-.8633;3.3411,.0896,-.4868;4.2602,-1.4579,1.4506;5.5984,-1.1257,-.6768;1.8474,-2.1053,-.3384;2.4053,.8133,.3975;.6086,-2.0121,-.8351;-.5379,-2.7749,-.2293;.2404,-1.1167,-1.9887;1.3004,2.9168,.6926;-.0847,2.7573,.1625;-.956,1.6143,.2854;-.7832,3.6847,-.543;-2.1129,1.9384,-.3505;-3.4159,1.2554,-.6175;-3.5685,-.1158,.0051;-3.4186,-.3032,1.3844;-3.9196,-1.2147,-.7834;-3.6146,-1.5572,1.9573;-4.1269,-2.4696,-.2117;-3.9735,-2.6451,1.161;3.2621,-1.5801,-1.9098;3.7416,.7066,-1.2815;3.2882,-1.3607,1.9285;4.599,-2.4951,1.543;4.9678,-.8258,1.9959;5.9983,-2.1433,-.6197;5.5531,-.8414,-1.7314;6.305,-.4569,-.1754;2.0095,-2.7493,.5208;-.2122,-3.4232,.5868;-1.0436,-3.3924,-.9806;-1.2937,-2.087,.1614;1.0915,-.5628,-2.386;-.5147,-.3883,-1.6732;-.2039,-1.7008,-2.8034;1.6535,3.9376,.5484;1.3509,2.6601,1.7518;-.7214,.6876,.7817;-.5534,4.6828,-.8778;-3.557,1.1845,-1.7015;-4.2206,1.9096,-.2569;-3.1442,.5387,2.0103;-4.0337,-1.0882,-1.8551;-3.4881,-1.6852,3.0265;-4.3978,-3.3098,-.8411;-4.1257,-3.6211,1.6074;</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-BELVIS4</scalar>
               </parameter>
               <parameter dictRef="cc:jobname">
                  <scalar dataType="xsd:string">APULGAR</scalar>
               </parameter>
               <parameter dictRef="cc:title">
                  <scalar dataType="xsd:string">Optimization Resmethrin_RS CONF10 gas</scalar>
               </parameter>
               <parameter dictRef="cc:version">
                  <scalar dataType="xsd:string">EM64L-G16RevC.01</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:degfreedom">
                  <scalar cmlx:templateRef="degfreedom" dataType="xsd:integer">147</scalar>
               </parameter>
               <parameter dictRef="cc:frameworkgroup">
                  <scalar cmlx:templateRef="framework" dataType="xsd:string">C1[X(C22H26O3)]</scalar>
               </parameter>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string">RB3LYP</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">6-311+G(d,p)</scalar>
               </parameter>
               <parameter dictRef="g:operation">
                  <scalar dataType="xsd:string">Freq</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">#P</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">RB3LYP/6-311+G(d,p)</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">Freq</scalar>
               </parameter>
            </parameterList>
            <molecule cmlx:templateRef="atom"
                      formalCharge="0"
                      id="mol.l202.orient"
                      spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="2.184856"
                        y3="2.180139"
                        z3="0.120011">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a2"
                        x3="1.732449"
                        y3="0.390783"
                        z3="1.424881">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a3"
                        x3="-2.087731"
                        y3="3.264701"
                        z3="-0.773666">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a4"
                        x3="4.208753"
                        y3="-0.945484"
                        z3="0.064266">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a5"
                        x3="3.043546"
                        y3="-1.252874"
                        z3="-0.828348">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a6"
                        x3="3.311906"
                        y3="0.210086"
                        z3="-0.385797">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a7"
                        x3="4.205466"
                        y3="-1.400345"
                        z3="1.511857">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a8"
                        x3="5.591992"
                        y3="-0.963485"
                        z3="-0.564999">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a9"
                        x3="1.849441"
                        y3="-2.010627"
                        z3="-0.363839">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a10"
                        x3="2.342657"
                        y3="0.88395"
                        z3="0.501926">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a11"
                        x3="0.622349"
                        y3="-1.915686"
                        z3="-0.888517">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a12"
                        x3="-0.527098"
                        y3="-2.718805"
                        z3="-0.343617">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a13"
                        x3="0.269716"
                        y3="-0.980116"
                        z3="-2.01482">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a14"
                        x3="1.197782"
                        y3="2.957507"
                        z3="0.851531">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a15"
                        x3="-0.170656"
                        y3="2.799164"
                        z3="0.279507">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a16"
                        x3="-1.0268"
                        y3="1.639568"
                        z3="0.334139">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a17"
                        x3="-0.865368"
                        y3="3.743824"
                        z3="-0.40652">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a18"
                        x3="-2.172108"
                        y3="1.972037"
                        z3="-0.318358">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a19"
                        x3="-3.456984"
                        y3="1.281326"
                        z3="-0.646164">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a20"
                        x3="-3.603974"
                        y3="-0.1159"
                        z3="-0.082841">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a21"
                        x3="-3.48632"
                        y3="-0.356294"
                        z3="1.291358">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a22"
                        x3="-3.917646"
                        y3="-1.187235"
                        z3="-0.923257">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.67725"
                        y3="-1.635013"
                        z3="1.808621">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a24"
                        x3="-4.119767"
                        y3="-2.466942"
                        z3="-0.407497">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a25"
                        x3="-3.998651"
                        y3="-2.695187"
                        z3="0.960584">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a26"
                        x3="3.295295"
                        y3="-1.402073"
                        z3="-1.875633">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a27"
                        x3="3.722808"
                        y3="0.86425"
                        z3="-1.144616">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a28"
                        x3="3.220156"
                        y3="-1.336647"
                        z3="1.967741">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a29"
                        x3="4.55792"
                        y3="-2.435379"
                        z3="1.571759">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a30"
                        x3="4.888951"
                        y3="-0.780411"
                        z3="2.100164">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a31"
                        x3="6.006217"
                        y3="-1.976636"
                        z3="-0.53805">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a32"
                        x3="5.569141"
                        y3="-0.637796"
                        z3="-1.60834">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a33"
                        x3="6.275117"
                        y3="-0.305124"
                        z3="-0.019152">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a34"
                        x3="1.999586"
                        y3="-2.686196"
                        z3="0.473054">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a35"
                        x3="-0.212212"
                        y3="-3.394559"
                        z3="0.454222">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a36"
                        x3="-1.003758"
                        y3="-3.312981"
                        z3="-1.131823">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a37"
                        x3="-1.303325"
                        y3="-2.058286"
                        z3="0.054213">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a38"
                        x3="1.121841"
                        y3="-0.398319"
                        z3="-2.367489">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a39"
                        x3="-0.504497"
                        y3="-0.276066"
                        z3="-1.690429">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.144466"
                        y3="-1.537464"
                        z3="-2.863405">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a41"
                        x3="1.538486"
                        y3="3.988292"
                        z3="0.75724">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a42"
                        x3="1.225361"
                        y3="2.659194"
                        z3="1.900586">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a43"
                        x3="-0.790477"
                        y3="0.697186"
                        z3="0.799118">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a44"
                        x3="-0.642769"
                        y3="4.757893"
                        z3="-0.695218">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a45"
                        x3="-3.569307"
                        y3="1.251956"
                        z3="-1.735442">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a46"
                        x3="-4.280731"
                        y3="1.908661"
                        z3="-0.281022">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a47"
                        x3="-3.241182"
                        y3="0.463674"
                        z3="1.957218">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a48"
                        x3="-4.006361"
                        y3="-1.019434"
                        z3="-1.99169">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a49"
                        x3="-3.575992"
                        y3="-1.803988"
                        z3="2.874819">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a50"
                        x3="-4.3614"
                        y3="-3.285109"
                        z3="-1.076666">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a51"
                        x3="-4.146911"
                        y3="-3.69044"
                        z3="1.363744">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
               </atomArray>
               <bondArray/>
               <formula concise="C22H26O3"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">312.2335999999998</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1/22C.3O.26H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;1;2;3;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/rA:51nO0O0O0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.1849,2.1801,.12;1.7324,.3908,1.4249;-2.0877,3.2647,-.7737;4.2088,-.9455,.0643;3.0435,-1.2529,-.8283;3.3119,.2101,-.3858;4.2055,-1.4003,1.5119;5.592,-.9635,-.565;1.8494,-2.0106,-.3638;2.3427,.884,.5019;.6223,-1.9157,-.8885;-.5271,-2.7188,-.3436;.2697,-.9801,-2.0148;1.1978,2.9575,.8515;-.1707,2.7992,.2795;-1.0268,1.6396,.3341;-.8654,3.7438,-.4065;-2.1721,1.972,-.3184;-3.457,1.2813,-.6462;-3.604,-.1159,-.0828;-3.4863,-.3563,1.2914;-3.9176,-1.1872,-.9233;-3.6772,-1.635,1.8086;-4.1198,-2.4669,-.4075;-3.9987,-2.6952,.9606;3.2953,-1.4021,-1.8756;3.7228,.8642,-1.1446;3.2202,-1.3366,1.9677;4.5579,-2.4354,1.5718;4.889,-.7804,2.1002;6.0062,-1.9766,-.5381;5.5691,-.6378,-1.6083;6.2751,-.3051,-.0192;1.9996,-2.6862,.4731;-.2122,-3.3946,.4542;-1.0038,-3.313,-1.1318;-1.3033,-2.0583,.0542;1.1218,-.3983,-2.3675;-.5045,-.2761,-1.6904;-.1445,-1.5375,-2.8634;1.5385,3.9883,.7572;1.2254,2.6592,1.9006;-.7905,.6972,.7991;-.6428,4.7579,-.6952;-3.5693,1.252,-1.7354;-4.2807,1.9087,-.281;-3.2412,.4637,1.9572;-4.0064,-1.0194,-1.9917;-3.576,-1.804,2.8748;-4.3614,-3.2851,-1.0767;-4.1469,-3.6904,1.3637;</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">Optimization Resmethrin_RS CONF10 gas</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>
                  <module cmlx:templateRef="l101.isotope2">
                     <array cmlx:templateRef="atom"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">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</array>
                     <array cmlx:templateRef="iatwgt"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">16 16 16 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 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</array>
                     <array cmlx:templateRef="atmwgt"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="51">15.9949146 15.9949146 15.9949146 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250</array>
                     <array cmlx:templateRef="nucspn"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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</array>
                     <array cmlx:templateRef="atzeff"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="51">5.6000000 5.6000000 5.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000</array>
                  </module>
                  <list cmlx:templateRef="rest">
                     <scalar dataType="xsd:string" dictRef="x:l101">(Enter /usr/local/gaussian/gaussian16/g16/l101.exe)</scalar>
                     <scalar dataType="xsd:string" dictRef="x:l101">Structure from the checkpoint file:  "opt-b3lyp-pople.chk"</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="53">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 R46 R47 R48 R49 R50 R51 R52 R53</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="53">1 1 2 3 3 4 4 4 4 5 5 5 6 6 7 7 7 8 8 8 9 9 11 11 12 12 12 13 13 13 14 14 14 15 15 16 16 17 18 19 19 19 20 20 21 21 22 22 23 23 24 24 25</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="53">10 14 10 17 18 5 6 7 8 6 9 26 10 27 28 29 30 31 32 33 11 34 12 13 35 36 37 38 39 40 15 41 42 16 17 18 43 44 19 20 45 46 21 22 23 47 24 48 25 49 25 50 51</array>
                        <array dataType="xsd:double" dictRef="cc:distance" size="53">1.3605 1.4539 1.2114 1.3633 1.3731 1.4997 1.5304 1.5174 1.5198 1.5518 1.4886 1.0874 1.477 1.0829 1.0875 1.095 1.0943 1.0949 1.0932 1.0946 1.3379 1.086 1.5044 1.5061 1.0919 1.0961 1.0941 1.0904 1.0956 1.0965 1.4916 1.0897 1.091 1.4424 1.3585 1.3594 1.0771 1.0776 1.4951 1.5137 1.0954 1.0979 1.4 1.3973 1.3925 1.0843 1.3945 1.0852 1.3951 1.0842 1.3923 1.0842 1.084</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="53">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="angle">
                        <array dataType="xsd:string" dictRef="g:symbol" size="92">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 A86 A87 A88 A89 A90 A91 A92</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="92">10 17 5 5 6 6 7 4 4 6 6 9 4 4 5 5 10 4 4 4 28 28 29 4 4 4 31 31 32 5 5 11 1 1 2 9 9 12 11 11 11 35 35 36 11 11 11 38 38 39 1 1 1 15 15 41 14 14 16 15 15 18 3 3 15 3 3 16 18 18 18 20 20 45 19 19 21 20 20 23 20 20 24 21 21 25 22 22 25 23 23 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="92">1 3 4 4 4 4 4 5 5 5 5 5 6 6 6 6 6 7 7 7 7 7 7 8 8 8 8 8 8 9 9 9 10 10 10 11 11 11 12 12 12 12 12 12 13 13 13 13 13 13 14 14 14 14 14 14 15 15 15 16 16 16 17 17 17 18 18 18 19 19 19 19 19 19 20 20 20 21 21 21 22 22 22 23 23 23 24 24 24 25 25 25</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="92">14 18 7 8 7 8 8 9 26 9 26 26 10 27 10 27 27 28 29 30 29 30 30 31 32 33 32 33 33 11 34 34 2 6 6 12 13 13 35 36 37 36 37 37 38 39 40 39 40 40 15 41 42 41 42 42 16 17 17 18 43 43 15 44 44 16 19 19 20 45 46 45 46 46 21 22 22 23 47 47 24 48 48 25 49 49 25 50 50 24 51 51</array>
                        <array dataType="xsd:double" dictRef="cc:angle" size="92">116.5468 107.257 120.3123 117.2781 120.3728 114.8692 113.1684 122.8123 114.9291 121.9807 111.3446 114.6081 123.5239 116.0941 119.2111 115.8042 113.2389 112.6013 109.5623 109.9804 108.9076 107.8982 107.7593 110.1886 111.8766 110.759 107.8829 107.9503 108.0465 125.2561 116.5029 118.2398 122.9112 110.0031 127.0669 121.389 123.5114 115.0628 112.0054 111.173 110.5784 108.3814 108.2109 106.272 112.9763 110.0738 110.5763 107.7657 108.4271 106.7898 111.9099 104.4754 108.69 110.7363 111.2794 109.5083 127.9767 126.0844 105.9388 106.5748 126.1208 127.3034 110.4949 116.3462 133.1573 109.7323 114.5203 135.7473 115.3591 108.5731 107.9319 109.5942 109.3174 105.6102 121.0398 120.3779 118.5274 120.7143 119.4652 119.8203 120.9109 119.4707 119.6183 120.2379 119.7079 120.0542 120.0845 119.771 120.1415 119.5217 120.2071 120.2701</array>
                        <array dataType="xsd:string" delimiter="|" dictRef="g:deriv" size="92">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>
                     <list cmlx:templateRef="dihed">
                        <array dataType="xsd:string" dictRef="g:symbol" size="121">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</array>
                        <array dataType="xsd:integer" dictRef="g:atom1" size="121">14 14 10 10 10 18 18 17 17 7 7 8 8 7 7 8 8 5 5 5 6 6 6 8 8 8 5 5 5 6 6 6 7 7 7 9 9 26 26 4 4 6 6 26 26 4 4 5 5 27 27 5 5 34 34 9 9 9 13 13 13 9 9 9 12 12 12 1 1 41 41 42 42 14 14 17 17 14 14 16 16 15 15 43 43 3 3 3 16 16 16 18 18 45 45 46 46 19 19 22 22 19 19 21 21 20 20 47 47 20 20 48 48 21 21 49 49 22 22 50 50</array>
                        <array dataType="xsd:integer" dictRef="g:atom2" size="121">1 1 1 1 1 3 3 3 3 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 9 9 9 9 11 11 11 11 11 11 11 11 11 11 11 11 14 14 14 14 14 14 15 15 15 15 15 15 15 15 16 16 16 16 18 18 18 18 18 18 19 19 19 19 19 19 20 20 20 20 20 20 20 20 21 21 21 21 22 22 22 22 23 23 23 23 24 24 24 24</array>
                        <array dataType="xsd:integer" dictRef="g:atom3" size="121">10 10 14 14 14 17 17 18 18 5 5 5 5 6 6 6 6 7 7 7 7 7 7 7 7 7 8 8 8 8 8 8 8 8 8 6 6 6 6 9 9 9 9 9 9 10 10 10 10 10 10 11 11 11 11 12 12 12 12 12 12 13 13 13 13 13 13 15 15 15 15 15 15 16 16 16 16 17 17 17 17 18 18 18 18 19 19 19 19 19 19 20 20 20 20 20 20 21 21 21 21 22 22 22 22 23 23 23 23 24 24 24 24 25 25 25 25 25 25 25 25</array>
                        <array dataType="xsd:integer" dictRef="g:atom4" size="121">2 6 15 41 42 15 44 16 19 9 26 9 26 10 27 10 27 28 29 30 28 29 30 28 29 30 31 32 33 31 32 33 31 32 33 10 27 10 27 11 34 11 34 11 34 1 2 1 2 1 2 12 13 12 13 35 36 37 35 36 37 38 39 40 38 39 40 16 17 16 17 16 17 18 43 18 43 3 44 3 44 3 19 3 19 20 45 46 20 45 46 21 22 21 22 21 22 23 47 23 47 24 48 24 48 25 49 25 49 25 50 25 50 24 51 24 51 23 51 23 51</array>
                        <array dataType="xsd:double" dictRef="cc:dihed" size="121">-2.0715 176.4533 -86.2804 153.8535 37.0184 -0.5033 179.9034 0.3981 -179.5185 -0.4303 -148.2149 144.0816 -3.703 -4.2207 144.1522 -144.9613 3.4116 -37.0113 84.3495 -157.3803 35.7767 157.1375 -84.5923 177.13 -61.5092 56.7611 -87.3041 32.7093 153.3199 -156.77 -36.7566 83.8539 59.6623 179.6757 -59.7137 -1.2142 -141.7907 139.2362 -1.3403 154.3557 -25.222 81.517 -98.0607 -57.7665 122.6557 150.3792 -31.1728 -140.3114 38.1365 1.2111 179.6591 -179.6215 -1.9393 -0.0504 177.6318 -3.376 -124.7939 117.4062 178.7573 57.3395 -60.4604 0.8081 -119.7088 122.5367 178.6239 58.107 -59.6475 71.0554 -109.0823 -172.818 7.0444 -50.7686 129.0938 179.732 -0.6199 -0.1524 179.4958 -179.4818 0.0185 0.4054 179.9057 -0.1511 179.7401 -179.7938 0.0974 -176.5157 60.0647 -53.9585 3.5968 -119.8228 126.154 56.3575 -126.3799 179.2362 -3.5012 -65.4579 111.8048 177.3366 -2.8262 0.0245 179.8617 -176.8506 3.0565 0.48 -179.613 -0.4427 179.6146 179.7206 -0.222 -0.5679 -179.9395 179.5251 0.1535 0.357 179.9837 -179.7006 -0.0738 0.143 -179.4835 179.5123 -0.1143</array>
                        <array dataType="xsd:string"
                               delimiter="|"
                               dictRef="g:deriv"
                               size="121">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="147">0.00063 0.00106 0.00196 0.00254 0.00272 0.00310 0.00367 0.00380 0.00665 0.01013 0.01251 0.01472 0.01533 0.01589 0.01708 0.01739 0.01792 0.01933 0.02002 0.02059 0.02120 0.02254 0.02277 0.02341 0.02495 0.02763 0.02861 0.02880 0.03067 0.03261 0.03387 0.03772 0.04479 0.04585 0.04614 0.04641 0.04727 0.04804 0.04990 0.05116 0.05556 0.05575 0.05599 0.05687 0.05835 0.05961 0.06229 0.06458 0.08346 0.08511 0.08693 0.09545 0.09967 0.10043 0.10682 0.11003 0.11572 0.11964 0.11989 0.12108 0.12200 0.12235 0.12506 0.12639 0.12664 0.12913 0.13745 0.14159 0.14310 0.14360 0.14454 0.14654 0.14726 0.15051 0.15233 0.15561 0.16241 0.16911 0.17609 0.18218 0.18660 0.19076 0.19338 0.19455 0.20016 0.20626 0.21357 0.21635 0.21941 0.22530 0.23655 0.24296 0.24711 0.25798 0.27033 0.27974 0.28711 0.29409 0.29930 0.30303 0.31544 0.31678 0.31826 0.31900 0.32203 0.32318 0.32462 0.32660 0.32704 0.32872 0.33058 0.33220 0.33355 0.33561 0.33616 0.33835 0.33959 0.33986 0.34139 0.34425 0.34586 0.34928 0.35084 0.35181 0.35209 0.35383 0.35506 0.35528 0.35638 0.35749 0.35853 0.36968 0.37410 0.38244 0.39951 0.40961 0.41596 0.42829 0.44182 0.46251 0.46397 0.47454 0.50481 0.54321 0.61396 0.83236 1.61091</array>
                     <array cmlx:templateRef="junk"
                            dataType="xsd:string"
                            dictRef="x:junk1"
                            size="8">Angle between quadratic step and forces= 81.73 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">0.00040488 0.00000023</array>
                        <array dataType="xsd:double" dictRef="g:rmsint" size="2">0.00000017 0.00000000</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l103.deltas">
                     <list cmlx:templateRef="delta">
                        <array dataType="xsd:string" dictRef="cc:variable" size="266">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 R46 R47 R48 R49 R50 R51 R52 R53 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 A86 A87 A88 A89 A90 A91 A92 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</array>
                        <array dataType="xsd:double" dictRef="g:lastval" size="266">2.57091 2.74741 2.28915 2.57622 2.59478 2.83393 2.89210 2.86743 2.87192 2.93250 2.81299 2.05489 2.79116 2.04630 2.05513 2.06932 2.06800 2.06904 2.06591 2.06841 2.52832 2.05218 2.84286 2.84603 2.06348 2.07140 2.06757 2.06056 2.07037 2.07206 2.81874 2.05927 2.06168 2.72581 2.56728 2.56893 2.03542 2.03638 2.82541 2.86041 2.07010 2.07477 2.64565 2.64051 2.63150 2.04912 2.63514 2.05066 2.63645 2.04892 2.63100 2.04891 2.04846 2.03413 1.87199 2.09985 2.04689 2.10090 2.00485 1.97516 2.14348 2.00589 2.12896 1.94333 2.00029 2.15590 2.02622 2.08063 2.02117 1.97639 1.96526 1.91222 1.91952 1.90080 1.88318 1.88075 1.92315 1.95261 1.93311 1.88291 1.88409 1.88577 2.18613 2.03336 2.06367 2.14521 1.91992 2.21774 2.11864 2.15568 2.00822 1.95486 1.94034 1.92996 1.89161 1.88864 1.85480 1.97181 1.92115 1.92992 1.88087 1.89241 1.86383 1.95320 1.82344 1.89700 1.93271 1.94219 1.91128 2.23362 2.20059 1.84898 1.86008 2.20122 2.22186 1.92850 2.03062 2.32403 1.91519 1.99876 2.36924 2.01340 1.89496 1.88377 1.91278 1.90795 1.84325 2.11254 2.10099 2.06869 2.10686 2.08506 2.09126 2.11029 2.08516 2.08773 2.09855 2.08930 2.09534 2.09587 2.09040 2.09687 2.08605 2.09801 2.09911 -0.03615 3.07969 -1.50588 2.68525 0.64609 -0.00878 3.13991 0.00695 -3.13319 -0.00751 -2.58684 2.51470 -0.06463 -0.07367 2.51593 -2.53005 0.05954 -0.64597 1.47218 -2.74680 0.62442 2.74257 -1.47641 3.09150 -1.07354 0.99067 -1.52374 0.57088 2.67594 -2.73615 -0.64152 1.46353 1.04130 3.13593 -1.04220 -0.02119 -2.47471 2.43013 -0.02339 2.69402 -0.44021 1.42274 -1.71148 -1.00822 2.14075 2.62461 -0.54407 -2.44890 0.66561 0.02114 3.13564 -3.13499 -0.03385 -0.00088 3.10026 -0.05892 -2.17806 2.04913 3.11990 1.00076 -1.05523 0.01410 -2.08931 2.13867 3.11757 1.01416 -1.04105 1.24015 -1.90384 -3.01624 0.12295 -0.88608 2.25311 3.13691 -0.01082 -0.00266 3.13279 -3.13255 0.00032 0.00708 3.13995 -0.00264 3.13706 -3.13799 0.00170 -3.08078 1.04833 -0.94175 0.06278 -2.09130 2.20180 0.98362 -2.20574 3.12826 -0.06111 -1.14246 1.95136 3.09511 -0.04933 0.00043 3.13918 -3.08662 0.05335 0.00838 -3.13484 -0.00773 3.13487 3.13672 -0.00387 -0.00991 -3.14054 3.13330 0.00268 0.00623 3.14131 -3.13637 -0.00129 0.00250 -3.13258 3.13308 -0.00199</array>
                        <array dataType="xsd:double" dictRef="cc:deriv" size="266">-0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -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 0.00000 -0.00000 0.00001 0.00001 0.00000 -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 0.00000 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 -0.00000 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 -0.00001 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00001 0.00001 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 0.00001 -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 -0.00001 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</array>
                        <array dataType="xsd:double" dictRef="cc:delta.linear" size="266">0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 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="266">-0.00001 0.00000 0.00001 0.00001 0.00002 0.00001 -0.00002 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 0.00001 0.00001 -0.00000 -0.00001 0.00000 -0.00000 0.00001 -0.00002 0.00000 -0.00000 -0.00000 -0.00002 -0.00000 0.00001 0.00000 -0.00000 0.00000 0.00001 0.00000 -0.00000 -0.00002 0.00003 0.00002 -0.00000 -0.00002 -0.00000 -0.00002 0.00000 0.00002 0.00000 0.00000 0.00001 -0.00000 0.00002 -0.00002 0.00001 -0.00002 -0.00000 -0.00001 0.00002 -0.00003 0.00004 -0.00000 0.00004 0.00002 -0.00004 0.00000 -0.00002 0.00000 0.00000 -0.00002 0.00002 -0.00001 0.00000 -0.00000 -0.00001 -0.00001 0.00001 0.00001 0.00001 0.00001 0.00000 -0.00001 -0.00001 0.00001 0.00000 -0.00001 0.00001 0.00000 -0.00001 0.00001 -0.00000 0.00001 0.00000 -0.00001 0.00001 -0.00004 0.00002 -0.00002 0.00003 0.00000 -0.00004 0.00002 -0.00001 0.00002 0.00001 0.00001 -0.00001 0.00000 0.00000 0.00001 0.00001 -0.00002 -0.00000 -0.00000 0.00000 -0.00001 -0.00001 0.00002 0.00003 -0.00001 -0.00001 -0.00001 0.00001 -0.00001 0.00004 -0.00003 -0.00001 0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00001 0.00000 -0.00001 0.00001 -0.00000 0.00001 -0.00001 -0.00000 0.00000 -0.00000 0.00000 0.00005 -0.00009 -0.00010 -0.00012 0.00004 0.00018 -0.00003 0.00017 0.00004 0.00004 0.00004 0.00004 -0.00010 -0.00002 -0.00008 -0.00001 -0.00000 0.00003 0.00003 0.00002 0.00005 0.00005 0.00000 0.00003 0.00003 -0.00006 -0.00006 -0.00007 -0.00006 -0.00006 -0.00006 -0.00005 -0.00005 -0.00005 -0.00008 0.00001 -0.00007 0.00002 0.00031 0.00032 0.00035 0.00035 0.00032 0.00033 0.00013 0.00018 0.00013 0.00018 0.00005 0.00010 0.00005 -0.00008 0.00004 -0.00009 0.00002 0.00001 0.00001 0.00013 0.00012 0.00013 0.00137 0.00142 0.00143 0.00125 0.00130 0.00131 -0.00014 0.00000 -0.00014 0.00001 -0.00010 0.00004 0.00014 0.00020 0.00002 0.00008 -0.00016 -0.00032 -0.00004 -0.00020 0.00001 -0.00025 -0.00006 -0.00032 0.00040 0.00041 0.00043 0.00068 0.00068 0.00070 -0.00050 -0.00052 -0.00051 -0.00052 -0.00052 -0.00053 0.00000 -0.00002 0.00001 -0.00000 -0.00001 0.00002 -0.00001 0.00001 -0.00000 -0.00001 0.00002 0.00000 0.00001 0.00001 -0.00002 -0.00002 -0.00001 -0.00000 0.00000 0.00001 0.00001 0.00000 0.00000 -0.00000</array>
                        <array dataType="xsd:double" dictRef="cc:delta.total" size="266">-0.00001 0.00000 0.00001 0.00001 0.00002 0.00001 -0.00002 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 0.00001 0.00001 -0.00000 -0.00001 0.00000 -0.00000 0.00001 -0.00002 0.00000 -0.00000 -0.00000 -0.00002 -0.00000 0.00001 0.00000 -0.00000 0.00000 0.00001 0.00000 -0.00000 -0.00002 0.00003 0.00002 -0.00000 -0.00002 -0.00000 -0.00002 0.00000 0.00002 0.00000 0.00000 0.00001 -0.00000 0.00002 -0.00002 0.00001 -0.00002 -0.00000 -0.00001 0.00002 -0.00003 0.00004 -0.00000 0.00004 0.00002 -0.00004 0.00000 -0.00002 0.00000 0.00000 -0.00002 0.00002 -0.00001 0.00000 -0.00000 -0.00001 -0.00001 0.00001 0.00001 0.00001 0.00001 0.00000 -0.00001 -0.00001 0.00001 0.00000 -0.00001 0.00001 0.00000 -0.00001 0.00001 -0.00000 0.00001 0.00000 -0.00001 0.00001 -0.00004 0.00002 -0.00002 0.00003 0.00000 -0.00004 0.00002 -0.00001 0.00002 0.00001 0.00001 -0.00001 0.00000 0.00000 0.00001 0.00001 -0.00002 -0.00000 -0.00000 0.00000 -0.00001 -0.00001 0.00002 0.00003 -0.00001 -0.00001 -0.00001 0.00001 -0.00001 0.00004 -0.00003 -0.00001 0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00001 0.00000 -0.00001 0.00001 -0.00000 0.00001 -0.00001 -0.00000 0.00000 -0.00000 0.00000 0.00005 -0.00009 -0.00010 -0.00012 0.00004 0.00018 -0.00003 0.00017 0.00004 0.00004 0.00004 0.00004 -0.00010 -0.00002 -0.00008 -0.00001 -0.00000 0.00003 0.00003 0.00002 0.00005 0.00005 0.00000 0.00003 0.00003 -0.00006 -0.00006 -0.00007 -0.00006 -0.00006 -0.00006 -0.00005 -0.00005 -0.00005 -0.00008 0.00001 -0.00007 0.00002 0.00031 0.00032 0.00035 0.00035 0.00032 0.00033 0.00013 0.00018 0.00013 0.00018 0.00005 0.00010 0.00005 -0.00008 0.00004 -0.00009 0.00002 0.00001 0.00001 0.00013 0.00012 0.00013 0.00137 0.00142 0.00143 0.00125 0.00130 0.00131 -0.00014 0.00000 -0.00014 0.00001 -0.00010 0.00004 0.00014 0.00020 0.00002 0.00008 -0.00016 -0.00032 -0.00004 -0.00020 0.00001 -0.00025 -0.00006 -0.00032 0.00040 0.00041 0.00043 0.00068 0.00068 0.00070 -0.00050 -0.00052 -0.00051 -0.00052 -0.00052 -0.00053 0.00000 -0.00002 0.00001 -0.00000 -0.00001 0.00002 -0.00001 0.00001 -0.00000 -0.00001 0.00002 0.00000 0.00001 0.00001 -0.00002 -0.00002 -0.00001 -0.00000 0.00000 0.00001 0.00001 0.00000 0.00000 -0.00000</array>
                        <array dataType="xsd:double" dictRef="cc:newval" size="266">2.57090 2.74742 2.28916 2.57623 2.59480 2.83394 2.89208 2.86744 2.87192 2.93251 2.81300 2.05489 2.79116 2.04630 2.05513 2.06931 2.06800 2.06904 2.06590 2.06841 2.52832 2.05218 2.84286 2.84604 2.06347 2.07139 2.06758 2.06056 2.07038 2.07204 2.81874 2.05927 2.06168 2.72580 2.56727 2.56894 2.03542 2.03638 2.82541 2.86042 2.07010 2.07477 2.64563 2.64054 2.63152 2.04912 2.63513 2.05066 2.63643 2.04892 2.63102 2.04891 2.04846 2.03414 1.87199 2.09987 2.04687 2.10091 2.00483 1.97516 2.14347 2.00591 2.12894 1.94337 2.00029 2.15594 2.02624 2.08058 2.02117 1.97637 1.96527 1.91223 1.91950 1.90082 1.88317 1.88076 1.92315 1.95260 1.93310 1.88292 1.88409 1.88577 2.18614 2.03336 2.06366 2.14519 1.91992 2.21774 2.11862 2.15569 2.00822 1.95485 1.94034 1.92995 1.89162 1.88864 1.85479 1.97182 1.92111 1.92994 1.88085 1.89244 1.86383 1.95315 1.82346 1.89699 1.93273 1.94220 1.91129 2.23361 2.20059 1.84898 1.86009 2.20123 2.22184 1.92850 2.03062 2.32403 1.91518 1.99875 2.36926 2.01342 1.89495 1.88376 1.91277 1.90796 1.84324 2.11258 2.10096 2.06869 2.10686 2.08507 2.09125 2.11030 2.08514 2.08774 2.09855 2.08929 2.09535 2.09587 2.09041 2.09686 2.08605 2.09801 2.09911 -0.03615 3.07975 -1.50597 2.68515 0.64597 -0.00874 3.14008 0.00692 -3.13302 -0.00747 -2.58680 2.51474 -0.06459 -0.07376 2.51591 -2.53013 0.05954 -0.64597 1.47220 -2.74678 0.62444 2.74262 -1.47636 3.09150 -1.07351 0.99070 -1.52381 0.57082 2.67587 -2.73622 -0.64159 1.46346 1.04125 3.13588 -1.04226 -0.02128 -2.47471 2.43006 -0.02337 2.69433 -0.43989 1.42309 -1.71113 -1.00790 2.14107 2.62474 -0.54389 -2.44877 0.66579 0.02118 3.13574 -3.13494 -0.03393 -0.00084 3.10017 -0.05890 -2.17806 2.04914 3.12004 1.00088 -1.05511 0.01548 -2.08790 2.14010 3.11883 1.01546 -1.03974 1.24001 -1.90384 -3.01638 0.12296 -0.88618 2.25315 3.13705 -0.01062 -0.00264 3.13287 -3.13270 0.00001 0.00704 3.13975 -0.00263 3.13680 -3.13805 0.00138 -3.08038 1.04874 -0.94133 0.06345 -2.09062 2.20250 0.98312 -2.20626 3.12775 -0.06163 -1.14298 1.95083 3.09511 -0.04934 0.00044 3.13917 -3.08663 0.05337 0.00836 -3.13483 -0.00773 3.13485 3.13673 -0.00387 -0.00991 -3.14053 3.13328 0.00266 0.00622 3.14130 -3.13636 -0.00128 0.00250 -3.13258 3.13308 -0.00199</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">0.000015 0.000003 0.002229 0.000405</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">-1.238332e-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">6-311+G(d,p)</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:diffuse">(5D, 7F)</scalar>
                     <module cmlx:templateRef="ernie">
                        <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                        <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                        <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                     </module>
                     <list cmlx:templateRef="symmadaptcart">
                        <array dataType="xsd:integer" dictRef="cc:adapted" size="1">731</array>
                        <array dataType="xsd:string" dictRef="cc:symm" size="1">A</array>
                     </list>
                     <list cmlx:templateRef="symmadapt">
                        <array dataType="xsd:integer" dictRef="cc:adapted" size="1">706</array>
                        <array dataType="xsd:string" dictRef="cc:symm" size="1">A</array>
                     </list>
                     <scalar dataType="xsd:integer" dictRef="cc:basiscount">706</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:primbasis">1108</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:cartesianbasis">731</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:alphae">91</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:betae">91</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:nucrepener">2216.2392900239</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:natoms">51</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">51</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">51</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>
                     <scalar dataType="xsd:string" dictRef="g:misc">IExCor=  402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX=  0.200000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  0.800000  0.720000  1.000000  0.810000 ScalE2=  1.000000  1.000000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=131</scalar>
                  </module>
                  <module cmlx:templateRef="l301.dispersion">
                     <scalar dataType="xsd:string" dictRef="g:empdispersion">Grimme-D3</scalar>
                     <scalar dataType="xsd:double" dictRef="g:dispenergy" units="nonsi:hartree">-0.0582576528</scalar>
                  </module>
               </module>
               <module cmlx:templateRef="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.stoich">
                     <scalar cmlx:templateRef="stoich"
                             dataType="xsd:string"
                             dictRef="g:stoichiometry">C22H26O3</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:pointgroup">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestconciseabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.3082482 0.1551150 0.1183910</array>
                  </module>
               </module>
               <module cmlx:templateRef="l302">
                  <module cmlx:templateRef="l302.basis">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="11">NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="5">One-electron integrals computed using PRISM.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="6">One-electron integral symmetry used in STVInt</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NBasis= 706 RedAO= T EigKep= 1.11D-06 NBF= 706</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="7">NBsUse= 705 1.00D-06 EigRej= 9.72D-07 NBFU= 705</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l302.basis2">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="5">Precomputing XC quadrature grid using</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">NSgBfM= 726 726 726 726 726 MxSgAt= 51 MxSgA2= 51.</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l303.basis">
                  <list cmlx:templateRef="l303">
                     <scalar dataType="xsd:integer" dictRef="g:dipdrv">1</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l502">
                  <scalar dataType="xsd:string" dictRef="g:l502.type">Closed</scalar>
                  <module cmlx:templateRef="l502.cycle">
                     <list cmlx:templateRef="cycle">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="cc:cycle">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:pass">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:idiag">1</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="l502.e">
                        <list cmlx:templateRef="l502.e">
                           <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553054851</scalar>
                        </list>
                     </module>
                  </module>
                  <module cmlx:templateRef="l502.footer">
                     <list cmlx:templateRef="scfdone">
                        <list>
                           <scalar dataType="xsd:double" dictRef="g:rbhflyp" units="nonsi:hartree">-1079.97553055</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:ncycle">1</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="scfdone">
                        <list cmlx:templateRef="scfdone">
                           <list>
                              <scalar dataType="xsd:double" dictRef="cc:kinener">1.075265706032e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:potener">-6.946104994408e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:eener">2.574682725457e+03</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <list cmlx:templateRef="l502">
                     <scalar dataType="xsd:string" dictRef="g:l502">Using DIIS extrapolation, IDIIS=  1040.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NGot=  1415577600 LenX=  1414494764 LenY=  1413959672</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on RMS density matrix=1.00D-08 within 128 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on MAX density matrix=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on             energy=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">No special actions if energy rises.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Fock matrices will be formed incrementally for  20 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502"/>
                  </list>
               </module>
               <module cmlx:templateRef="l1101">
                  <list cmlx:templateRef="l1101">
                     <scalar dataType="xsd:string" dictRef="g:l1101">Using compressed storage, NAtomX=    51.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l1101">Will process     52 centers per pass.</scalar>
                  </list>
               </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="4">Minotr: Closed shell wavefunction.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="1">IDoAtm=11111111111111111111111111111111111111111111111111</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="1">IDoAtm=1</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="3">Direct CPHF calculation.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="7">Differentiating once with respect to electric field.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="5">with respect to dipole field.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="7">Differentiating once with respect to nuclear coordinates.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="8">Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="8">Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="7">NewPWx=T KeepS1=F KeepF1=F KeepIn=T MapXYZ=F SortEE=F KeepMc=T.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="8">15794 words used for storage of precomputed grid.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="5">Two-electron integrals replicated using symmetry.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="5">MDV= 1415577600 using IRadAn= 1.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="6">Solving linear equations simultaneously, MaxMat= 384.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="8">FoF2E skips out because all densities are zero.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="7">CalDSu exits because no D1Ps are significant.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="11">FoFJK: IHMeth= 1 ICntrl= 0 DoSepK=F KAlg= 0 I1Cent= 0 FoldK=F</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">IRaf= 780000000 NMat= 153 IRICut= 382 DoRegI=T DoRafI=T ISym2E= 2 IDoP0=3 IntGTp=3.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="8">FoFCou: FMM=F IPFlag= 0 FMFlag= 100000 FMFlg1= 0</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="6">NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="10">wScrn= 0.000000 ICntrl= 0 IOpCl= 0 I1Cent= 0 NGrid= 0</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">NMat0= 153 NMatS0= 153 NMatT0= 0 NMatD0= 153 NMtDS0= 0 NMtDT0= 0</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="6">Integrals replicated using symmetry in FoFCou.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="11">Raff kept on since 76.46% of shell-pairs survive, threshold= 0.20 IRatSp=76.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="14">There are 156 degrees of freedom in the 1st order CPHF. IDoFFX=6 NUNeed= 3.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">153 vectors produced by pass 0 Test12= 5.59D-14 1.00D-09 XBig12= 2.64D+02 5.64D+00.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="10">AX will form 153 AO Fock derivatives at one time.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">153 vectors produced by pass 1 Test12= 5.59D-14 1.00D-09 XBig12= 5.21D+01 1.36D+00.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">153 vectors produced by pass 2 Test12= 5.59D-14 1.00D-09 XBig12= 5.09D-01 5.83D-02.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">153 vectors produced by pass 3 Test12= 5.59D-14 1.00D-09 XBig12= 1.71D-03 3.49D-03.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">153 vectors produced by pass 4 Test12= 5.59D-14 1.00D-09 XBig12= 3.94D-06 1.63D-04.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">131 vectors produced by pass 5 Test12= 5.59D-14 1.00D-09 XBig12= 5.85D-09 5.45D-06.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">34 vectors produced by pass 6 Test12= 5.59D-14 1.00D-09 XBig12= 6.98D-12 2.11D-07.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="12">3 vectors produced by pass 7 Test12= 5.59D-14 1.00D-09 XBig12= 8.04D-15 6.82D-09.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="6">InvSVY: IOpt=1 It= 1 EMax= 2.66D-14</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="9">Solved reduced A of dimension 933 with 156 vectors.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="6">FullF1: Do perturbations 1 to 3.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="7">Isotropic polarizability for W= 0.000000 260.09 Bohr**3.</array>
                     <array dataType="xsd:string" dictRef="g:l1002.minotr" size="10">End of Minotr F.D. properties file 721 does not exist.</array>
                  </list>
               </module>
               <module cmlx:templateRef="l601.polariz">
                  <array dataType="xsd:double" dictRef="g:l601.pol.exact" size="6">285.924 10.821 275.866 14.473 -8.148 218.487</array>
                  <array dataType="xsd:double" dictRef="g:l601.pol.approx" size="6">374.584 14.378 416.945 31.211 -20.163 377.326</array>
               </module>
               <module cmlx:templateRef="l716">
                  <list cmlx:templateRef="l716">
                     <scalar dataType="xsd:string" dictRef="g:l716">(Enter /usr/local/gaussian/gaussian16/g16/l716.exe)</scalar>
                  </list>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:jobtime">
                  <scalar dataType="xsd:string">PT163076.300S</scalar>
               </property>
               <property dictRef="cc:jobdatetime.end">
                  <scalar dataType="xsd:date">2024-10-10T02:55:47.000</scalar>
               </property>
               <property dictRef="cc:popanal">
                  <module cmlx:templateRef="l601.popanal">
                     <array dataType="xsd:double" dictRef="g:alphaocc" size="91">-19.18979 -19.16124 -19.10365 -10.29666 -10.23436 -10.23152 -10.22377 -10.19779 -10.19408 -10.19374 -10.18736 -10.18679 -10.18153 -10.18138 -10.18097 -10.18074 -10.17982 -10.17955 -10.17061 -10.16775 -10.16643 -10.15620 -10.15589 -10.15514 -10.15187 -1.11491 -1.10027 -1.01518 -0.88334 -0.87016 -0.82025 -0.80760 -0.80344 -0.75731 -0.75400 -0.74529 -0.72803 -0.69683 -0.69202 -0.68629 -0.68338 -0.64005 -0.61648 -0.60296 -0.58840 -0.57220 -0.55683 -0.54070 -0.52832 -0.52466 -0.51435 -0.49491 -0.48091 -0.47811 -0.47144 -0.46639 -0.45923 -0.45461 -0.45277 -0.44219 -0.44037 -0.43104 -0.42975 -0.42923 -0.41836 -0.41645 -0.41153 -0.40542 -0.39943 -0.39312 -0.38730 -0.38276 -0.38085 -0.37487 -0.36938 -0.36583 -0.35871 -0.35470 -0.35357 -0.35133 -0.35043 -0.32915 -0.30941 -0.29711 -0.28638 -0.28112 -0.27423 -0.26341 -0.25853 -0.23237 -0.22562</array>
                     <array dataType="xsd:double" dictRef="g:alphavirt" size="614">-0.02411 -0.02077 -0.01072 -0.00482 -0.00303 0.00336 0.01154 0.01269 0.01805 0.02183 0.02423 0.02974 0.03011 0.03651 0.03723 0.04193 0.04309 0.04567 0.04666 0.05001 0.05295 0.05721 0.06063 0.06549 0.06975 0.07015 0.07520 0.07817 0.08054 0.08309 0.08585 0.08885 0.09743 0.10021 0.10120 0.10644 0.10844 0.11227 0.11357 0.11512 0.12080 0.12292 0.12353 0.12700 0.13006 0.13321 0.13798 0.14129 0.14240 0.14485 0.14600 0.14886 0.15125 0.15323 0.15842 0.16053 0.16357 0.16556 0.16821 0.17099 0.17212 0.17453 0.17733 0.17952 0.18106 0.18276 0.18507 0.18935 0.19263 0.19341 0.19709 0.19768 0.19881 0.20064 0.20298 0.20541 0.20755 0.20812 0.21089 0.21101 0.21453 0.21853 0.22008 0.22509 0.22600 0.22822 0.22934 0.23066 0.23211 0.23707 0.23910 0.24217 0.24442 0.24477 0.24635 0.24872 0.25142 0.25205 0.25517 0.26004 0.26361 0.26456 0.26758 0.27033 0.27137 0.27749 0.27906 0.28143 0.28266 0.28665 0.28883 0.29047 0.29421 0.29780 0.30000 0.30225 0.30768 0.31085 0.31289 0.31802 0.31949 0.32030 0.32163 0.32345 0.32839 0.32990 0.33579 0.33708 0.33989 0.34297 0.35082 0.35096 0.35437 0.35698 0.36173 0.36864 0.37225 0.37552 0.38115 0.38307 0.38955 0.39760 0.39888 0.40507 0.41110 0.41532 0.41903 0.42694 0.43392 0.43708 0.44685 0.45190 0.45575 0.45977 0.46495 0.46906 0.47074 0.48651 0.49451 0.49759 0.50794 0.51700 0.52381 0.52527 0.53132 0.53689 0.54536 0.54788 0.55514 0.56615 0.56957 0.57055 0.57809 0.58230 0.58433 0.58814 0.59683 0.60079 0.60224 0.60780 0.61203 0.61779 0.62306 0.62869 0.63117 0.63525 0.63738 0.64094 0.64686 0.64802 0.65418 0.65687 0.65935 0.66588 0.66891 0.67294 0.67701 0.67994 0.68169 0.68629 0.68893 0.69447 0.69637 0.69715 0.70379 0.70562 0.70730 0.70881 0.71346 0.71890 0.72267 0.72420 0.72754 0.73185 0.73683 0.74027 0.74325 0.74967 0.75350 0.76118 0.76499 0.76691 0.77161 0.77736 0.78409 0.78571 0.79080 0.79589 0.79813 0.80109 0.80414 0.81290 0.81610 0.82406 0.83282 0.83667 0.84455 0.84995 0.85240 0.85718 0.85982 0.87226 0.87595 0.88690 0.89535 0.91226 0.91339 0.91810 0.92673 0.93218 0.93742 0.94378 0.95319 0.96260 0.96969 0.97277 0.98400 0.99682 1.00047 1.00805 1.01580 1.02726 1.02824 1.03947 1.04669 1.05589 1.06167 1.07057 1.08344 1.08669 1.10046 1.11101 1.11426 1.11525 1.12028 1.13530 1.13717 1.14909 1.16045 1.16765 1.18074 1.19253 1.20470 1.20561 1.21230 1.22183 1.22947 1.24427 1.25708 1.27293 1.28893 1.29377 1.30913 1.31253 1.32029 1.32905 1.33195 1.34794 1.36018 1.36773 1.38075 1.40202 1.40417 1.41065 1.41876 1.42374 1.43764 1.45003 1.45264 1.46052 1.46612 1.47149 1.47712 1.48504 1.49406 1.50414 1.50505 1.51154 1.51436 1.51981 1.52271 1.53476 1.54155 1.54493 1.55561 1.56460 1.57145 1.57623 1.58000 1.58210 1.60478 1.60991 1.61134 1.61943 1.62449 1.62916 1.63713 1.64434 1.64717 1.65307 1.65437 1.65989 1.66191 1.66879 1.66992 1.67669 1.68461 1.68759 1.70098 1.70493 1.70987 1.71666 1.72386 1.72707 1.72930 1.73806 1.75018 1.75882 1.76828 1.77313 1.77631 1.78081 1.78313 1.79239 1.79657 1.80878 1.81266 1.82338 1.83067 1.83269 1.83388 1.84392 1.84810 1.86122 1.86783 1.87280 1.88087 1.88996 1.89629 1.90313 1.91096 1.91659 1.91874 1.92815 1.93513 1.94716 1.94865 1.95806 1.96493 1.97130 1.99026 1.99392 1.99613 1.99895 2.00641 2.01221 2.01737 2.02506 2.03590 2.05229 2.06345 2.07260 2.07572 2.08299 2.09112 2.09588 2.10543 2.11439 2.13341 2.13742 2.15257 2.15939 2.16765 2.18011 2.19179 2.20177 2.21522 2.22104 2.22905 2.23442 2.24836 2.25458 2.26276 2.29615 2.30527 2.32280 2.34504 2.35503 2.36154 2.38515 2.38982 2.40281 2.40351 2.41397 2.43260 2.44025 2.44550 2.45380 2.45680 2.47069 2.48131 2.48874 2.50938 2.52190 2.52414 2.52619 2.53088 2.53214 2.53817 2.54751 2.54941 2.55854 2.56655 2.57334 2.59020 2.59803 2.61042 2.62639 2.63396 2.64167 2.64728 2.65268 2.65859 2.67758 2.68018 2.70749 2.70816 2.71694 2.72529 2.73125 2.73801 2.74153 2.74867 2.75427 2.76166 2.76772 2.77048 2.77220 2.77794 2.79043 2.79333 2.80498 2.80966 2.82532 2.83824 2.84339 2.84499 2.85487 2.86422 2.86631 2.87205 2.88226 2.88962 2.90348 2.90761 2.91207 2.92247 2.93147 2.94029 2.94419 2.95628 2.95851 2.96105 2.96589 2.98481 3.00491 3.02108 3.02807 3.03561 3.04557 3.06239 3.06982 3.08577 3.09967 3.10945 3.11819 3.12649 3.14412 3.16298 3.16958 3.17818 3.18318 3.18940 3.20079 3.20738 3.22162 3.23774 3.24762 3.25701 3.26873 3.33491 3.36817 3.37192 3.38142 3.40301 3.41200 3.43949 3.48327 3.52264 3.55024 3.56687 3.59831 3.61782 3.62199 3.63099 3.64003 3.70356 3.70773 3.72628 3.74033 3.78895 3.79276 3.81466 3.83616 3.84219 3.85774 3.85975 3.86168 3.87474 3.88901 3.95688 3.98709 4.02686 4.03491 4.04678 4.08390 4.13252 4.14841 4.15277 4.15696 4.21061 4.27967 4.31141 4.34623 4.35614 4.36098 4.49016 4.57103 4.61925 4.84487 5.01195 5.11859 5.18912 5.32067 5.41026 5.45337 5.65711 5.82665 5.92183 23.64868 23.70963 23.72891 23.82265 23.83220 23.85461 23.87042 23.90729 23.91961 23.95655 23.96597 23.97594 23.99740 24.00664 24.00990 24.02007 24.08462 24.09577 24.17171 24.19289 24.20730 24.29041 49.91280 49.93752 50.05747</array>
                     <module cmlx:templateRef="l601.state">
                        <scalar dataType="xsd:string" dictRef="g:l601.state">1-A.</scalar>
                     </module>
                     <module cmlx:templateRef="mulliken">
                        <module cmlx:templateRef="l601.mullik">
                           <scalar dataType="xsd:string" dictRef="g:title">Mulliken charges:</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:serial">1</scalar>
                           <list cmlx:templateRef="row">
                              <array dataType="xsd:integer" dictRef="cc:serial" size="51">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</array>
                              <array dataType="xsd:string" dictRef="cc:elementType" size="51">O O O C C C C C C C C C C C C C 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 H H H H H H H H H</array>
                              <array dataType="xsd:double" dictRef="x:charge" size="51">0.087941 -0.172179 -0.005157 0.065096 0.135753 -0.012674 -0.630226 -0.214020 -0.061516 -0.594534 0.467799 -0.670412 -0.876958 -0.347598 0.267637 0.748538 -0.128692 -0.889096 -0.640470 1.155475 -0.610099 -0.232677 -0.246153 -0.300402 -0.098888 0.162237 0.162076 0.166901 0.139417 0.139209 0.149992 0.132074 0.148632 0.111687 0.132534 0.146695 0.165808 0.144641 0.171730 0.146599 0.153542 0.180557 0.155301 0.124436 0.163933 0.195056 0.132093 0.110715 0.125365 0.120766 0.121519</array>
                           </list>
                           <scalar dataType="xsd:double" dictRef="x:chargesum">-0.00000</scalar>
                        </module>
                     </module>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l601.mullik">
                     <scalar dataType="xsd:string" dictRef="g:title">Mulliken charges with hydrogens summed into heavy atoms:</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:serial">1</scalar>
                     <list cmlx:templateRef="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="25">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</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="25">O O O C C C C C C C C C C C C C C C C C C C C C C</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="25">0.087941 -0.172179 -0.005157 0.065096 0.297990 0.149402 -0.184700 0.216677 0.050171 -0.594534 0.467799 -0.225375 -0.413988 -0.013499 0.267637 0.903839 -0.004256 -0.889096 -0.281481 1.155475 -0.478006 -0.121963 -0.120788 -0.179636 0.022631</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">0.00000</scalar>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l716.dipole">
                     <array cmlx:templateRef="dipole"
                            dataType="xsd:double"
                            dictRef="x:d"
                            size="3">3.41593781e-03 -1.70634932e-02 -3.29225169e-01</array>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l716.polarizability">
                     <array cmlx:templateRef="polariz"
                            dataType="xsd:double"
                            dictRef="cc:polarizability"
                            size="6">2.85924457e+02 1.08206080e+01 2.75866348e+02 1.44728619e+01 -8.14807444e+00 2.18486911e+02</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">-2.5888 0.0004 0.0006 0.0007 1.9459 3.5816 16.4396 28.1062 39.3998</array>
                     </module>
                     <module cmlx:templateRef="l716.freq.chunkx"
                             dictRef="cc:vibrations"
                             id="default">
                        <array dataType="xsd:integer" dictRef="x:serial" size="147">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147</array>
                        <array dataType="xsd:string"
                               delimiter="|"
                               dictRef="cc:irrep"
                               size="147">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|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="147">16.3467 28.0929 39.3947 42.9038 56.3493 66.1027 74.3356 78.9708 86.7949 122.6617 127.5899 147.9742 156.5748 167.0821 189.5346 204.0358 219.0808 225.5876 243.0459 251.3988 272.1280 280.5763 306.0596 320.7040 324.8713 360.9620 381.4797 388.6621 412.9505 413.8176 428.4479 468.2114 472.7087 495.7395 522.9950 579.2273 601.0118 619.9662 635.0854 636.6270 666.2305 695.0534 711.6774 740.7837 745.6568 778.3743 791.2987 805.3181 835.2383 837.1687 838.0080 856.9666 858.6939 865.7813 868.3423 920.8122 922.6975 952.9175 966.5755 967.6410 968.8361 981.4020 988.7963 993.6018 1000.5411 1006.5873 1011.4079 1018.0699 1018.4134 1031.2531 1052.3846 1067.4998 1085.7936 1103.0761 1105.4159 1107.7121 1136.9742 1148.7699 1151.8540 1162.8170 1186.4323 1190.7176 1191.2395 1211.8412 1213.4475 1217.0538 1224.6379 1244.2156 1271.1316 1295.6640 1331.5455 1332.5619 1354.5131 1360.2423 1378.2740 1387.6084 1404.5691 1413.3796 1415.7185 1416.8128 1422.9430 1428.0842 1446.8598 1472.1366 1476.1675 1483.8540 1485.7159 1486.7800 1488.0669 1492.7622 1494.4905 1495.3045 1512.4464 1519.0978 1528.4992 1581.8350 1623.1825 1645.2609 1647.5713 1721.5034 1762.6953 3001.3333 3007.5036 3012.4150 3013.6830 3020.8873 3037.3201 3053.5654 3068.2668 3069.2574 3069.6439 3074.3323 3085.2059 3100.3928 3104.1713 3112.6150 3121.7031 3140.6459 3147.2967 3154.7030 3161.6571 3167.6260 3170.8904 3179.0343 3189.2763 3261.1467 3263.5131</array>
                        <array dataType="xsd:double" dictRef="cc:redmass" size="147">3.8520 4.2380 4.0434 4.6157 4.8830 4.0423 3.6551 4.6280 3.0356 2.1739 1.7446 2.5393 3.5462 3.0568 2.5130 1.2760 1.2994 2.7659 3.1540 4.0192 2.5788 1.5640 3.1998 2.8583 5.4828 2.9467 2.8990 2.8944 3.1192 2.8739 2.6636 2.3471 3.1333 3.2196 3.1835 3.5696 4.4944 3.6551 5.9860 4.3116 3.7462 3.5718 1.7754 3.0654 2.0636 1.8662 3.0276 3.7408 2.8400 2.9571 3.9102 1.7286 1.7471 2.2184 1.4252 1.4525 3.9706 2.3501 2.3964 1.4348 1.7147 1.4028 1.3836 2.3638 2.8721 1.2972 1.2653 6.0462 1.6259 2.3225 2.2269 1.8523 1.5613 1.6838 1.6426 1.6055 2.5130 2.1653 1.9189 3.2518 2.5574 1.2329 1.6426 1.1427 2.1473 1.3682 1.9030 2.0124 1.6101 1.3488 3.5492 1.8504 1.6979 1.5633 1.6529 1.3952 1.5349 1.3008 1.3868 2.7383 1.2599 1.3189 2.0052 1.0473 1.2534 1.1729 1.4593 1.1037 1.0511 1.0581 1.0863 1.0654 1.1445 1.0599 2.2332 6.2691 5.4579 5.7007 6.1950 6.6336 10.7761 1.0656 1.0410 1.0354 1.0413 1.0408 1.0945 1.0968 1.0921 1.0588 1.1009 1.1012 1.1017 1.1020 1.0882 1.0964 1.1082 1.0897 1.0939 1.0867 1.0870 1.0889 1.0908 1.0943 1.0983 1.0984 1.0986</array>
                        <array dataType="xsd:double" dictRef="cc:forceconst" size="147">0.0006 0.0020 0.0037 0.0050 0.0091 0.0104 0.0119 0.0170 0.0135 0.0193 0.0167 0.0328 0.0512 0.0503 0.0532 0.0313 0.0367 0.0829 0.1098 0.1497 0.1125 0.0725 0.1766 0.1732 0.3409 0.2262 0.2486 0.2576 0.3134 0.2900 0.2881 0.3032 0.4125 0.4662 0.5130 0.7056 0.9565 0.8277 1.4225 1.0296 0.9797 1.0167 0.5298 0.9911 0.6760 0.6662 1.1169 1.4294 1.1673 1.2211 1.6179 0.7480 0.7590 0.9797 0.6331 0.7256 1.9917 1.2573 1.3191 0.7915 0.9483 0.7961 0.7970 1.3750 1.6940 0.7744 0.7626 3.6922 0.9936 1.4552 1.4531 1.2436 1.0845 1.2071 1.1826 1.1607 1.9140 1.6836 1.5000 2.5906 2.1210 1.0299 1.3734 0.9887 1.8629 1.1941 1.6815 1.8355 1.5328 1.3341 3.7076 1.9359 1.8354 1.7043 1.8500 1.5828 1.7841 1.5310 1.6376 3.2386 1.5030 1.5848 2.4732 1.3373 1.6092 1.5215 1.8979 1.4374 1.3713 1.3892 1.4295 1.4035 1.5425 1.4410 3.0740 9.2422 8.4725 9.0917 9.9079 11.5828 19.7273 5.6555 5.5478 5.5359 5.5723 5.5964 5.9490 6.0256 6.0575 5.8765 6.1117 6.1321 6.1785 6.2410 6.1778 6.2584 6.3627 6.3326 6.3840 6.3719 6.4021 6.4372 6.4617 6.5160 6.5817 6.8826 6.8941</array>
                        <array dataType="xsd:double" dictRef="cc:irintensity" size="147">0.1379 0.0680 0.4200 0.7391 0.0689 0.1184 0.2024 0.2492 1.5037 0.2648 0.7892 0.2321 0.3932 1.2983 1.8899 0.0835 1.2997 1.4456 3.0149 1.7430 1.1355 2.0648 1.9478 1.7264 5.4208 0.8875 2.2964 4.1434 5.7695 0.2356 1.4875 2.5033 10.1852 1.4083 0.0930 1.4651 6.7762 5.7084 1.2819 1.0444 3.7398 13.6155 49.1825 12.4150 34.4659 32.3727 4.5687 14.9759 22.1403 0.1630 1.6721 21.7498 5.6766 2.9381 16.1182 0.9668 47.3481 5.9029 26.3860 1.6133 6.6714 1.7785 0.0544 6.9875 12.5106 0.2543 1.7366 0.2575 0.4832 1.0969 3.3242 13.1796 14.2864 97.3763 48.4521 6.1956 59.4486 158.1658 1.4046 43.9884 138.4268 8.7098 33.3088 0.0050 8.4823 0.3403 0.4109 8.6983 2.3588 13.4862 0.2420 3.4075 2.1036 21.8689 6.4784 25.1987 11.6132 4.2488 12.7897 4.3665 0.7135 21.5883 86.9503 1.2513 2.8757 13.5496 7.0192 20.8487 0.8880 9.9569 14.3158 5.9251 7.9065 4.7248 13.5486 36.7073 0.9611 9.5276 1.6116 13.2023 149.1156 21.5923 16.3398 39.2732 38.3206 58.9656 10.5421 10.2084 14.6955 26.6480 6.8214 48.6543 29.4267 16.7779 9.5203 21.7374 8.5034 11.1123 8.4061 4.7173 0.2455 5.4252 10.3708 22.8423 10.9150 0.7434 3.8241</array>
                        <array dataType="xsd:double" dictRef="cc:displacement" size="22491">-0.00 0.02 0.05 0.05 -0.00 0.04 0.02 0.02 0.03 0.01 0.03 -0.08 -0.05 0.01 -0.00 -0.04 0.02 -0.03 0.10 0.05 -0.07 -0.03 0.04 -0.17 -0.01 -0.00 0.08 0.01 0.01 0.02 -0.03 -0.07 0.12 0.02 -0.08 0.20 -0.10 -0.14 0.08 0.00 -0.00 0.07 0.01 0.01 0.06 0.02 -0.00 -0.00 0.01 0.03 0.08 0.03 0.01 -0.02 0.06 -0.01 -0.09 0.03 0.00 -0.07 -0.05 0.02 -0.06 0.07 -0.01 -0.07 -0.09 0.03 -0.05 0.03 0.00 -0.06 -0.05 0.02 -0.05 -0.11 0.00 -0.02 -0.09 0.02 -0.06 0.13 0.05 -0.01 0.11 0.05 -0.09 0.14 0.06 -0.13 -0.02 0.05 -0.18 -0.11 0.03 -0.17 -0.01 0.06 -0.22 0.04 0.05 0.11 0.07 -0.03 0.22 0.01 -0.14 0.25 0.01 -0.09 0.19 -0.13 -0.12 0.02 -0.12 -0.16 0.06 -0.10 -0.21 0.12 0.00 0.00 0.10 -0.00 -0.03 0.06 0.02 -0.02 -0.03 0.00 0.04 0.12 0.12 -0.03 -0.09 0.03 -0.01 -0.15 -0.08 0.03 -0.06 0.13 -0.03 -0.08 -0.15 0.05 -0.04 0.06 -0.01 -0.06 -0.09 0.03 -0.04 -0.02 -0.03 -0.12 -0.02 0.01 -0.06 -0.05 0.06 0.05 0.01 -0.01 0.02 0.03 -0.07 0.02 -0.01 -0.05 -0.04 0.00 0.06 0.04 0.02 -0.01 0.04 0.04 -0.08 0.04 -0.02 -0.02 -0.08 0.03 -0.06 0.08 0.03 -0.05 0.10 0.01 -0.05 0.10 0.02 0.01 -0.11 -0.00 0.02 -0.04 -0.03 0.05 0.02 -0.01 0.03 -0.02 -0.06 0.07 0.08 -0.10 0.11 0.17 -0.04 0.05 0.05 -0.02 -0.05 0.03 0.01 0.11 -0.03 0.03 -0.10 -0.07 0.07 0.06 -0.14 0.08 -0.05 -0.15 0.04 -0.12 0.03 -0.01 -0.07 -0.07 -0.01 0.05 0.02 0.03 0.07 0.09 -0.02 0.10 0.02 0.04 0.00 0.09 0.03 -0.06 0.02 0.00 0.03 0.02 0.06 -0.09 0.03 0.04 -0.06 0.10 0.01 -0.05 0.11 0.05 -0.05 0.12 0.00 -0.05 0.08 0.02 -0.05 0.12 -0.02 -0.04 0.10 0.04 -0.00 -0.15 0.06 0.04 -0.10 -0.04 0.05 0.03 0.00 0.02 -0.05 -0.24 0.22 0.18 -0.06 0.07 0.34 -0.06 -0.09 0.10 0.00 0.19 -0.02 0.04 -0.18 -0.08 0.10 0.10 -0.20 0.12 -0.08 -0.23 0.02 0.04 -0.04 0.06 0.10 0.06 -0.04 0.02 0.08 -0.03 -0.02 0.02 -0.06 0.01 0.05 0.01 0.01 0.02 -0.01 0.01 0.03 -0.05 -0.09 -0.01 -0.09 0.07 0.08 0.04 0.05 0.02 -0.07 0.03 0.02 -0.09 0.07 0.04 -0.02 -0.08 -0.08 0.03 0.06 -0.06 0.02 0.03 -0.03 0.07 -0.01 -0.07 -0.04 0.05 0.06 0.03 -0.01 0.00 0.05 -0.04 -0.00 0.05 -0.05 -0.02 0.18 -0.10 -0.04 -0.11 -0.00 -0.02 0.16 -0.10 -0.06 -0.13 -0.01 -0.04 0.00 -0.06 -0.06 -0.09 -0.02 0.05 0.02 -0.02 -0.00 0.00 0.06 0.06 -0.06 -0.01 0.04 0.03 -0.01 0.00 -0.09 -0.11 -0.00 -0.06 -0.11 -0.02 -0.00 -0.12 -0.04 -0.13 0.15 0.16 -0.12 0.15 0.12 -0.04 -0.01 0.08 -0.11 0.10 -0.06 -0.00 -0.11 -0.09 -0.03 -0.05 -0.17 0.01 -0.15 -0.04 0.03 0.06 -0.10 0.05 0.10 -0.04 0.13 -0.02 -0.13 -0.10 0.07 0.12 0.05 -0.03 -0.01 0.04 -0.05 -0.00 0.31 -0.13 -0.04 -0.21 0.03 -0.00 0.27 -0.14 -0.08 -0.25 0.03 -0.03 -0.01 -0.06 -0.07 0.03 0.02 0.02 0.09 0.04 0.06 0.08 -0.11 -0.15 0.01 -0.02 -0.03 -0.02 0.04 -0.00 0.03 0.02 0.02 0.04 -0.04 -0.04 -0.01 -0.05 -0.08 -0.04 0.07 0.02 0.06 0.03 0.04 -0.05 0.13 0.06 -0.07 0.18 0.10 -0.05 0.16 0.08 0.01 0.01 -0.00 0.02 -0.03 -0.01 -0.02 0.00 0.11 0.08 -0.10 -0.17 0.01 -0.04 0.02 -0.02 -0.01 0.08 -0.02 -0.03 0.03 -0.06 -0.08 0.02 0.01 -0.01 -0.02 -0.07 -0.10 -0.03 -0.00 -0.02 -0.07 -0.04 -0.07 -0.07 -0.06 0.05 -0.01 0.03 0.02 0.02 0.06 -0.02 -0.01 0.01 -0.06 -0.07 0.08 -0.08 -0.05 -0.04 -0.06 -0.11 -0.03 -0.03 -0.07 0.03 -0.08 -0.09 -0.04 0.06 0.01 -0.07 0.16 0.08 -0.13 0.21 0.11 -0.02 0.21 0.14 -0.03 0.12 0.06 -0.01 0.19 0.11 -0.10 0.18 0.09 -0.01 0.01 -0.02 0.01 0.03 0.01 -0.07 0.05 0.24 0.13 -0.15 -0.30 -0.08 0.03 0.08 0.01 -0.01 0.15 -0.10 -0.10 0.06 0.04 0.03 -0.01 -0.11 -0.13 -0.03 0.02 -0.00 -0.10 -0.05 -0.09 -0.11 0.02 0.05 0.08 -0.14 0.00 -0.04 0.09 -0.02 -0.11 -0.10 0.01 -0.01 -0.08 0.01 -0.03 -0.11 0.01 -0.01 -0.13 -0.00 -0.01 -0.08 0.03 0.02 -0.05 -0.05 -0.04 -0.09 0.01 0.01 -0.08 -0.05 0.01 -0.02 -0.15 -0.02 -0.16 0.03 0.11 0.02 0.06 0.06 0.03 0.06 0.03 0.02 0.07 0.09 0.07 0.01 -0.08 0.06 0.02 -0.01 0.07 -0.01 -0.00 0.10 -0.01 -0.00 0.16 -0.03 -0.01 0.06 -0.00 0.00 0.18 -0.03 -0.02 0.07 -0.01 -0.00 0.13 -0.02 -0.01 -0.07 0.03 -0.03 -0.10 0.01 0.00 -0.14 -0.01 -0.04 -0.13 -0.00 -0.02 -0.15 -0.01 0.01 -0.07 0.04 0.02 -0.07 0.04 0.02 -0.10 0.04 0.04 0.00 -0.12 -0.11 0.05 -0.23 -0.11 -0.05 -0.07 -0.06 -0.01 -0.21 0.11 -0.20 0.12 0.15 -0.19 -0.04 0.19 -0.14 0.09 0.06 0.03 0.06 0.06 -0.01 0.07 0.07 -0.00 0.11 0.17 0.10 -0.02 -0.16 0.08 -0.01 -0.00 0.06 -0.03 -0.01 0.19 -0.03 -0.01 0.01 0.01 0.01 0.23 -0.04 -0.02 0.04 0.00 -0.00 0.15 -0.02 -0.01 -0.02 -0.02 -0.07 0.00 0.01 -0.02 -0.06 0.05 0.10 -0.04 -0.06 0.01 -0.03 -0.03 -0.01 -0.00 -0.03 -0.01 -0.07 -0.06 0.01 -0.03 -0.10 0.03 -0.05 0.01 -0.01 -0.01 -0.01 -0.03 -0.06 0.08 0.02 -0.08 0.14 0.06 -0.04 0.10 0.04 0.01 0.00 -0.05 -0.01 0.02 -0.01 0.02 -0.01 -0.06 -0.06 0.05 0.09 -0.01 0.01 -0.00 0.03 -0.04 -0.06 0.06 -0.03 -0.03 -0.05 0.03 -0.02 0.20 -0.08 -0.02 -0.01 0.03 0.01 0.23 -0.07 0.00 0.13 -0.02 0.02 -0.02 -0.04 -0.01 0.03 -0.05 -0.01 -0.08 -0.03 -0.01 -0.11 -0.07 0.01 -0.07 -0.08 0.02 -0.06 -0.11 0.04 0.00 -0.09 0.03 -0.01 -0.12 0.04 -0.06 -0.02 -0.03 -0.07 0.05 -0.02 -0.21 0.24 0.06 0.02 0.18 0.19 -0.04 0.12 0.08 -0.06 0.08 0.03 -0.01 0.12 0.01 0.02 -0.00 -0.08 0.04 0.01 -0.05 0.06 -0.04 -0.14 -0.10 0.08 0.17 0.09 -0.06 -0.07 -0.01 -0.06 -0.12 -0.15 0.07 -0.03 0.29 -0.12 -0.04 -0.10 0.08 0.03 0.35 -0.11 0.01 0.16 -0.01 0.04 0.01 -0.01 -0.07 -0.04 -0.02 -0.10 -0.00 -0.00 0.06 0.02 0.01 -0.00 0.05 -0.04 -0.02 -0.00 -0.03 -0.07 -0.01 0.07 0.01 0.04 0.04 0.04 0.05 -0.06 -0.02 -0.02 -0.02 -0.09 0.02 0.05 0.08 0.02 0.03 0.05 -0.01 0.18 0.20 0.04 -0.00 -0.03 0.02 0.00 0.02 0.04 -0.01 0.00 -0.01 0.01 0.06 0.03 -0.02 0.02 0.07 -0.06 -0.07 0.02 -0.04 -0.04 0.05 -0.04 -0.04 -0.08 -0.03 -0.02 -0.03 -0.01 -0.02 -0.17 -0.01 0.01 -0.15 -0.00 0.01 0.08 -0.07 -0.01 0.00 -0.04 -0.07 -0.03 0.02 -0.03 0.06 0.09 0.06 -0.08 0.13 0.02 0.08 0.05 0.09 0.06 -0.00 0.03 -0.00 0.08 0.04 0.10 -0.17 -0.11 0.04 -0.06 -0.03 -0.03 0.12 0.01 0.05 0.00 0.15 -0.03 0.26 0.28 -0.04 0.11 0.27 0.03 0.27 0.12 0.04 -0.01 -0.04 0.08 -0.00 -0.03 0.07 -0.02 -0.03 -0.03 0.02 0.09 0.18 -0.10 -0.08 0.03 -0.06 -0.17 0.14 -0.05 -0.06 -0.10 -0.04 -0.02 -0.02 -0.01 -0.02 -0.25 -0.00 0.03 -0.22 0.02 0.03 -0.09 -0.09 0.03 0.06 -0.08 0.11 -0.05 0.04 -0.05 0.04 -0.03 -0.02 0.02 -0.01 0.00 0.02 -0.02 0.05 0.10 -0.10 -0.04 0.02 0.02 -0.07 0.04 -0.03 0.01 0.00 -0.07 0.07 0.02 0.04 0.07 0.02 0.03 0.06 0.00 0.10 0.12 -0.09 -0.09 0.03 -0.07 -0.03 -0.03 -0.09 -0.01 -0.08 -0.05 0.01 -0.01 -0.08 0.03 -0.08 -0.09 0.04 -0.08 -0.05 0.05 -0.05 0.10 0.06 -0.06 -0.12 0.03 -0.01 0.21 0.06 -0.03 -0.02 0.03 0.02 0.16 0.04 0.01 -0.00 0.03 -0.01 -0.01 0.01 0.06 0.11 -0.12 -0.00 0.10 -0.10 -0.10 0.11 -0.12 -0.03 0.04 0.03 -0.13 -0.02 0.07 -0.05 0.03 0.01 -0.06 0.06 -0.08 -0.04 0.02 -0.01 0.02 -0.02 0.08 0.05 0.04 0.03 0.11 -0.02 0.18 0.20 -0.06 0.02 0.14 0.07 0.13 0.07 -0.06 -0.09 0.09 -0.15 -0.14 0.01 -0.11 -0.03 -0.10 -0.03 0.01 0.02 -0.11 0.03 -0.07 -0.08 0.04 -0.07 0.15 0.07 -0.09 -0.24 0.02 -0.00 0.34 0.07 -0.04 -0.07 0.02 0.06 0.25 0.04 0.03 0.01 -0.01 0.06 -0.13 -0.10 -0.13 0.04 -0.02 -0.02 -0.00 0.02 -0.00 0.01 -0.04 -0.00 -0.04 -0.02 -0.05 0.01 0.09 0.02 -0.00 0.05 0.00 -0.00 -0.00 0.02 -0.06 -0.05 -0.05 0.00 0.02 0.00 -0.06 0.19 0.11 0.06 -0.06 -0.09 -0.01 -0.05 0.08 0.00 -0.04 0.05 -0.01 -0.02 0.03 0.04 -0.03 0.02 0.01 -0.01 -0.01 0.00 0.01 -0.01 -0.00 0.01 -0.01 0.03 0.01 -0.01 -0.02 0.01 0.00 0.07 0.01 -0.01 0.01 0.00 0.00 0.06 0.00 0.00 0.03 -0.08 0.01 -0.04 -0.01 -0.05 0.00 0.06 0.01 0.06 0.11 0.07 -0.02 0.15 -0.01 0.05 0.07 0.05 -0.01 0.00 -0.01 -0.03 0.11 -0.02 -0.05 0.08 0.09 -0.11 0.27 0.20 -0.13 0.13 0.20 0.01 0.32 0.04 0.15 -0.31 -0.30 0.28 0.18 -0.07 -0.20 -0.08 0.06 -0.01 -0.05 0.13 -0.03 -0.10 0.06 -0.04 -0.02 0.04 0.06 -0.04 0.02 0.00 0.00 -0.01 0.01 0.01 -0.01 0.04 0.01 -0.02 -0.05 0.01 0.00 0.10 0.01 -0.01 -0.00 0.00 0.01 0.09 -0.00 0.00 -0.01 -0.02 -0.00 0.02 -0.01 0.02 0.02 -0.01 -0.01 -0.01 0.01 0.00 -0.04 -0.06 0.07 -0.05 -0.03 -0.03 0.09 0.15 0.05 -0.05 -0.01 -0.08 -0.06 -0.03 0.08 -0.01 -0.02 -0.00 -0.02 0.00 0.01 -0.08 0.00 -0.13 0.08 0.04 0.00 0.01 -0.02 0.01 0.00 -0.01 0.02 -0.00 -0.01 0.02 0.02 -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 0.02 0.00 -0.00 0.00 0.00 0.00 0.03 -0.00 -0.00 0.02 0.00 -0.00 -0.05 -0.12 0.08 -0.10 -0.06 -0.08 0.08 0.05 0.06 0.24 0.21 0.14 0.01 0.31 -0.03 -0.03 0.00 -0.03 -0.12 -0.09 -0.10 -0.03 0.05 -0.18 -0.09 -0.04 0.08 -0.15 -0.10 -0.18 -0.07 0.11 -0.21 -0.07 -0.00 -0.10 0.06 0.24 0.27 -0.14 -0.14 -0.13 0.41 0.04 -0.16 0.01 -0.02 0.02 0.01 -0.02 0.01 -0.01 -0.00 0.02 0.03 -0.02 -0.01 0.00 0.01 0.00 0.01 0.01 0.01 -0.02 0.01 0.00 0.03 -0.00 -0.00 -0.00 0.01 0.00 0.05 -0.01 -0.00 0.04 -0.00 -0.00 0.07 0.04 0.06 -0.06 -0.02 -0.08 0.00 -0.01 0.01 0.01 0.01 -0.00 0.01 0.04 -0.01 0.03 0.03 0.00 -0.02 -0.01 -0.01 0.01 -0.02 0.02 0.01 0.05 -0.00 0.01 0.02 -0.01 -0.00 0.03 0.02 0.02 0.02 0.06 -0.03 -0.02 -0.01 -0.00 -0.02 0.02 0.02 -0.05 -0.04 0.02 -0.06 -0.08 0.01 -0.03 0.01 0.01 -0.03 -0.03 -0.03 0.02 0.03 -0.03 0.01 0.02 -0.02 0.00 0.01 -0.02 0.02 0.01 -0.00 -0.00 0.00 -0.00 0.01 -0.00 0.01 -0.00 -0.01 0.00 0.04 -0.01 0.06 0.03 0.02 -0.02 0.05 -0.01 -0.09 -0.03 -0.01 0.01 -0.05 -0.00 -0.02 -0.04 0.01 0.04 -0.01 0.02 0.03 -0.05 0.03 0.02 0.06 0.01 0.06 -0.02 0.01 -0.04 0.06 0.06 0.05 0.01 0.14 -0.15 0.34 0.29 -0.41 -0.36 -0.20 0.45 -0.13 -0.18 -0.04 0.00 0.05 -0.04 -0.03 0.02 0.03 -0.07 -0.11 0.00 -0.01 0.05 -0.10 0.04 0.03 0.01 0.03 0.09 -0.02 0.00 0.02 -0.03 0.03 0.01 0.01 -0.01 0.00 0.00 0.01 -0.01 0.03 -0.01 -0.01 -0.06 -0.07 -0.03 -0.01 -0.01 0.08 0.00 0.02 -0.02 -0.01 -0.01 -0.01 0.01 -0.04 -0.03 -0.06 -0.04 0.02 -0.01 -0.10 -0.04 0.01 0.17 0.02 0.02 -0.05 -0.03 -0.05 -0.05 0.03 0.01 -0.01 -0.01 -0.03 0.09 0.05 0.05 -0.06 -0.06 0.01 0.03 -0.03 0.00 0.07 -0.01 0.02 0.06 0.02 -0.00 0.04 -0.03 0.02 0.03 0.01 0.04 -0.01 0.02 0.06 -0.02 0.02 0.04 -0.03 0.02 0.05 -0.00 0.01 -0.03 -0.03 0.01 -0.02 0.00 -0.00 -0.07 -0.01 0.00 0.01 0.00 -0.03 -0.07 -0.01 0.04 -0.01 -0.14 -0.04 -0.00 -0.10 -0.11 -0.01 -0.14 0.01 0.16 0.24 0.04 -0.01 0.17 0.02 -0.11 0.28 0.04 0.01 -0.04 -0.02 -0.03 0.02 -0.01 -0.18 0.18 0.08 0.09 0.16 0.16 -0.01 0.14 0.14 -0.19 -0.25 -0.23 0.38 -0.14 -0.17 0.07 0.00 -0.08 0.02 0.06 -0.02 0.03 0.07 0.04 -0.01 0.04 -0.07 0.03 -0.01 0.02 0.02 -0.03 0.03 0.06 -0.05 0.03 0.07 0.01 0.01 -0.05 -0.04 0.01 -0.04 0.02 -0.01 -0.14 0.00 -0.00 -0.09 -0.01 -0.11 0.13 0.03 0.00 0.04 -0.04 -0.01 -0.01 0.01 -0.00 0.02 0.01 -0.05 0.03 0.01 -0.07 -0.08 0.04 0.01 0.03 -0.07 0.09 0.01 0.03 -0.04 0.03 0.02 -0.07 0.00 0.00 -0.02 0.03 0.01 0.05 -0.04 -0.07 -0.07 -0.00 -0.03 0.04 -0.05 -0.01 0.15 -0.09 0.03 0.21 0.03 -0.04 0.03 -0.03 0.01 0.09 0.01 -0.01 -0.07 -0.04 0.01 -0.05 -0.01 0.04 -0.05 -0.06 -0.00 -0.02 0.05 0.04 -0.02 -0.01 -0.00 0.00 0.06 0.02 0.00 0.06 -0.02 -0.03 0.06 -0.00 -0.07 -0.11 -0.00 -0.05 -0.02 0.07 0.06 -0.16 0.10 0.04 -0.03 -0.09 0.12 0.12 -0.08 0.08 0.03 -0.10 0.13 0.02 0.05 -0.03 0.07 0.03 0.05 -0.01 -0.01 0.09 0.04 0.02 0.07 -0.12 0.15 0.09 -0.27 -0.27 -0.19 0.25 -0.16 -0.15 -0.01 -0.03 0.05 0.11 -0.08 0.02 -0.14 0.05 0.28 0.09 -0.08 -0.06 0.18 -0.04 -0.08 -0.05 -0.00 -0.21 -0.02 0.05 -0.07 -0.09 -0.02 -0.02 0.09 0.06 -0.02 -0.01 -0.02 0.03 0.12 0.02 0.02 0.04 -0.00 0.01 0.14 0.04 0.10 0.03 -0.04 0.02 -0.04 0.02 -0.01 -0.02 -0.02 -0.04 -0.05 -0.02 -0.05 -0.08 0.08 0.01 0.00 0.14 0.09 -0.03 -0.04 -0.07 0.04 0.00 0.02 -0.05 -0.01 -0.03 -0.04 0.00 0.01 -0.10 0.00 -0.00 0.02 -0.04 0.00 0.05 -0.08 -0.03 0.06 -0.10 -0.11 0.03 -0.05 0.04 0.04 -0.06 -0.06 -0.02 0.02 0.02 -0.05 0.02 0.01 -0.04 0.02 0.01 -0.04 0.03 0.00 0.00 0.01 -0.00 0.01 0.01 -0.01 0.04 0.01 -0.01 0.01 -0.02 -0.04 -0.06 -0.02 -0.06 -0.15 -0.18 -0.10 0.21 0.18 0.09 -0.33 0.29 0.07 0.15 0.20 0.21 0.04 0.04 0.06 -0.14 0.29 0.08 -0.02 -0.07 -0.10 -0.01 -0.05 -0.04 -0.12 0.06 0.02 0.02 0.02 0.10 -0.09 -0.06 -0.10 -0.02 0.06 0.06 -0.22 0.02 0.05 -0.01 -0.02 0.01 0.02 -0.04 0.00 0.06 -0.13 -0.16 0.02 -0.03 0.11 -0.12 0.05 0.03 0.06 0.07 0.11 -0.06 0.02 0.01 -0.05 0.03 0.01 0.02 0.00 -0.00 0.03 0.01 -0.01 0.09 -0.01 -0.02 0.06 0.03 -0.03 -0.05 0.08 -0.01 0.02 -0.05 0.05 -0.01 -0.01 -0.00 -0.02 -0.02 0.02 -0.03 -0.02 0.01 0.00 -0.10 -0.03 -0.01 0.11 -0.02 -0.01 -0.02 0.06 -0.01 0.03 -0.01 0.00 -0.01 0.03 -0.03 -0.01 -0.03 0.06 0.01 0.03 0.05 0.05 -0.05 0.03 -0.05 0.02 0.02 -0.04 0.06 0.02 -0.05 0.03 0.01 -0.04 0.06 0.01 -0.00 -0.04 -0.09 0.02 -0.03 -0.09 0.04 -0.03 -0.09 0.00 -0.02 0.02 0.03 -0.02 0.01 -0.01 -0.00 0.10 0.00 -0.01 -0.05 -0.03 0.02 -0.02 -0.04 -0.00 0.06 0.15 0.06 -0.30 -0.21 -0.15 0.24 -0.35 -0.05 0.16 0.18 0.12 -0.08 -0.04 -0.06 -0.12 0.30 -0.12 -0.01 -0.02 0.06 -0.09 0.05 0.04 0.07 -0.07 -0.04 -0.09 -0.00 -0.15 0.08 -0.00 0.07 0.06 0.01 0.01 0.08 0.02 0.01 -0.00 0.05 -0.17 0.13 0.15 -0.03 0.02 -0.04 0.06 0.02 -0.06 0.01 0.12 -0.02 -0.05 0.00 0.05 -0.13 -0.12 0.06 -0.04 -0.12 -0.01 -0.01 0.06 0.05 -0.02 0.05 -0.03 0.01 0.22 -0.01 -0.00 0.03 0.03 0.02 -0.01 0.04 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 0.00 0.01 -0.00 -0.01 -0.04 -0.02 0.03 -0.05 -0.02 0.00 0.03 0.02 0.03 -0.05 -0.02 0.00 0.01 0.01 0.05 -0.03 -0.01 0.00 0.03 -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 -0.01 -0.03 0.00 -0.01 -0.02 0.01 -0.01 -0.04 -0.00 -0.00 0.00 0.00 -0.01 -0.02 -0.00 0.00 0.01 -0.00 -0.00 0.01 0.02 0.00 -0.02 0.00 0.00 0.00 0.01 -0.00 0.00 0.01 0.00 0.00 0.01 -0.00 -0.10 -0.08 -0.13 -0.00 0.07 0.01 0.06 -0.15 0.03 0.04 -0.06 -0.03 0.07 -0.35 -0.32 -0.38 0.41 -0.06 0.27 0.05 0.48 0.07 -0.10 -0.05 0.11 0.03 0.02 -0.03 -0.01 0.01 -0.02 0.04 -0.03 0.00 0.06 0.01 0.00 0.01 0.02 -0.01 -0.00 -0.01 0.03 -0.01 -0.01 -0.01 0.01 -0.04 -0.02 0.01 -0.01 -0.06 -0.00 -0.00 0.02 0.01 -0.01 -0.02 -0.00 0.00 0.04 -0.01 -0.00 -0.03 0.01 -0.01 0.05 -0.01 -0.02 0.01 0.01 -0.02 0.00 0.00 0.00 -0.01 0.01 0.01 0.02 0.01 -0.03 -0.00 0.00 0.01 0.01 -0.00 0.02 -0.02 0.02 0.03 0.02 0.01 -0.03 -0.01 -0.00 0.00 -0.01 -0.02 -0.02 -0.01 -0.00 0.00 -0.03 -0.04 0.04 -0.02 -0.01 0.02 -0.02 -0.01 -0.02 -0.00 0.00 0.01 -0.01 0.00 -0.03 -0.02 0.01 0.02 0.04 -0.00 0.01 0.04 -0.01 0.00 0.04 0.00 0.00 0.00 -0.00 0.00 -0.00 0.01 0.00 -0.04 0.01 0.00 -0.01 -0.03 0.02 0.03 -0.01 -0.04 0.05 0.28 0.09 -0.30 -0.10 -0.04 0.24 -0.21 -0.05 0.17 0.08 0.38 -0.03 -0.37 -0.09 -0.10 0.30 -0.19 -0.02 0.04 0.04 0.02 -0.17 -0.16 -0.13 0.15 -0.07 0.07 -0.03 0.17 0.00 -0.04 -0.03 0.03 0.03 0.02 -0.06 0.01 0.02 -0.03 -0.03 0.12 -0.03 -0.12 0.02 -0.04 -0.01 -0.02 0.01 0.00 0.03 -0.08 0.03 0.02 -0.00 -0.01 0.08 0.06 -0.01 0.01 0.05 0.01 0.00 -0.01 -0.01 0.00 -0.02 0.02 -0.00 -0.09 0.02 0.00 -0.06 0.05 -0.02 0.05 0.06 0.03 0.04 -0.03 -0.06 -0.05 0.03 -0.04 -0.01 -0.02 -0.03 -0.08 0.01 -0.08 -0.13 -0.01 -0.05 -0.04 -0.04 -0.01 0.05 -0.08 0.02 -0.03 0.04 -0.04 0.06 -0.03 0.05 0.01 0.02 0.02 0.17 0.01 0.05 -0.04 -0.00 0.08 -0.02 0.01 0.06 0.03 -0.03 -0.06 -0.01 0.01 0.06 0.05 -0.04 -0.10 -0.01 0.01 0.03 0.01 0.01 0.02 0.01 -0.01 0.02 0.01 0.02 0.01 -0.01 -0.01 0.01 0.00 0.01 -0.00 -0.01 0.00 -0.00 -0.01 -0.04 -0.02 -0.10 -0.01 -0.11 -0.12 0.15 -0.05 -0.33 -0.08 -0.09 -0.02 -0.17 -0.02 -0.21 -0.12 -0.22 0.02 0.18 0.06 0.06 -0.27 0.14 0.09 -0.09 0.00 -0.06 0.13 0.15 0.11 -0.10 0.05 -0.04 0.06 -0.16 0.21 -0.01 0.13 0.17 0.03 0.01 0.21 0.05 0.00 -0.04 0.01 0.16 -0.01 -0.09 0.06 0.02 -0.04 -0.07 -0.02 0.03 0.10 -0.17 0.05 0.05 0.07 0.04 0.17 0.01 -0.01 0.03 0.02 0.03 0.01 -0.02 -0.02 0.01 0.00 0.02 -0.01 -0.03 -0.00 -0.02 0.13 0.08 0.15 0.07 -0.00 0.02 -0.07 0.07 0.02 -0.02 -0.03 -0.05 -0.00 -0.05 -0.05 -0.02 -0.02 -0.06 -0.08 0.01 -0.04 0.01 -0.06 0.00 0.04 -0.10 -0.04 0.06 0.02 0.03 0.03 -0.04 0.01 -0.01 0.03 0.02 0.09 -0.01 0.02 -0.02 0.03 0.03 0.00 0.04 -0.08 -0.05 0.08 0.02 -0.01 0.04 -0.08 -0.08 0.08 0.07 -0.02 -0.01 -0.03 -0.01 -0.02 -0.02 -0.01 -0.02 -0.01 -0.01 -0.04 0.00 -0.01 -0.02 -0.00 -0.01 -0.04 0.01 0.00 -0.03 0.02 -0.00 -0.03 -0.05 -0.04 -0.04 -0.08 -0.12 -0.08 -0.12 0.02 0.05 0.01 -0.19 0.09 -0.01 0.13 0.00 0.35 0.00 -0.41 -0.11 -0.09 0.20 -0.19 0.06 -0.12 -0.06 -0.08 0.17 0.17 0.07 -0.11 0.08 -0.05 0.09 -0.16 0.10 0.02 0.10 0.05 -0.03 -0.01 0.16 0.02 -0.03 -0.03 0.04 0.11 -0.15 0.00 0.03 -0.06 0.09 0.03 -0.02 0.03 -0.11 0.11 -0.06 -0.04 -0.11 -0.06 -0.15 -0.02 -0.02 -0.02 -0.02 -0.06 -0.00 -0.00 -0.00 0.00 -0.00 -0.05 0.02 0.01 -0.03 0.03 0.08 0.04 0.01 0.00 0.07 -0.01 -0.04 -0.02 0.07 -0.01 0.01 -0.00 -0.02 -0.01 0.01 -0.01 -0.00 -0.01 -0.03 -0.03 -0.02 -0.01 0.07 -0.00 -0.01 -0.01 0.04 0.03 0.03 -0.01 -0.01 -0.01 0.02 -0.03 -0.00 -0.01 0.04 -0.01 0.01 -0.02 -0.05 -0.05 -0.02 -0.17 -0.03 -0.11 -0.09 0.06 0.03 -0.14 -0.03 -0.11 0.01 0.10 -0.09 0.03 0.04 0.11 -0.00 -0.06 0.18 0.03 -0.07 0.16 -0.01 -0.06 0.05 0.08 -0.02 0.01 0.03 -0.00 -0.12 0.10 0.02 -0.04 -0.01 0.01 -0.01 -0.02 -0.02 -0.05 -0.10 -0.05 0.03 -0.01 -0.04 -0.09 -0.01 0.03 -0.06 0.04 -0.25 0.01 0.33 0.08 0.02 -0.10 0.16 -0.01 -0.00 0.04 -0.06 -0.01 -0.01 -0.01 0.01 -0.03 -0.03 0.00 -0.03 0.06 -0.03 0.02 0.05 0.01 -0.01 0.04 -0.00 0.01 -0.14 -0.01 -0.10 0.01 0.02 -0.03 -0.17 -0.11 0.05 0.11 -0.16 -0.05 -0.12 0.15 0.04 -0.13 -0.09 0.15 0.23 0.05 -0.11 0.21 -0.04 -0.07 0.03 0.11 -0.01 -0.03 0.02 0.03 -0.32 0.15 0.07 0.04 0.04 -0.00 0.10 -0.05 -0.09 0.00 0.06 -0.02 0.01 0.00 0.01 -0.02 -0.02 0.04 0.03 -0.00 -0.06 0.02 -0.07 -0.01 0.04 0.11 0.07 -0.06 0.04 0.11 0.06 0.02 -0.08 -0.05 -0.00 0.06 -0.09 -0.03 -0.05 -0.01 -0.03 0.03 -0.01 -0.04 0.05 0.01 0.03 -0.02 -0.02 0.06 -0.02 0.02 0.05 -0.02 -0.02 0.06 -0.01 0.01 -0.01 -0.03 -0.02 -0.01 0.02 -0.04 -0.03 0.02 -0.03 -0.02 0.02 -0.01 -0.04 0.01 -0.00 -0.03 0.01 0.02 -0.05 0.01 -0.05 -0.10 0.04 0.06 -0.05 -0.09 0.01 -0.14 -0.01 0.04 -0.07 -0.10 -0.00 -0.11 0.04 -0.01 0.08 -0.27 0.12 0.49 0.18 0.03 -0.11 0.35 -0.08 0.07 0.13 -0.14 -0.15 -0.13 -0.08 0.09 -0.15 -0.08 -0.05 0.00 0.01 -0.07 0.00 0.02 0.01 0.00 -0.03 -0.04 0.05 0.01 -0.03 0.22 -0.07 -0.20 0.01 -0.03 0.05 -0.02 0.02 0.05 -0.02 0.07 -0.07 -0.03 -0.03 -0.01 -0.11 -0.05 -0.04 0.03 -0.04 -0.02 0.02 -0.01 -0.04 0.01 0.01 -0.02 -0.00 0.06 -0.06 -0.00 0.02 -0.04 0.03 0.03 -0.03 0.05 -0.01 0.02 0.03 -0.00 0.03 0.00 0.01 -0.02 -0.01 -0.04 -0.01 -0.03 -0.00 0.11 0.03 0.00 0.02 0.02 0.01 -0.03 -0.05 -0.00 -0.04 0.02 -0.00 -0.01 -0.03 -0.01 0.02 -0.00 -0.05 0.01 -0.01 0.01 -0.02 -0.02 0.03 -0.02 -0.05 0.00 0.01 -0.00 0.02 -0.01 -0.04 -0.02 0.02 0.04 0.01 -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 -0.00 -0.00 -0.01 0.00 0.00 -0.01 0.00 0.06 -0.02 -0.00 -0.07 0.01 -0.03 0.09 0.56 0.16 -0.45 -0.04 0.05 0.36 -0.15 -0.12 -0.10 -0.03 -0.17 0.06 0.22 0.08 0.06 -0.16 0.16 0.00 -0.04 -0.06 -0.02 0.07 0.04 -0.00 -0.03 0.03 -0.01 0.04 -0.05 -0.08 0.05 -0.01 -0.08 -0.03 0.02 -0.04 0.01 -0.02 0.03 -0.03 -0.02 -0.03 -0.00 -0.01 0.00 0.00 -0.01 0.03 -0.01 -0.05 0.09 -0.03 -0.02 -0.03 -0.01 -0.09 -0.01 -0.00 0.00 -0.00 -0.01 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.01 -0.01 -0.00 0.03 0.09 0.01 -0.02 0.09 -0.02 0.01 -0.01 -0.06 0.05 -0.04 0.02 0.04 -0.08 0.01 0.01 -0.04 0.01 0.17 -0.02 0.03 0.07 -0.02 0.04 0.01 -0.13 -0.10 0.01 0.06 -0.02 -0.02 -0.07 -0.06 -0.09 0.05 -0.02 -0.11 -0.02 0.01 -0.00 0.06 0.05 -0.04 0.05 0.09 -0.02 0.03 0.01 -0.04 0.04 0.07 0.01 -0.02 -0.07 -0.07 0.03 0.06 -0.01 -0.03 -0.06 0.00 -0.01 -0.06 -0.00 -0.06 -0.03 0.00 0.02 -0.01 -0.00 -0.05 0.02 -0.01 -0.00 0.03 0.10 -0.04 0.02 0.02 -0.08 -0.02 0.21 0.02 0.13 0.13 -0.04 0.01 0.26 -0.04 -0.05 0.06 -0.03 0.01 0.11 0.04 0.06 0.06 -0.06 0.10 -0.01 -0.18 -0.14 -0.20 0.15 0.11 -0.08 -0.04 0.04 -0.07 0.17 -0.18 -0.17 0.07 0.01 -0.16 -0.11 0.08 -0.09 -0.00 -0.02 -0.03 0.07 0.03 0.05 0.06 0.04 -0.03 0.03 0.03 -0.05 0.04 0.07 -0.31 0.19 0.08 0.03 -0.00 0.33 -0.01 0.02 -0.09 -0.01 -0.10 -0.04 0.00 0.07 0.00 -0.01 -0.07 0.06 -0.04 0.02 0.07 0.00 -0.06 0.01 0.02 -0.08 0.01 0.03 0.02 0.01 -0.02 0.01 -0.01 -0.02 0.02 -0.01 -0.01 0.01 -0.02 -0.07 0.02 -0.01 -0.02 0.01 -0.01 -0.01 0.07 0.05 -0.00 -0.05 0.01 0.00 0.04 0.03 0.04 -0.03 0.01 0.04 0.01 -0.01 0.06 0.02 -0.01 0.04 0.06 0.00 0.05 0.05 0.02 0.03 0.04 -0.01 0.03 0.01 0.02 -0.07 0.06 0.11 -0.03 -0.06 -0.13 -0.03 -0.01 -0.13 -0.05 -0.12 -0.07 -0.00 0.05 -0.02 -0.02 -0.10 0.05 0.00 -0.01 0.07 -0.04 -0.00 -0.01 -0.02 0.03 -0.00 -0.08 0.06 -0.04 -0.11 0.01 0.00 -0.07 0.01 0.00 -0.02 0.01 -0.02 -0.02 0.03 -0.01 -0.02 0.01 -0.00 -0.01 0.10 0.07 0.11 -0.08 -0.06 0.05 0.02 -0.03 0.02 -0.10 0.09 0.06 -0.03 -0.02 0.06 0.05 -0.05 0.03 -0.01 0.01 0.12 -0.00 -0.06 0.05 0.06 -0.00 0.08 0.06 0.04 0.01 0.04 -0.04 -0.33 0.37 0.13 0.04 -0.02 0.49 -0.05 0.05 -0.20 -0.10 -0.21 -0.09 0.00 0.15 -0.00 -0.03 -0.16 0.12 0.01 0.01 0.14 0.03 -0.01 -0.09 -0.09 0.17 0.04 0.13 0.22 -0.02 -0.02 -0.02 0.04 0.01 0.00 0.01 -0.01 -0.02 0.07 -0.02 0.00 0.05 -0.07 0.02 -0.08 0.01 0.00 -0.04 -0.01 0.02 0.01 0.02 0.02 -0.04 0.08 -0.00 0.03 0.00 0.03 -0.03 0.05 -0.11 0.01 0.04 -0.12 0.05 -0.14 0.00 -0.07 0.20 0.01 0.07 -0.07 0.18 -0.09 -0.06 0.05 -0.06 -0.00 -0.02 0.00 -0.03 -0.08 0.01 -0.02 -0.08 0.05 -0.02 -0.10 0.01 -0.02 -0.09 0.05 -0.01 -0.13 0.05 0.03 0.03 0.01 0.02 -0.01 0.09 -0.04 0.00 0.02 -0.00 0.01 0.09 -0.05 0.04 0.04 -0.03 0.04 -0.12 -0.21 0.01 -0.08 -0.03 0.06 -0.17 -0.00 -0.01 -0.05 0.16 0.04 0.03 0.05 -0.04 0.08 0.07 -0.02 0.07 -0.00 0.03 -0.03 -0.00 0.02 -0.03 0.00 0.03 -0.03 -0.02 -0.08 0.03 0.14 -0.15 -0.01 -0.32 -0.07 -0.13 0.39 -0.01 0.15 -0.06 -0.04 -0.06 -0.12 -0.02 -0.10 -0.04 -0.11 0.04 -0.05 -0.12 0.04 -0.02 -0.07 0.02 -0.03 -0.08 0.03 -0.00 -0.13 0.05 -0.01 -0.05 0.02 -0.08 0.01 0.06 0.04 0.04 -0.02 0.07 0.03 -0.13 -0.02 0.06 -0.06 0.00 0.03 0.00 -0.02 0.06 -0.14 0.18 -0.06 0.08 0.01 0.03 0.06 -0.03 -0.03 0.07 -0.01 -0.01 0.09 -0.10 0.01 -0.07 0.00 -0.06 0.06 0.02 0.04 -0.05 -0.01 -0.04 0.04 -0.04 -0.02 -0.01 0.04 -0.01 0.05 -0.01 0.03 -0.04 -0.01 0.01 -0.02 0.00 0.00 0.01 0.00 -0.01 0.01 0.01 -0.00 0.02 -0.00 -0.02 0.00 0.00 -0.01 0.01 -0.01 -0.02 0.00 -0.14 0.13 -0.10 -0.11 0.08 -0.01 -0.03 0.08 -0.18 -0.02 0.06 -0.08 -0.04 0.08 -0.13 0.10 -0.09 0.23 0.42 -0.12 0.05 0.11 -0.08 0.19 0.07 0.05 0.07 -0.26 -0.09 -0.09 -0.04 0.12 -0.19 -0.11 0.03 -0.11 -0.00 -0.08 0.01 0.01 -0.04 0.02 -0.01 -0.11 0.09 -0.00 0.03 -0.27 0.11 0.24 0.00 -0.10 -0.04 -0.03 0.09 -0.01 0.07 -0.03 -0.02 -0.02 -0.02 0.01 -0.03 0.00 -0.03 0.02 0.01 -0.01 0.01 0.00 -0.02 0.00 0.00 -0.00 -0.00 -0.01 -0.02 0.00 0.09 0.01 0.08 0.05 -0.07 0.00 -0.00 0.00 -0.07 -0.03 -0.04 -0.01 -0.01 -0.08 -0.01 -0.06 -0.07 -0.08 0.04 -0.00 0.01 -0.01 0.01 0.04 -0.05 0.04 0.02 0.01 -0.04 -0.01 -0.03 0.09 -0.01 0.10 -0.05 0.05 0.03 0.06 -0.07 0.04 0.12 -0.07 -0.06 -0.00 0.09 -0.08 -0.00 0.02 -0.05 0.01 0.09 -0.03 -0.01 -0.10 -0.04 -0.01 -0.05 -0.01 0.02 0.03 0.01 -0.01 0.03 0.03 0.02 0.02 0.01 -0.02 0.00 0.00 0.02 -0.01 -0.02 -0.00 -0.01 -0.01 -0.15 0.00 -0.05 -0.08 -0.09 0.07 0.03 0.08 0.01 -0.01 0.01 0.10 -0.01 -0.06 0.01 0.02 -0.01 0.04 0.08 0.06 -0.06 -0.02 0.12 -0.11 0.06 0.04 0.31 -0.05 -0.03 0.11 -0.09 0.08 0.03 -0.20 0.18 0.08 0.00 -0.05 0.05 0.12 -0.14 0.05 0.04 -0.07 -0.02 0.11 -0.41 0.17 0.44 0.02 -0.14 -0.02 0.02 -0.03 0.01 0.11 -0.08 -0.08 -0.04 -0.03 0.02 -0.06 0.02 -0.02 0.05 0.05 0.03 0.02 0.03 -0.05 -0.00 0.01 0.03 -0.03 -0.05 -0.00 -0.02 -0.03 0.02 -0.01 -0.06 0.12 0.05 -0.01 -0.00 0.05 -0.02 -0.01 -0.05 -0.03 -0.05 -0.03 -0.13 -0.05 -0.07 0.14 -0.03 -0.06 0.05 -0.06 0.12 -0.05 0.04 0.01 -0.08 0.01 -0.02 -0.03 0.08 0.00 0.08 -0.04 0.04 0.03 0.05 -0.06 -0.03 -0.05 0.07 0.03 -0.00 -0.06 0.05 -0.00 -0.02 0.03 -0.01 -0.07 0.01 0.01 0.06 0.02 0.00 0.02 0.00 -0.01 -0.02 -0.01 0.00 -0.02 -0.01 -0.01 -0.01 -0.01 0.01 -0.00 -0.00 -0.01 0.00 0.01 0.00 0.00 -0.05 -0.08 -0.03 -0.17 -0.05 -0.10 0.20 -0.11 0.08 0.23 -0.00 -0.14 0.19 0.00 -0.14 -0.01 -0.08 0.23 0.27 -0.08 0.11 -0.01 -0.10 0.24 -0.08 0.05 0.03 0.25 -0.05 -0.03 0.10 -0.07 0.05 0.01 -0.19 0.16 0.08 -0.01 -0.05 0.05 0.11 -0.14 0.05 0.03 -0.05 -0.01 -0.04 0.29 -0.14 -0.25 0.02 0.07 0.00 -0.02 0.01 -0.01 -0.08 0.06 0.03 0.02 0.00 -0.01 0.01 -0.01 0.01 -0.03 -0.03 -0.01 -0.01 -0.01 0.02 -0.00 -0.00 -0.01 0.01 0.03 0.00 0.01 0.06 -0.01 0.01 -0.07 0.11 0.04 -0.04 -0.04 -0.03 0.09 -0.09 -0.03 0.08 -0.12 0.01 0.01 -0.11 0.01 -0.11 0.03 0.00 0.09 0.02 -0.10 0.02 0.01 0.05 0.01 -0.02 0.01 0.02 0.14 0.08 0.06 0.03 -0.05 -0.08 -0.02 -0.03 0.00 -0.06 0.05 -0.02 0.05 0.01 -0.00 0.03 0.02 -0.07 0.03 0.01 0.00 -0.03 -0.01 -0.00 -0.02 0.00 -0.00 -0.00 0.01 0.03 0.01 0.00 -0.03 0.02 -0.00 -0.03 0.02 0.00 0.03 0.01 -0.01 0.00 0.02 -0.01 0.01 -0.13 -0.00 -0.02 -0.11 -0.01 -0.19 0.18 -0.19 -0.23 0.01 0.20 -0.18 0.05 0.06 0.18 0.06 -0.22 -0.02 0.11 -0.07 0.07 0.05 -0.11 -0.05 -0.03 0.03 0.07 -0.08 -0.15 0.17 0.11 -0.19 -0.03 -0.11 -0.01 -0.14 -0.04 -0.21 -0.11 -0.02 -0.12 -0.10 -0.23 0.11 0.05 -0.06 0.21 -0.06 -0.20 0.01 0.03 0.06 0.05 -0.14 0.04 -0.00 -0.02 -0.02 0.00 0.01 -0.01 0.01 0.07 0.00 -0.01 -0.06 0.04 0.00 -0.06 0.01 0.01 0.07 -0.00 -0.02 0.00 0.02 -0.01 -0.01 0.00 0.00 0.01 -0.02 -0.01 0.01 0.00 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 0.01 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.02 -0.01 -0.01 -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 0.00 0.01 -0.01 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.01 0.01 0.00 -0.00 0.20 -0.04 -0.02 -0.20 0.04 0.03 -0.20 0.04 0.02 0.19 -0.04 -0.02 0.00 -0.00 0.00 -0.00 0.01 0.00 0.00 0.01 -0.00 0.03 -0.03 0.03 0.03 -0.00 -0.03 0.02 -0.01 -0.01 -0.03 -0.01 0.03 -0.00 -0.01 0.01 -0.01 -0.01 0.01 0.01 0.00 -0.00 -0.01 0.01 0.02 -0.02 -0.01 0.02 0.01 0.02 -0.00 0.01 0.00 0.02 0.01 0.00 0.02 0.01 0.03 -0.01 -0.01 0.01 -0.05 0.02 0.05 0.00 -0.01 -0.01 -0.01 0.03 -0.01 -0.00 0.01 -0.00 -0.01 -0.00 0.01 -0.01 0.44 -0.09 -0.05 -0.44 0.09 0.05 -0.44 0.09 0.05 0.44 -0.09 -0.05 0.02 -0.01 -0.00 -0.03 0.02 0.04 0.04 -0.04 0.01 0.02 0.02 0.02 -0.01 0.11 0.07 0.07 -0.03 0.04 -0.11 0.01 -0.10 0.02 -0.07 0.02 -0.06 -0.04 0.00 0.09 -0.01 0.04 -0.07 -0.00 -0.04 0.09 0.09 0.07 0.06 0.09 -0.09 -0.10 -0.06 0.01 -0.01 0.06 -0.01 0.01 -0.03 -0.01 0.00 -0.03 -0.02 0.05 -0.02 -0.02 -0.01 0.02 0.01 -0.00 0.01 -0.00 -0.00 0.00 -0.00 -0.00 -0.01 -0.00 0.01 -0.01 0.00 0.00 -0.01 -0.00 -0.00 -0.01 0.01 -0.01 -0.01 0.01 0.15 -0.15 0.07 -0.13 -0.00 -0.12 0.01 -0.24 0.03 0.09 -0.06 -0.21 -0.02 -0.15 0.14 -0.19 -0.09 0.08 -0.10 -0.17 -0.04 0.08 -0.07 -0.13 0.06 -0.07 -0.00 -0.08 -0.01 -0.13 0.14 0.19 -0.22 0.02 0.07 -0.13 -0.24 0.00 -0.21 -0.17 -0.13 0.01 -0.15 -0.27 0.17 -0.05 0.06 -0.12 0.01 0.18 0.03 -0.02 -0.04 -0.04 0.08 -0.03 -0.01 0.02 0.01 -0.01 -0.02 0.01 -0.02 -0.01 -0.01 0.00 0.01 -0.02 0.00 0.01 -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 0.00 0.00 0.00 -0.05 -0.03 0.02 0.00 0.05 -0.09 0.04 0.02 0.04 0.04 0.01 0.04 -0.07 0.00 0.02 0.04 -0.07 -0.13 0.02 0.01 0.00 -0.08 0.14 0.18 -0.06 -0.03 0.00 0.05 -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 0.01 -0.00 -0.00 0.09 0.11 -0.07 0.13 0.05 0.11 0.09 0.05 0.13 0.05 0.01 0.08 0.12 0.05 -0.08 -0.03 0.02 0.00 -0.08 0.01 0.02 -0.08 0.02 0.01 0.20 -0.28 -0.33 -0.07 -0.13 -0.08 0.12 0.03 -0.16 -0.20 -0.21 0.01 0.15 -0.25 -0.08 0.06 0.12 -0.36 0.15 -0.31 0.12 -0.01 0.00 0.00 0.00 -0.00 -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 -0.00 -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 0.02 0.01 -0.00 -0.00 -0.02 0.03 -0.01 0.01 -0.00 -0.00 0.00 -0.01 0.01 0.00 -0.01 -0.00 -0.01 -0.00 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 -0.00 0.00 -0.00 0.00 -0.01 -0.04 0.00 -0.03 -0.03 -0.05 0.00 -0.05 -0.02 0.00 -0.00 -0.02 0.01 -0.01 0.03 -0.02 0.08 -0.06 0.05 0.28 -0.08 -0.03 -0.04 0.02 0.02 -0.04 0.02 -0.02 -0.11 0.05 0.03 -0.13 0.05 -0.01 0.20 0.01 -0.04 0.00 -0.02 0.01 -0.00 -0.01 -0.01 -0.01 0.01 -0.01 -0.01 -0.00 0.01 -0.01 -0.00 0.01 0.02 0.00 -0.01 0.00 0.01 -0.00 0.01 0.00 -0.01 -0.02 -0.01 0.00 0.02 0.00 0.00 0.00 -0.01 0.01 -0.00 -0.01 0.01 -0.00 0.00 -0.01 -0.00 0.01 -0.01 -0.00 0.00 -0.01 -0.09 0.01 -0.10 -0.01 0.08 -0.00 -0.11 -0.04 -0.01 0.05 -0.03 0.02 -0.08 0.05 0.07 0.03 -0.24 0.26 -0.30 0.10 0.02 -0.28 0.10 0.01 -0.38 0.08 0.06 -0.39 0.09 0.05 0.35 -0.02 -0.06 -0.12 0.04 0.02 0.02 -0.03 -0.02 0.03 0.03 0.04 0.14 0.07 0.03 0.06 -0.06 0.11 0.02 0.01 -0.00 -0.06 -0.01 0.02 0.16 0.00 -0.09 -0.08 -0.07 -0.04 -0.02 0.04 -0.00 -0.12 0.03 -0.01 -0.06 -0.08 0.07 0.01 0.05 -0.07 -0.08 0.10 0.03 -0.00 -0.03 -0.00 0.03 -0.04 -0.04 0.07 -0.03 -0.05 0.01 0.02 0.04 0.01 0.03 0.00 -0.02 0.01 -0.01 -0.00 -0.01 -0.01 0.00 -0.01 0.00 0.01 -0.01 -0.01 0.01 -0.01 0.01 -0.01 -0.02 0.01 0.09 -0.08 0.12 -0.07 -0.04 -0.09 -0.16 -0.00 -0.21 -0.16 -0.05 -0.02 -0.15 -0.12 0.25 0.11 -0.02 -0.11 0.06 -0.02 -0.10 0.25 -0.01 -0.18 -0.14 -0.19 -0.13 0.09 -0.03 0.05 -0.06 -0.16 0.12 -0.11 -0.17 0.14 0.12 -0.06 0.01 0.04 0.16 -0.21 0.07 0.05 -0.10 -0.11 0.10 -0.11 -0.04 0.22 0.06 0.04 -0.06 -0.09 0.13 -0.05 -0.06 0.06 0.03 -0.00 0.00 0.04 -0.03 0.02 -0.02 -0.01 0.02 -0.03 -0.00 0.03 0.00 -0.01 0.03 -0.01 0.00 -0.01 -0.02 0.02 0.14 -0.07 -0.03 -0.03 0.02 0.03 -0.03 -0.03 -0.05 0.05 0.24 0.07 0.03 0.05 0.07 -0.05 0.05 -0.04 0.00 -0.01 -0.02 0.02 -0.01 -0.00 -0.03 -0.02 -0.05 0.00 -0.05 0.01 -0.07 0.00 0.00 -0.06 -0.05 0.04 0.01 0.02 -0.03 0.10 -0.13 -0.05 0.01 0.02 -0.01 -0.04 0.05 0.05 -0.07 0.04 0.06 -0.01 -0.02 -0.04 -0.02 -0.03 -0.01 0.01 -0.02 0.01 0.01 0.01 0.01 -0.00 0.00 -0.01 -0.00 0.01 0.01 -0.00 0.01 -0.01 0.01 0.02 -0.01 0.14 0.00 0.11 -0.18 0.08 -0.08 -0.03 -0.19 -0.07 -0.01 -0.03 -0.34 -0.04 -0.21 0.24 -0.22 -0.10 0.10 0.01 -0.16 -0.05 0.22 -0.09 -0.15 -0.01 -0.13 -0.13 -0.01 -0.02 0.04 -0.07 -0.08 0.07 -0.07 -0.07 0.06 0.09 -0.06 0.03 0.03 0.09 -0.12 0.06 0.02 -0.05 0.15 -0.13 0.11 0.06 -0.26 -0.08 -0.05 0.07 0.10 -0.15 0.06 0.09 -0.06 -0.04 -0.00 -0.01 -0.04 0.02 -0.01 0.02 0.01 -0.01 0.03 -0.00 -0.02 -0.01 0.00 -0.01 0.00 -0.01 0.01 0.02 -0.01 0.00 -0.02 0.06 -0.01 0.08 0.06 -0.02 0.01 0.01 0.04 -0.02 0.06 0.15 0.02 -0.19 -0.01 -0.05 -0.13 0.01 -0.05 0.13 0.02 -0.00 -0.04 0.02 0.22 -0.06 -0.10 -0.06 -0.08 -0.04 -0.08 0.01 -0.12 -0.06 0.02 0.04 -0.03 0.06 0.01 0.03 0.05 0.00 0.01 0.02 0.00 -0.00 -0.03 0.01 -0.01 -0.03 -0.02 -0.00 -0.00 -0.02 -0.02 0.00 -0.00 -0.01 0.01 0.00 0.01 0.01 -0.00 -0.00 -0.01 0.00 0.01 0.00 -0.00 -0.00 -0.01 0.00 0.02 -0.01 0.33 -0.20 -0.11 0.15 0.08 0.07 -0.00 -0.04 0.11 0.02 -0.04 0.16 -0.01 -0.03 0.13 0.02 -0.00 -0.10 -0.12 -0.02 -0.04 0.10 0.01 -0.15 0.09 0.45 0.12 -0.21 -0.11 0.01 -0.11 -0.01 -0.03 -0.11 -0.02 -0.02 0.12 -0.05 0.21 0.10 0.01 0.11 0.05 0.15 -0.07 0.04 0.02 -0.04 0.02 0.11 0.07 0.00 -0.02 -0.06 0.02 -0.03 -0.08 -0.02 -0.03 0.00 -0.03 -0.03 -0.00 0.00 0.01 0.00 0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 -0.01 -0.00 0.01 0.02 -0.01 0.01 0.01 0.03 -0.00 0.01 0.01 0.02 -0.07 -0.03 0.00 -0.00 0.01 0.03 -0.01 -0.03 -0.01 -0.01 -0.03 0.00 -0.01 0.02 0.00 -0.00 -0.00 0.00 0.04 -0.01 -0.01 -0.00 -0.01 -0.01 -0.01 0.00 -0.02 -0.01 0.00 0.01 -0.01 0.01 -0.12 -0.05 -0.09 -0.02 -0.06 -0.13 -0.00 -0.02 0.12 -0.09 0.03 0.08 0.08 -0.00 0.02 0.08 0.22 -0.06 0.07 0.17 -0.09 -0.01 -0.08 -0.12 0.05 0.06 0.08 -0.05 -0.09 -0.05 0.00 0.05 0.14 0.01 -0.20 0.09 0.06 -0.05 -0.02 0.02 0.01 0.00 0.00 -0.01 0.02 0.00 -0.01 0.02 0.00 -0.01 0.02 -0.00 -0.00 -0.01 -0.02 -0.00 -0.01 0.02 -0.00 -0.02 0.01 0.08 0.03 -0.03 -0.02 -0.00 -0.01 -0.00 -0.01 -0.02 -0.01 -0.00 0.02 -0.01 0.03 0.01 -0.00 0.02 0.01 0.02 -0.01 -0.15 -0.03 -0.05 -0.23 -0.05 -0.09 -0.01 0.04 0.24 -0.19 0.12 0.31 0.11 0.31 -0.07 0.15 0.28 -0.02 -0.07 -0.17 0.02 -0.04 -0.11 0.06 -0.09 0.11 -0.02 -0.08 0.17 0.03 -0.01 -0.21 0.05 0.03 -0.02 -0.02 -0.01 0.00 -0.00 -0.12 0.01 0.17 -0.01 0.02 0.00 -0.01 0.00 0.01 0.01 0.00 0.01 0.00 0.01 -0.02 -0.01 0.00 0.01 -0.00 -0.01 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 0.09 0.00 0.06 -0.04 0.08 0.15 -0.00 0.01 0.00 0.01 -0.08 -0.17 0.04 -0.08 -0.16 -0.04 0.07 -0.11 0.05 0.09 -0.01 0.02 0.01 -0.02 0.05 0.02 0.10 -0.04 -0.02 -0.07 -0.03 -0.00 0.05 0.02 -0.11 0.01 -0.01 0.01 0.01 -0.01 0.00 0.00 0.00 -0.01 -0.01 0.00 0.01 -0.05 0.00 -0.01 -0.00 -0.04 -0.01 0.02 -0.00 -0.01 0.00 -0.00 -0.01 0.01 -0.00 -0.03 -0.01 0.01 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 -0.01 -0.00 -0.01 0.00 0.13 -0.01 0.07 0.15 -0.03 0.05 0.04 -0.02 -0.08 0.15 -0.25 -0.66 -0.26 0.09 -0.09 0.10 0.13 0.08 -0.03 -0.05 0.07 -0.02 -0.01 0.10 -0.13 0.05 -0.05 -0.13 0.10 -0.04 0.01 -0.10 0.04 0.02 -0.01 -0.01 -0.01 0.00 -0.00 -0.04 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 -0.01 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 0.05 0.00 0.03 -0.02 0.03 0.08 0.00 -0.01 -0.06 -0.00 -0.03 -0.04 -0.02 0.01 -0.00 0.01 -0.01 -0.02 -0.03 -0.05 -0.12 -0.07 -0.27 -0.09 -0.01 0.14 -0.26 0.01 -0.14 0.30 0.08 0.30 0.12 0.02 0.05 0.12 -0.00 0.00 0.01 0.00 0.00 0.00 0.00 -0.01 -0.01 0.00 0.00 -0.03 0.00 -0.01 -0.00 -0.02 -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 0.00 -0.00 -0.00 -0.00 0.00 0.06 -0.00 0.01 0.11 0.01 0.03 0.00 -0.05 -0.14 0.05 -0.08 -0.20 0.08 -0.02 -0.03 -0.03 -0.02 -0.09 -0.06 -0.18 -0.21 -0.03 -0.01 -0.28 0.06 -0.00 0.32 0.09 0.20 0.24 -0.04 -0.09 -0.25 0.00 -0.01 -0.03 -0.00 -0.01 0.00 0.02 -0.11 -0.14 0.00 0.00 -0.00 -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 -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.14 0.05 0.10 0.03 0.06 0.10 0.08 -0.05 -0.19 -0.05 -0.02 0.02 -0.17 0.07 0.24 -0.15 0.08 -0.01 0.06 0.06 -0.02 0.05 0.01 -0.04 0.07 0.00 0.06 -0.06 0.00 -0.06 -0.05 -0.00 0.04 0.06 -0.08 0.00 -0.03 0.03 0.01 -0.01 0.00 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 0.01 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.03 -0.01 0.00 0.01 0.00 -0.00 -0.00 0.00 0.01 0.01 -0.00 -0.00 0.00 -0.01 -0.00 0.00 -0.01 -0.00 -0.01 0.01 0.19 0.04 0.09 0.22 0.01 0.09 0.16 -0.12 -0.36 -0.18 0.02 0.05 0.23 0.01 -0.05 -0.35 -0.03 -0.29 -0.06 -0.02 0.04 -0.06 -0.01 0.07 -0.23 0.08 -0.03 -0.24 0.09 -0.00 0.02 -0.06 0.04 0.03 0.06 -0.04 0.05 -0.07 0.01 -0.00 -0.01 0.02 0.06 -0.11 0.01 -0.15 0.23 0.03 -0.19 -0.04 -0.03 0.00 -0.06 0.17 0.17 -0.02 -0.06 0.00 0.01 -0.01 -0.10 0.01 -0.05 0.02 -0.01 0.00 0.03 0.02 -0.01 0.01 -0.01 0.02 0.06 0.01 -0.00 0.05 -0.01 -0.04 -0.02 0.02 0.03 0.00 -0.01 0.01 -0.01 -0.03 -0.04 -0.05 -0.01 -0.04 0.00 -0.00 -0.00 0.01 -0.01 0.00 0.01 0.01 -0.01 -0.01 -0.01 0.02 -0.01 0.02 0.01 0.02 -0.00 -0.00 -0.27 0.34 -0.02 -0.27 -0.08 -0.10 -0.03 0.03 0.09 -0.03 -0.06 0.36 -0.03 0.01 0.14 0.28 0.02 -0.12 0.10 0.02 -0.05 0.13 0.02 -0.07 0.15 -0.16 -0.18 0.01 0.05 0.02 -0.01 0.02 0.01 0.07 0.08 -0.03 -0.01 -0.01 -0.03 -0.00 -0.01 -0.02 0.03 -0.07 0.05 0.04 0.03 0.14 0.03 -0.12 -0.04 -0.05 0.04 0.10 -0.05 0.03 0.08 -0.09 -0.03 -0.03 -0.03 -0.00 -0.01 -0.02 -0.01 0.01 -0.02 0.01 -0.00 -0.06 0.00 0.02 -0.06 0.03 0.01 -0.02 -0.00 -0.02 0.08 -0.02 0.01 -0.00 0.02 -0.01 -0.05 0.03 -0.08 0.01 -0.00 0.01 -0.06 0.08 0.01 -0.05 -0.03 -0.04 0.00 -0.02 0.05 0.03 -0.00 -0.01 -0.00 0.01 -0.00 0.03 -0.02 -0.00 0.01 -0.01 -0.00 0.01 0.01 -0.01 0.01 -0.00 0.01 -0.06 -0.08 -0.05 -0.15 0.01 0.15 0.02 -0.06 -0.09 -0.05 -0.00 -0.01 0.02 0.09 0.08 0.21 0.02 0.11 0.05 0.01 -0.01 -0.09 0.03 -0.03 -0.09 0.01 0.03 0.07 0.01 -0.06 0.07 -0.04 0.00 -0.10 -0.01 0.02 -0.08 0.08 0.00 -0.10 -0.03 -0.07 -0.00 -0.02 0.04 0.00 -0.02 0.04 0.00 -0.03 0.07 0.04 0.00 -0.02 0.01 0.00 -0.01 0.04 0.00 -0.02 0.06 -0.07 -0.08 0.00 0.02 0.01 -0.01 0.01 0.01 0.03 0.03 -0.01 -0.00 -0.01 -0.01 -0.00 -0.00 -0.01 0.00 -0.02 0.02 -0.11 -0.08 -0.14 0.04 0.00 -0.03 0.01 -0.17 -0.32 0.21 -0.18 -0.42 0.25 0.12 0.10 0.17 -0.02 0.10 -0.04 0.01 -0.01 -0.04 -0.02 0.02 0.26 0.01 -0.08 0.26 -0.07 -0.04 -0.04 0.00 0.06 0.01 -0.01 0.01 -0.00 0.01 -0.00 0.00 0.01 -0.01 0.00 0.00 0.00 -0.01 0.01 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 0.01 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.03 -0.02 -0.02 -0.03 0.00 0.02 0.01 -0.01 -0.00 -0.00 0.01 0.01 0.01 0.01 0.01 0.02 0.01 0.03 -0.10 0.01 0.01 0.07 -0.01 -0.00 0.06 -0.03 -0.02 -0.13 0.03 0.02 -0.14 0.01 0.01 0.07 -0.00 -0.01 -0.01 0.01 0.00 -0.02 -0.01 -0.02 0.00 -0.01 0.01 0.00 -0.00 0.01 0.00 -0.01 0.01 0.01 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.01 -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 -0.04 -0.02 -0.04 -0.02 0.00 -0.02 0.03 -0.02 -0.05 0.07 -0.04 -0.11 0.03 0.01 0.02 0.04 0.05 -0.01 0.47 -0.09 -0.06 0.50 -0.11 -0.07 0.17 -0.04 -0.02 0.17 -0.06 -0.01 0.57 -0.10 -0.07 0.05 0.15 -0.13 0.03 -0.13 0.04 -0.05 0.01 -0.02 0.00 0.01 0.00 0.09 -0.09 -0.04 -0.08 -0.03 0.16 -0.01 0.02 -0.05 0.00 0.00 0.00 0.03 0.02 -0.02 -0.09 0.03 0.03 -0.00 0.01 0.01 -0.03 -0.02 0.02 -0.00 0.00 -0.01 0.07 0.06 0.01 0.03 -0.03 0.00 -0.04 -0.01 -0.00 -0.01 -0.06 -0.01 -0.01 0.03 -0.01 0.06 -0.01 0.02 0.06 0.01 -0.01 -0.05 0.01 -0.02 -0.04 0.02 0.02 -0.01 0.00 -0.03 -0.00 0.01 0.02 -0.06 -0.01 0.02 0.05 0.10 -0.07 -0.06 -0.00 0.20 -0.01 0.06 -0.06 -0.02 0.02 0.01 -0.02 0.05 -0.08 -0.10 -0.04 0.05 0.01 -0.06 -0.02 0.07 -0.04 -0.04 -0.08 0.28 0.21 -0.04 -0.07 -0.03 0.03 0.01 -0.04 -0.09 -0.08 0.02 0.00 0.02 0.03 0.02 0.00 0.04 -0.02 0.07 -0.05 -0.01 0.12 0.32 0.09 -0.24 -0.07 -0.17 -0.06 -0.03 -0.06 -0.01 0.14 -0.01 0.04 0.02 0.04 -0.08 0.10 0.11 -0.03 -0.02 0.14 -0.03 0.00 0.30 -0.02 -0.06 0.32 -0.03 -0.05 0.27 -0.07 -0.02 -0.05 -0.07 0.04 -0.01 0.06 -0.02 -0.07 -0.00 -0.01 -0.00 -0.01 -0.00 -0.03 0.04 0.03 0.06 0.03 -0.06 0.00 -0.00 0.01 -0.01 -0.00 0.00 -0.01 -0.02 0.02 0.02 -0.02 -0.03 0.00 -0.00 -0.01 0.01 0.01 -0.01 -0.00 0.00 -0.00 0.09 0.03 0.09 0.06 -0.03 -0.03 -0.04 0.02 0.01 0.00 -0.07 -0.07 -0.02 0.02 -0.02 0.04 -0.02 0.00 0.07 0.01 -0.02 -0.05 0.01 -0.02 -0.04 0.03 0.03 -0.01 0.00 -0.03 0.00 0.02 0.02 -0.06 -0.02 0.02 -0.02 -0.05 0.04 0.07 0.02 -0.06 0.00 -0.02 0.01 0.01 -0.00 -0.01 0.01 -0.01 0.01 0.05 0.02 -0.02 -0.00 0.03 0.01 -0.05 0.02 0.03 0.03 -0.16 -0.10 0.02 0.03 0.01 -0.02 -0.01 0.02 0.04 0.03 -0.00 -0.01 -0.01 -0.02 -0.01 0.00 -0.02 0.01 -0.03 0.02 0.15 -0.01 -0.08 0.10 0.16 0.13 -0.14 -0.00 0.01 -0.29 0.16 0.51 -0.06 0.04 0.01 0.04 -0.09 0.12 0.10 -0.04 -0.02 0.13 -0.02 0.01 0.32 -0.02 -0.07 0.33 -0.01 -0.05 0.28 -0.08 -0.03 0.03 0.01 -0.03 -0.00 -0.01 -0.00 -0.05 0.04 -0.01 0.00 0.02 0.00 -0.00 -0.00 -0.01 -0.02 -0.03 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.01 0.02 -0.00 0.02 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.02 -0.01 0.00 -0.05 0.01 0.08 -0.01 -0.01 0.01 0.04 -0.06 -0.14 0.03 0.02 -0.01 0.08 0.03 0.04 -0.10 0.01 0.02 0.04 -0.01 0.00 0.03 -0.03 -0.03 0.00 0.00 0.02 -0.01 -0.03 -0.02 0.06 0.00 -0.01 -0.01 0.04 -0.02 -0.04 -0.03 0.01 0.00 -0.00 0.01 -0.00 0.00 -0.01 0.00 -0.01 0.01 -0.03 -0.01 0.01 -0.00 -0.02 -0.00 0.03 -0.01 -0.02 -0.01 0.05 0.03 -0.00 -0.01 -0.00 0.01 0.01 -0.01 -0.01 -0.01 -0.00 0.00 -0.00 0.01 0.00 -0.00 0.01 -0.00 0.01 -0.00 -0.04 -0.00 -0.03 0.06 -0.01 0.00 -0.02 -0.09 -0.14 -0.29 0.24 0.67 0.10 0.02 0.04 0.14 0.14 -0.02 -0.01 0.01 -0.00 -0.03 -0.01 -0.02 -0.26 0.04 0.05 -0.28 0.00 0.05 -0.25 0.07 0.05 0.01 -0.01 -0.03 -0.03 -0.01 -0.03 0.11 -0.03 0.06 0.00 0.05 0.00 -0.02 -0.02 -0.06 -0.06 -0.06 -0.03 -0.00 -0.01 0.06 0.01 0.01 -0.00 0.00 0.00 -0.04 0.14 0.05 0.12 -0.01 0.01 0.00 0.01 0.02 -0.00 0.01 -0.02 0.02 -0.10 -0.03 -0.07 -0.07 0.07 0.07 0.04 0.01 0.01 0.08 0.04 -0.09 -0.03 -0.04 0.03 -0.12 -0.01 -0.09 0.11 -0.02 -0.01 -0.04 0.01 0.02 -0.03 0.02 0.02 -0.00 -0.01 0.01 0.00 0.02 0.00 -0.06 0.01 0.00 -0.03 0.05 -0.07 -0.14 -0.07 -0.09 0.01 -0.05 0.09 0.01 -0.01 -0.01 0.01 -0.05 0.09 -0.04 -0.01 0.00 0.00 -0.02 -0.01 0.08 -0.02 -0.05 -0.04 0.20 0.13 0.02 -0.02 -0.04 0.07 0.03 -0.05 -0.03 -0.03 -0.00 0.01 -0.01 0.05 0.02 -0.02 0.05 -0.01 0.02 -0.00 -0.10 -0.03 -0.06 -0.08 -0.03 -0.07 0.34 0.00 -0.16 -0.18 0.22 0.35 -0.19 0.02 -0.08 -0.16 -0.13 0.04 -0.01 -0.00 0.03 -0.02 0.02 0.02 0.25 -0.08 -0.02 0.25 -0.02 -0.04 0.25 -0.06 -0.06 -0.10 -0.03 -0.04 -0.07 -0.01 -0.06 -0.07 0.02 -0.04 -0.01 0.06 -0.01 -0.04 -0.05 -0.09 -0.06 -0.03 -0.07 -0.00 -0.02 0.12 0.04 0.01 -0.02 -0.02 -0.03 -0.07 0.23 0.09 0.20 -0.02 0.02 0.01 0.03 0.04 -0.01 0.02 -0.04 0.04 0.08 0.05 0.07 0.08 -0.06 -0.07 -0.02 -0.00 -0.01 -0.05 -0.03 0.08 0.01 0.02 -0.03 0.06 -0.01 0.05 -0.05 0.01 0.01 0.02 -0.00 -0.02 0.01 0.00 -0.00 0.00 0.01 -0.02 0.00 0.00 0.01 0.03 -0.01 0.00 -0.04 0.03 -0.11 -0.18 -0.06 -0.17 0.02 -0.10 0.18 0.02 -0.02 -0.01 0.02 -0.09 0.15 -0.02 -0.01 -0.01 0.03 -0.01 -0.03 0.10 -0.02 -0.06 -0.14 0.36 0.27 0.08 -0.02 -0.08 0.14 0.05 -0.09 -0.05 -0.07 -0.00 0.02 -0.02 0.10 0.04 -0.05 0.11 -0.01 0.03 -0.00 0.11 0.05 0.07 0.06 0.03 0.07 -0.26 0.03 0.18 0.13 -0.17 -0.24 0.09 -0.03 0.05 0.07 0.04 -0.01 0.00 -0.00 -0.02 0.03 -0.01 -0.00 -0.11 0.06 -0.00 -0.09 0.03 0.01 -0.11 0.02 0.03 -0.02 0.03 -0.06 -0.07 -0.05 0.02 -0.00 0.00 -0.00 0.01 -0.11 -0.02 0.11 0.02 0.09 -0.07 0.05 -0.13 0.00 -0.01 -0.03 -0.06 -0.04 0.02 0.07 0.13 0.05 0.10 0.04 0.16 0.05 -0.03 -0.00 -0.07 -0.08 0.03 -0.02 0.05 -0.05 0.02 0.02 -0.02 0.00 -0.00 0.00 -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 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.24 -0.20 0.15 -0.17 0.06 -0.18 -0.00 0.02 -0.06 -0.00 -0.01 0.06 0.00 0.03 -0.08 0.16 0.05 -0.05 -0.08 0.09 0.06 -0.23 0.07 0.10 0.25 -0.35 -0.37 -0.21 -0.03 0.12 -0.19 -0.05 0.08 0.04 0.09 -0.02 -0.01 0.02 -0.10 -0.03 0.07 -0.12 0.01 -0.02 -0.02 -0.00 0.05 0.14 -0.00 -0.12 -0.06 0.00 -0.05 -0.08 0.01 -0.01 0.02 -0.01 0.00 0.00 0.01 -0.00 0.01 0.02 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 0.01 0.02 -0.03 -0.01 -0.02 0.02 -0.01 -0.01 0.00 0.01 -0.00 0.03 -0.00 -0.03 0.06 0.01 -0.04 0.00 0.01 0.03 -0.07 -0.01 -0.01 0.01 -0.13 0.15 -0.10 -0.00 -0.01 0.02 -0.09 0.00 -0.06 0.11 0.08 -0.08 0.04 -0.15 0.19 -0.01 0.04 0.01 -0.00 -0.00 -0.01 0.00 -0.02 -0.00 -0.02 -0.01 0.00 0.01 0.01 0.00 0.00 0.07 -0.03 0.03 -0.00 -0.01 -0.00 0.00 0.04 -0.01 -0.02 -0.02 0.00 -0.01 0.05 -0.01 -0.04 -0.03 -0.01 0.03 -0.01 0.16 -0.17 0.12 0.01 -0.04 0.01 -0.02 0.02 -0.14 -0.04 0.01 -0.11 -0.00 -0.02 0.01 0.03 0.01 -0.00 -0.01 0.03 0.02 -0.04 0.01 0.03 -0.11 -0.24 -0.42 0.19 0.17 -0.04 0.01 0.04 0.01 0.18 0.15 -0.05 0.18 -0.29 0.31 0.07 -0.05 0.06 0.12 -0.14 0.14 -0.01 0.05 0.09 -0.01 -0.04 -0.01 -0.06 -0.00 0.07 -0.01 -0.02 -0.01 0.03 0.10 -0.03 0.02 0.08 -0.02 0.00 0.01 0.04 -0.03 -0.00 -0.02 0.05 -0.08 0.04 0.02 -0.08 0.01 0.06 0.01 -0.02 -0.01 -0.01 0.00 -0.00 0.01 -0.00 -0.04 -0.03 -0.01 -0.01 0.00 -0.01 -0.01 0.01 -0.03 0.01 0.02 -0.01 -0.00 -0.01 0.03 0.00 0.00 -0.00 0.04 -0.06 0.03 0.01 0.00 0.00 0.03 -0.00 0.02 -0.03 -0.02 0.02 -0.01 0.05 -0.06 0.04 0.01 0.03 0.01 -0.02 -0.02 0.00 -0.03 0.02 -0.07 -0.03 0.00 0.03 0.04 0.01 0.02 0.26 -0.12 0.10 0.00 -0.02 0.00 0.00 0.16 -0.03 -0.09 -0.08 0.01 -0.05 0.20 -0.04 -0.16 -0.11 -0.03 0.10 -0.04 -0.05 0.04 -0.04 0.01 0.03 -0.01 0.01 -0.01 0.06 0.02 -0.01 0.03 0.00 0.00 0.01 -0.00 -0.00 -0.00 0.01 -0.01 -0.01 0.01 -0.00 -0.01 0.03 0.08 0.15 -0.05 -0.06 0.01 0.00 -0.01 -0.01 -0.06 -0.05 0.02 -0.06 0.10 -0.10 -0.02 0.01 -0.01 -0.04 0.05 -0.05 0.07 0.01 0.04 0.03 -0.00 0.02 -0.05 -0.07 -0.03 -0.09 -0.06 -0.08 0.07 0.40 -0.14 0.09 0.32 -0.06 -0.01 0.03 0.14 -0.14 -0.01 -0.07 0.13 -0.31 0.15 0.03 -0.30 0.03 0.19 0.05 -0.07 -0.00 0.02 0.01 -0.02 -0.01 0.04 0.00 -0.00 -0.01 -0.03 -0.04 -0.03 0.01 -0.02 0.03 0.03 0.14 -0.05 -0.01 -0.02 0.04 0.03 -0.02 -0.03 -0.02 -0.06 -0.04 -0.04 0.00 0.01 -0.02 0.01 -0.00 0.02 0.03 -0.01 0.00 -0.03 0.03 0.03 -0.03 -0.04 0.01 0.00 0.00 -0.03 0.02 0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 0.01 -0.02 -0.01 -0.01 0.00 0.00 -0.05 0.01 0.01 0.06 -0.01 -0.00 -0.05 0.01 0.00 0.05 -0.00 -0.00 0.00 -0.01 0.00 0.09 -0.10 0.06 0.00 0.17 -0.05 0.01 -0.03 0.07 0.02 -0.01 0.04 0.01 -0.00 -0.00 0.14 0.03 -0.03 0.08 0.05 -0.01 -0.09 0.04 0.05 -0.14 0.17 0.17 0.08 0.01 -0.05 0.08 0.02 -0.04 -0.04 -0.05 0.01 0.02 -0.03 0.06 0.01 -0.03 0.04 -0.01 0.01 0.01 0.02 -0.01 0.05 -0.00 -0.08 -0.06 0.15 -0.14 -0.38 0.00 -0.00 0.01 -0.03 0.01 -0.00 0.03 -0.02 0.05 0.37 -0.08 -0.05 -0.35 0.07 0.04 0.34 -0.06 -0.05 -0.35 0.08 0.04 -0.02 -0.00 0.00 0.01 0.02 0.01 -0.02 -0.01 0.04 0.00 -0.00 0.00 -0.03 -0.05 -0.03 0.02 -0.01 0.05 0.02 0.14 -0.06 -0.01 -0.02 0.03 0.02 -0.02 -0.02 -0.01 -0.06 -0.04 -0.04 -0.00 0.01 -0.02 0.01 -0.00 0.01 0.03 -0.00 0.00 -0.02 0.02 0.03 -0.04 -0.05 -0.02 0.01 0.03 0.01 -0.01 -0.02 0.01 -0.00 -0.01 -0.00 0.00 0.00 -0.00 0.01 -0.00 0.00 0.00 0.00 0.06 -0.01 -0.00 -0.07 0.01 0.01 0.06 -0.01 -0.00 -0.06 0.01 0.00 0.00 0.00 -0.00 0.10 -0.09 0.08 -0.02 0.17 -0.07 0.01 -0.03 0.06 0.01 -0.01 0.04 0.00 0.00 -0.01 0.16 0.03 -0.04 0.06 0.06 -0.00 -0.11 0.04 0.06 -0.14 0.18 0.18 0.06 -0.01 -0.05 0.09 0.02 -0.04 -0.05 -0.06 0.02 0.02 -0.02 0.06 0.01 -0.02 0.05 -0.00 0.01 -0.00 0.00 -0.02 0.02 0.02 -0.07 -0.06 -0.02 0.02 0.06 -0.03 0.02 0.04 -0.00 0.01 -0.00 -0.01 0.00 -0.01 -0.40 0.08 0.05 0.42 -0.08 -0.05 -0.41 0.07 0.06 0.38 -0.09 -0.05 -0.02 0.01 0.00 -0.02 -0.04 0.04 0.03 0.03 -0.05 -0.01 -0.00 0.00 0.05 -0.08 0.02 0.06 0.06 0.16 -0.08 -0.02 0.04 0.01 0.01 -0.10 -0.06 -0.02 0.03 0.06 0.00 -0.14 0.02 0.02 -0.04 -0.00 0.02 0.01 -0.03 -0.00 0.03 0.00 -0.03 0.01 0.01 -0.05 0.01 -0.00 0.00 0.01 0.02 0.00 -0.03 -0.00 0.01 -0.01 0.00 -0.00 -0.00 -0.01 0.01 0.01 0.01 0.00 -0.00 -0.01 0.00 0.00 0.01 -0.01 -0.00 -0.01 0.00 0.00 0.01 -0.01 -0.00 -0.00 0.00 0.00 0.10 0.30 0.14 -0.29 -0.17 -0.19 -0.03 0.08 -0.19 -0.02 0.01 0.01 -0.04 0.06 -0.08 0.06 0.02 -0.02 -0.13 0.04 0.06 -0.13 0.04 0.05 -0.13 0.45 0.25 -0.06 -0.10 -0.04 0.10 0.04 -0.09 -0.12 -0.10 -0.00 0.03 -0.01 0.09 0.04 -0.02 0.07 0.00 0.07 -0.05 0.02 -0.07 -0.17 0.05 0.12 0.06 -0.06 0.12 0.24 -0.03 0.02 0.00 0.04 -0.01 0.00 -0.02 0.02 -0.03 0.05 -0.01 -0.01 -0.10 0.02 0.01 0.09 -0.02 -0.01 -0.06 0.00 0.01 0.03 -0.00 -0.00 0.02 0.02 -0.02 -0.01 -0.02 0.03 -0.00 0.01 0.02 -0.02 0.00 -0.01 -0.00 -0.01 -0.02 0.02 0.05 -0.03 -0.00 -0.01 0.03 0.01 -0.00 -0.01 -0.01 -0.02 0.02 -0.01 -0.01 0.02 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.01 -0.01 -0.01 -0.01 -0.02 -0.04 0.02 0.05 0.05 -0.04 -0.11 0.01 -0.00 -0.03 0.00 -0.01 -0.01 -0.02 0.01 0.03 0.01 -0.00 0.00 -0.01 -0.00 -0.01 0.03 -0.01 -0.01 -0.03 0.01 -0.00 0.02 -0.01 -0.00 -0.01 0.01 0.00 0.01 -0.09 -0.00 0.04 0.09 0.02 0.01 -0.03 0.06 0.01 -0.01 0.01 0.01 -0.01 0.01 0.04 0.01 -0.01 0.04 0.01 -0.01 -0.01 0.01 0.01 0.00 -0.05 -0.00 0.01 0.01 0.00 -0.01 -0.01 0.01 0.01 0.00 0.00 -0.01 0.01 -0.02 -0.01 -0.00 0.00 -0.00 -0.01 -0.00 -0.05 0.00 0.01 0.04 -0.03 -0.03 -0.31 0.30 0.76 -0.04 0.04 0.08 0.11 -0.07 0.02 -0.07 0.03 -0.11 0.08 -0.02 -0.02 -0.21 0.04 0.02 0.20 -0.03 -0.03 -0.11 0.01 0.02 0.10 -0.01 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 -0.01 0.01 0.00 0.01 -0.01 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.00 -0.00 -0.01 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.01 0.02 0.01 0.00 -0.01 -0.01 -0.01 -0.00 0.04 -0.00 -0.00 -0.00 0.03 -0.02 -0.04 -0.03 0.02 0.09 -0.01 0.00 0.02 0.07 -0.03 -0.04 0.08 -0.02 -0.02 0.00 0.01 -0.02 -0.02 0.00 0.00 -0.08 0.02 0.02 0.01 -0.01 0.01 0.01 -0.00 -0.01 -0.00 -0.00 -0.01 -0.00 0.00 -0.01 -0.00 -0.01 0.01 0.01 0.00 -0.01 -0.02 0.01 0.01 -0.01 0.01 0.00 -0.01 0.02 0.02 0.01 -0.00 -0.00 0.01 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 0.02 0.04 -0.03 -0.02 -0.00 0.08 -0.09 -0.18 0.04 -0.01 0.02 0.20 -0.23 0.07 -0.07 0.16 -0.24 -0.47 0.09 0.01 -0.47 0.09 0.04 0.02 0.04 -0.02 0.14 -0.04 -0.00 0.48 -0.08 -0.02 0.12 -0.05 -0.13 -0.05 -0.01 0.08 0.03 0.03 0.00 0.06 -0.00 0.03 -0.09 0.15 0.04 0.12 -0.07 -0.12 0.02 0.04 -0.04 -0.05 -0.03 0.04 0.02 -0.10 -0.04 0.01 -0.15 0.00 0.00 0.01 0.02 -0.00 0.02 0.02 0.00 0.01 -0.02 -0.14 0.23 0.10 -0.02 0.00 -0.04 -0.02 -0.08 0.02 -0.00 0.02 0.01 -0.00 -0.01 0.02 0.00 -0.02 -0.02 0.00 -0.01 -0.00 -0.02 0.01 0.01 -0.02 0.01 0.01 -0.00 0.00 -0.00 0.01 0.01 0.00 0.02 -0.01 -0.00 0.08 -0.12 0.12 0.06 -0.03 -0.13 -0.03 -0.04 -0.13 -0.04 0.01 -0.18 -0.02 -0.09 0.14 0.13 0.05 -0.09 -0.19 0.09 0.08 -0.12 0.07 0.02 -0.05 0.28 0.28 0.01 -0.05 -0.04 0.11 0.03 -0.06 -0.09 -0.09 0.01 -0.03 0.06 -0.02 -0.00 -0.02 0.05 -0.03 0.05 -0.03 -0.04 0.22 0.34 -0.20 -0.11 -0.00 -0.08 -0.09 0.03 0.09 -0.01 -0.01 -0.06 0.04 -0.01 0.01 -0.05 0.07 0.12 -0.03 -0.01 0.11 -0.02 -0.01 0.00 -0.00 -0.00 -0.04 0.02 0.00 -0.12 0.02 0.01 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.07 -0.12 0.09 0.00 -0.00 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 0.00 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 0.03 -0.01 -0.11 0.05 -0.02 0.01 0.03 -0.01 0.00 0.01 -0.12 -0.02 0.08 0.16 0.09 0.00 0.01 -0.06 -0.01 -0.03 -0.06 0.00 -0.03 -0.00 0.01 -0.01 -0.00 -0.03 -0.01 0.05 0.00 0.01 0.01 -0.03 0.01 0.03 -0.01 0.01 -0.00 0.00 -0.01 -0.00 0.00 -0.01 -0.00 -0.00 0.00 0.01 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 -0.01 0.00 0.01 0.01 -0.01 -0.01 -0.00 0.01 0.01 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.01 0.00 0.01 -0.00 0.00 0.01 -0.01 0.03 0.00 0.01 -0.02 -0.01 -0.01 -0.21 -0.07 -0.22 -0.25 0.06 -0.13 0.37 -0.32 0.12 -0.17 0.19 -0.38 0.24 -0.07 -0.07 0.27 -0.07 -0.07 0.04 0.06 -0.01 -0.01 -0.07 0.03 -0.22 0.08 0.11 0.02 -0.01 -0.01 -0.00 0.00 0.01 -0.09 0.13 -0.08 0.00 0.01 -0.04 0.02 -0.04 0.01 0.03 0.03 0.02 0.00 -0.01 0.04 -0.02 0.01 -0.02 0.01 0.03 -0.01 -0.01 -0.02 -0.02 0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 -0.00 0.01 -0.02 0.01 0.02 0.00 -0.03 0.01 0.11 -0.04 0.09 -0.02 -0.05 0.01 0.06 -0.06 -0.02 -0.12 0.04 0.05 0.09 -0.01 -0.00 -0.05 -0.00 -0.01 -0.06 0.01 -0.00 -0.01 0.00 -0.00 -0.00 -0.01 -0.01 0.04 0.00 0.00 -0.13 0.19 -0.06 -0.23 -0.04 -0.18 -0.01 -0.01 0.03 -0.01 -0.02 0.04 -0.01 -0.02 0.06 -0.05 -0.00 0.07 0.10 -0.00 -0.02 -0.08 -0.01 0.07 0.00 -0.03 -0.05 -0.02 -0.00 0.01 -0.02 -0.00 0.01 0.01 0.02 -0.01 0.01 -0.01 0.01 0.00 0.01 -0.02 0.01 -0.01 0.01 -0.03 0.01 0.01 -0.01 -0.00 0.01 0.42 0.02 0.08 0.27 -0.07 0.16 0.15 -0.24 0.03 -0.24 0.08 -0.28 0.22 -0.05 -0.05 0.26 -0.06 -0.04 0.07 0.01 -0.01 0.01 -0.02 0.01 -0.22 0.06 0.05 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.01 0.01 -0.01 -0.02 0.00 0.02 -0.02 0.01 0.01 -0.01 -0.01 0.01 -0.01 0.01 -0.01 0.03 -0.01 -0.01 0.00 -0.01 -0.00 -0.00 0.01 0.00 -0.02 -0.05 0.05 0.11 -0.00 0.04 -0.11 0.01 -0.05 0.00 -0.01 -0.00 0.00 -0.00 0.00 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 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.07 -0.11 0.04 0.08 0.01 0.07 0.02 -0.03 0.06 0.02 0.02 -0.07 0.02 -0.00 -0.05 0.06 0.01 -0.04 -0.01 0.01 -0.00 0.03 0.01 -0.03 0.03 0.02 0.02 -0.37 -0.17 0.08 0.15 0.29 -0.21 0.14 0.21 -0.25 0.20 -0.22 0.29 0.08 0.29 -0.23 0.10 0.23 -0.28 -0.00 -0.01 -0.01 0.01 0.00 0.00 0.03 0.01 0.01 0.02 -0.01 0.01 0.00 -0.01 -0.00 -0.01 0.00 -0.01 0.01 -0.00 -0.00 0.01 -0.00 -0.00 0.01 -0.00 -0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 -0.03 0.01 0.01 0.00 -0.01 -0.01 -0.04 0.04 -0.03 -0.01 -0.03 0.08 -0.03 0.08 -0.01 -0.07 -0.05 -0.04 -0.02 0.02 -0.09 0.06 -0.01 0.03 -0.01 -0.05 0.01 0.02 0.05 0.03 0.00 0.01 -0.01 -0.02 0.02 -0.01 0.02 0.00 0.00 0.02 -0.04 -0.03 0.01 -0.01 0.01 0.05 0.01 0.03 -0.01 -0.03 0.00 0.02 -0.02 -0.01 -0.04 0.01 0.01 0.03 -0.00 -0.00 -0.02 0.00 -0.00 -0.02 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.01 -0.00 -0.00 0.26 -0.36 0.12 0.46 0.12 0.39 0.03 0.01 -0.00 0.04 0.04 -0.08 0.03 0.05 -0.16 0.11 0.00 -0.14 -0.20 -0.00 0.03 0.19 0.02 -0.16 -0.01 0.05 0.10 0.13 0.05 -0.04 0.01 -0.07 0.04 -0.06 -0.08 0.07 -0.06 0.07 -0.08 -0.03 -0.09 0.07 -0.04 -0.04 0.06 -0.01 -0.03 -0.04 0.03 -0.01 -0.02 0.16 0.04 0.03 0.09 -0.03 0.07 0.04 -0.07 0.01 -0.07 0.02 -0.08 0.06 -0.01 -0.02 0.08 -0.02 -0.01 0.02 0.00 -0.00 0.00 -0.01 0.00 -0.07 0.02 0.01 0.02 -0.01 -0.01 0.00 0.00 0.00 0.01 -0.00 0.00 -0.07 0.00 0.03 0.01 -0.04 0.02 0.03 0.02 0.03 -0.10 0.03 -0.01 0.09 -0.04 0.02 0.02 0.04 -0.02 -0.01 -0.02 -0.02 0.01 0.01 -0.01 -0.02 -0.02 -0.00 0.01 0.00 0.01 -0.02 0.01 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 -0.06 0.15 -0.02 -0.21 -0.08 -0.18 0.11 -0.19 0.47 0.19 0.11 -0.35 0.19 0.00 -0.31 0.26 0.03 -0.24 -0.27 0.07 0.06 0.12 0.09 -0.18 0.03 -0.01 -0.05 -0.02 0.00 0.02 -0.05 -0.03 0.03 0.01 0.01 0.01 -0.02 0.02 -0.05 -0.01 -0.02 -0.00 0.00 -0.05 0.05 -0.01 0.01 -0.02 0.00 0.03 0.03 -0.01 -0.00 -0.00 -0.01 0.01 -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 0.01 -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 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -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 -0.01 -0.00 0.01 0.02 -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 -0.09 0.02 0.01 0.08 -0.02 -0.01 0.08 -0.02 -0.01 -0.10 0.02 0.01 0.02 -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 0.01 0.00 0.00 0.00 0.01 0.00 -0.00 -0.01 0.00 0.01 0.00 -0.01 -0.01 -0.00 -0.01 -0.00 0.01 0.00 -0.01 -0.01 -0.01 0.00 -0.00 0.00 0.00 0.00 -0.01 0.01 -0.01 0.01 -0.00 -0.04 -0.00 -0.03 0.02 0.03 0.02 0.03 0.04 0.02 -0.00 -0.01 0.00 0.00 0.01 -0.00 0.00 -0.01 0.01 0.48 -0.10 -0.05 -0.45 0.09 0.05 -0.42 0.09 0.05 0.54 -0.11 -0.06 -0.11 0.02 0.01 0.08 0.00 -0.11 -0.01 -0.02 0.02 -0.01 -0.04 0.01 -0.04 0.00 -0.02 0.00 0.01 0.03 -0.03 0.02 0.01 -0.01 -0.00 0.02 0.01 -0.00 -0.05 0.01 0.00 -0.01 0.01 -0.02 0.01 0.01 0.00 -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 -0.12 -0.06 0.15 0.04 -0.07 -0.02 0.04 0.18 -0.03 -0.02 -0.05 0.02 -0.02 0.03 -0.02 0.01 0.01 0.00 -0.01 0.01 0.00 0.01 0.00 0.00 -0.01 0.00 -0.01 -0.01 -0.00 0.01 0.02 -0.01 -0.01 -0.01 -0.00 0.00 0.13 -0.11 0.07 0.05 0.11 0.13 0.00 -0.02 0.04 -0.00 -0.00 0.01 -0.00 -0.01 0.01 0.02 0.01 0.08 0.24 0.01 -0.05 -0.10 -0.02 0.11 -0.01 0.02 0.01 -0.01 -0.00 0.01 -0.01 -0.01 0.01 0.00 0.00 0.00 -0.01 0.01 -0.02 -0.01 -0.01 0.00 -0.00 -0.02 0.02 -0.38 -0.03 -0.41 0.26 0.35 0.25 0.26 0.24 -0.05 -0.07 -0.06 -0.06 -0.00 0.00 0.00 0.01 0.01 0.00 -0.08 0.02 0.01 0.06 -0.01 -0.02 0.03 -0.01 0.00 -0.10 0.01 0.01 0.06 -0.02 -0.00 -0.05 0.11 0.03 -0.03 -0.02 0.05 -0.02 -0.04 0.00 0.10 -0.00 0.02 -0.04 0.01 -0.07 0.11 -0.05 -0.05 0.04 0.04 -0.01 -0.05 -0.03 0.10 -0.01 -0.01 0.02 -0.04 -0.03 0.01 -0.01 -0.01 0.01 0.01 0.02 0.00 -0.00 -0.01 -0.02 0.01 -0.06 -0.10 0.05 -0.02 0.06 0.06 0.19 -0.05 -0.00 -0.15 0.05 -0.02 0.04 -0.02 0.00 0.01 -0.00 -0.00 0.01 -0.00 0.01 0.01 0.00 -0.01 0.00 -0.01 0.00 -0.00 0.01 0.01 -0.01 -0.01 -0.01 -0.01 0.01 -0.21 0.13 -0.13 -0.19 -0.15 -0.30 -0.04 -0.04 -0.16 -0.07 -0.00 -0.16 -0.01 -0.11 0.21 0.10 0.02 -0.19 -0.47 0.07 0.14 0.00 0.09 -0.12 0.04 -0.05 -0.02 0.03 -0.01 -0.03 0.07 0.03 -0.04 -0.02 -0.03 0.00 -0.00 0.02 0.03 0.03 -0.01 0.05 -0.02 0.08 -0.06 -0.17 0.01 0.02 -0.03 -0.08 -0.10 0.12 0.22 -0.05 0.05 -0.16 0.10 -0.01 -0.00 -0.00 -0.01 -0.00 -0.00 -0.02 0.02 0.00 0.03 -0.00 -0.01 -0.03 0.01 0.01 -0.07 0.01 0.00 0.07 -0.02 -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 0.00 -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 0.01 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 -0.01 0.00 0.00 0.00 -0.00 0.00 -0.05 0.01 0.01 -0.02 0.01 -0.01 0.09 -0.02 -0.01 0.07 -0.01 -0.01 -0.09 0.01 0.01 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 0.01 -0.01 -0.01 -0.00 0.01 0.01 -0.01 -0.00 0.01 -0.00 0.00 -0.01 0.03 0.02 -0.00 0.01 0.01 -0.03 -0.01 0.02 0.03 0.02 -0.01 0.01 -0.02 -0.01 -0.01 0.02 -0.03 0.02 -0.03 0.02 0.02 0.00 0.02 -0.01 -0.01 -0.01 0.00 -0.01 0.02 0.01 0.00 0.00 0.01 -0.01 0.00 -0.02 0.00 -0.02 0.32 -0.06 -0.03 0.19 -0.04 -0.03 -0.54 0.11 0.07 -0.43 0.08 0.06 0.55 -0.12 -0.06 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 0.01 -0.00 0.00 0.01 -0.00 0.01 0.00 0.01 -0.00 -0.01 -0.01 0.03 0.02 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.02 0.07 0.06 0.02 -0.08 -0.07 0.00 -0.00 0.01 -0.00 0.00 -0.01 -0.00 -0.02 0.01 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 0.01 0.01 -0.00 0.00 -0.01 0.01 0.00 -0.00 0.01 -0.00 -0.00 -0.01 -0.01 0.01 0.01 -0.00 0.01 0.00 0.01 0.02 0.00 -0.02 0.02 0.00 0.01 -0.04 0.02 -0.01 -0.00 0.03 0.00 0.00 0.04 0.01 -0.01 -0.02 0.00 0.02 0.10 -0.29 -0.26 0.04 -0.13 -0.12 0.34 0.10 -0.19 -0.30 -0.26 0.05 -0.05 0.16 0.14 0.12 -0.17 0.39 -0.18 0.34 -0.24 0.01 -0.00 -0.01 0.02 0.02 0.01 0.00 -0.02 -0.00 -0.00 0.02 -0.01 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.02 0.01 0.00 0.02 0.00 -0.01 -0.03 0.01 0.01 -0.05 0.01 0.00 0.04 -0.02 -0.00 0.00 0.01 -0.01 -0.00 -0.00 0.00 0.00 -0.01 0.00 0.01 -0.00 0.00 0.01 0.00 -0.01 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 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.01 0.00 0.00 -0.01 -0.01 -0.00 -0.01 0.01 0.00 -0.01 -0.00 0.00 0.01 -0.00 -0.01 0.00 -0.00 0.00 0.02 0.01 0.01 0.02 -0.03 -0.00 0.02 -0.01 -0.09 -0.29 -0.24 0.03 -0.06 0.38 0.01 -0.01 0.05 -0.00 -0.03 -0.03 0.05 0.36 -0.14 -0.02 0.02 -0.02 -0.01 0.01 -0.01 -0.00 0.01 -0.01 -0.00 -0.00 0.02 -0.00 0.01 -0.01 -0.01 -0.00 -0.02 -0.05 -0.00 0.01 0.02 0.00 -0.02 0.01 -0.05 -0.03 0.03 -0.00 -0.02 0.04 0.00 -0.02 -0.03 -0.03 0.01 -0.00 0.02 0.03 0.02 -0.02 0.05 -0.02 0.05 -0.04 -0.03 -0.01 -0.04 0.03 0.03 0.02 -0.00 0.00 -0.01 -0.03 0.00 -0.02 -0.07 0.01 -0.02 0.04 0.01 0.05 -0.05 -0.30 -0.27 0.05 -0.04 0.40 -0.05 -0.01 0.04 -0.06 -0.01 -0.01 0.12 0.36 -0.16 -0.03 0.01 0.03 0.01 0.01 -0.01 -0.00 -0.00 -0.00 -0.05 0.03 0.00 -0.07 -0.01 0.01 0.02 -0.08 0.06 0.00 0.08 0.03 0.01 -0.05 -0.09 0.03 0.04 -0.06 -0.01 0.01 -0.01 0.04 0.01 0.00 -0.02 -0.03 0.03 0.04 0.02 -0.00 0.02 -0.00 -0.05 0.01 0.01 0.02 0.01 0.01 -0.01 0.00 -0.03 0.01 -0.00 0.01 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.01 -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 0.16 -0.22 0.10 0.05 -0.11 0.05 -0.03 -0.17 -0.00 -0.06 0.03 -0.37 0.02 -0.20 0.30 0.25 0.06 0.07 0.37 0.12 -0.05 -0.34 0.04 0.25 0.05 0.10 -0.02 -0.15 -0.08 0.05 -0.02 0.03 -0.02 -0.00 0.02 -0.04 -0.08 0.10 -0.15 -0.04 -0.08 0.04 -0.03 -0.08 0.10 0.05 0.00 0.07 -0.07 -0.08 -0.07 -0.03 0.00 -0.00 0.03 -0.03 0.04 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.01 0.00 -0.00 0.01 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.01 0.01 -0.01 -0.01 0.08 -0.03 -0.01 -0.03 0.03 -0.02 0.02 -0.01 0.05 -0.00 0.01 -0.02 -0.01 -0.07 0.02 -0.00 0.00 0.05 0.06 0.01 -0.03 -0.06 0.04 -0.01 -0.01 0.02 -0.04 0.03 0.02 -0.01 -0.01 0.01 0.01 0.00 -0.01 -0.00 0.01 -0.00 0.07 -0.12 0.08 -0.03 -0.02 -0.06 -0.02 -0.12 0.05 0.01 0.17 -0.05 0.02 -0.04 0.02 -0.01 -0.00 -0.00 0.01 -0.00 -0.00 -0.00 0.01 0.01 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.03 -0.02 -0.08 -0.09 0.01 -0.05 -0.05 -0.06 -0.19 -0.10 -0.01 -0.20 -0.03 -0.16 0.32 0.25 0.05 -0.15 -0.23 0.12 0.10 -0.16 0.11 -0.00 0.02 0.00 0.03 0.03 0.03 0.00 -0.03 -0.01 0.02 0.03 0.02 -0.00 -0.00 -0.00 -0.02 -0.01 0.02 -0.04 0.01 -0.02 0.01 -0.12 -0.08 -0.30 0.38 0.24 0.18 0.05 -0.12 0.03 -0.13 0.19 -0.15 0.01 0.00 -0.00 -0.00 0.01 -0.01 0.02 -0.00 0.01 0.01 -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 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 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 0.01 0.00 -0.01 -0.01 0.00 0.00 -0.03 0.01 -0.00 0.03 -0.01 -0.01 0.02 -0.09 0.02 0.07 0.06 0.03 0.04 0.19 -0.04 -0.09 -0.16 -0.02 -0.12 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 0.01 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 0.01 -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 0.02 0.01 0.00 -0.01 -0.04 0.01 -0.01 -0.05 0.01 0.01 0.23 -0.36 0.08 0.39 0.10 0.11 0.42 0.25 -0.03 0.16 -0.48 -0.02 -0.14 0.04 0.03 -0.08 0.00 0.03 0.02 -0.05 0.01 0.00 0.00 0.01 0.00 -0.01 0.08 0.00 -0.05 -0.10 0.03 0.05 0.02 0.04 0.02 -0.02 -0.09 -0.01 0.01 -0.04 0.09 0.01 0.03 -0.02 -0.03 -0.02 0.02 -0.02 0.04 -0.07 -0.07 -0.02 -0.00 -0.04 0.05 -0.00 0.00 0.01 0.01 0.00 0.02 -0.01 -0.01 -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 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.06 0.22 -0.09 -0.04 0.20 0.22 -0.02 -0.08 -0.05 -0.04 0.01 -0.18 0.00 -0.11 0.20 0.33 0.06 -0.10 -0.05 0.14 0.06 -0.28 0.11 0.09 0.10 -0.06 0.06 0.34 0.20 -0.08 -0.08 -0.16 0.12 0.01 -0.06 0.14 0.11 -0.15 0.20 0.05 0.15 -0.09 0.05 0.12 -0.15 0.10 0.00 0.06 -0.14 -0.05 -0.03 -0.02 0.02 -0.00 0.04 -0.05 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 -0.03 0.05 0.01 -0.01 -0.01 0.01 -0.01 -0.00 -0.00 -0.00 0.01 0.00 -0.01 0.08 -0.00 0.07 -0.08 0.02 -0.05 -0.02 -0.00 -0.01 0.03 -0.04 0.06 -0.02 0.03 -0.01 -0.01 0.01 -0.00 -0.02 0.02 -0.04 0.05 -0.06 -0.07 -0.02 -0.01 0.03 -0.03 -0.01 0.00 -0.00 -0.00 0.00 -0.01 0.01 0.01 0.02 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.28 -0.24 0.11 -0.21 -0.24 -0.27 0.04 -0.01 0.19 0.09 0.03 0.03 0.04 0.07 -0.20 -0.12 -0.01 0.13 0.22 -0.03 -0.07 -0.03 -0.05 0.08 0.20 0.05 0.07 0.34 0.17 -0.10 -0.05 -0.18 0.11 -0.05 -0.11 0.16 0.11 -0.15 0.18 0.04 0.14 -0.09 0.06 0.11 -0.15 -0.05 -0.00 -0.02 0.07 0.02 0.00 -0.01 -0.01 0.00 -0.02 0.02 -0.01 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 -0.01 -0.00 0.00 0.00 -0.00 -0.01 -0.00 -0.01 -0.03 0.06 0.00 -0.02 0.00 0.02 -0.02 -0.01 -0.00 0.01 -0.03 -0.01 0.04 -0.00 0.07 -0.01 -0.04 -0.08 -0.03 0.04 0.02 -0.01 0.03 -0.03 0.03 -0.01 -0.02 0.03 -0.08 0.00 -0.02 0.08 0.06 0.00 -0.05 -0.05 -0.00 -0.06 -0.03 0.02 -0.02 -0.01 -0.00 -0.00 -0.00 -0.00 -0.01 0.01 0.02 0.03 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.01 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 -0.30 0.40 -0.06 0.41 0.03 0.21 0.01 -0.13 0.13 0.03 0.04 -0.22 0.07 -0.08 0.03 -0.11 -0.01 0.08 0.13 -0.05 -0.05 -0.01 -0.05 0.06 -0.02 0.03 0.02 0.00 0.13 0.09 -0.25 -0.07 0.13 0.18 0.14 0.01 0.00 0.06 0.17 0.11 -0.03 0.18 -0.09 0.21 -0.16 -0.09 0.03 0.01 0.02 0.03 0.01 0.01 -0.01 -0.01 0.02 0.03 -0.00 0.01 0.01 0.00 -0.00 0.00 -0.01 0.00 0.02 -0.02 -0.00 -0.02 0.00 -0.00 -0.02 0.00 0.01 0.01 -0.01 -0.01 -0.01 -0.03 0.02 -0.04 -0.00 0.01 -0.00 -0.01 0.01 0.01 0.00 -0.01 0.02 0.01 -0.04 0.00 -0.04 0.01 0.03 0.05 0.02 -0.03 -0.01 0.01 -0.01 0.02 -0.01 -0.02 -0.01 -0.02 0.05 -0.00 -0.03 0.10 0.10 0.03 -0.08 -0.06 0.04 -0.06 -0.06 -0.01 0.01 0.01 -0.00 0.00 -0.00 -0.00 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 0.01 -0.00 -0.01 -0.00 0.00 0.01 -0.01 -0.00 0.00 -0.01 -0.00 -0.01 -0.01 0.00 0.00 0.01 0.21 -0.28 0.05 -0.26 -0.03 -0.15 -0.01 0.09 -0.09 -0.02 -0.03 0.15 -0.05 0.06 -0.02 0.06 0.01 -0.05 -0.08 0.03 0.03 0.02 0.03 -0.04 0.00 0.01 0.00 -0.10 0.13 0.17 -0.33 -0.03 0.14 0.30 0.25 -0.05 -0.08 0.19 0.08 0.09 -0.16 0.33 -0.19 0.24 -0.14 0.06 -0.02 -0.01 -0.01 -0.02 -0.00 0.02 0.01 -0.00 0.00 -0.02 0.00 -0.01 -0.00 -0.00 0.01 0.00 0.01 -0.00 -0.04 0.03 0.01 0.06 -0.00 0.01 0.03 -0.00 0.00 -0.02 0.01 0.01 0.02 0.06 -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 0.01 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 -0.01 0.00 0.00 -0.01 -0.01 -0.00 0.01 0.00 -0.01 0.00 0.01 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 -0.00 -0.00 0.00 0.00 -0.02 -0.01 0.02 0.01 -0.01 -0.04 0.01 0.03 0.05 -0.02 -0.11 0.00 0.01 0.09 -0.08 -0.00 0.03 -0.07 -0.02 -0.08 -0.04 0.02 0.03 0.08 -0.03 0.05 -0.01 0.05 -0.00 0.02 0.00 -0.02 0.02 0.01 0.01 -0.03 0.01 -0.01 0.00 -0.02 -0.00 0.01 0.02 -0.01 -0.01 -0.00 -0.01 0.01 0.00 0.00 0.00 0.02 -0.00 -0.02 0.02 -0.00 -0.01 -0.03 -0.02 0.01 0.01 -0.02 0.00 -0.00 0.02 -0.03 0.02 -0.01 0.00 -0.00 0.00 0.01 0.01 0.00 0.00 0.07 0.03 0.03 0.02 0.00 0.01 -0.14 -0.04 -0.02 0.07 0.01 0.06 -0.05 -0.36 0.30 0.08 0.44 -0.04 0.05 0.25 -0.04 -0.03 -0.23 0.14 0.11 0.20 0.53 -0.00 0.01 -0.00 0.01 0.01 -0.01 -0.12 -0.09 -0.02 0.00 -0.01 -0.00 0.00 0.01 -0.02 -0.01 0.01 0.02 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.02 -0.01 0.01 0.02 -0.04 -0.01 -0.01 -0.01 -0.00 0.01 0.00 0.00 0.01 0.01 -0.00 0.01 0.02 -0.00 -0.02 0.03 -0.02 -0.10 0.04 -0.06 0.20 0.09 0.05 -0.09 -0.14 0.01 0.03 0.00 0.02 0.02 0.02 -0.02 -0.00 0.00 0.01 -0.00 0.00 0.01 -0.00 -0.01 0.01 -0.00 -0.01 0.00 0.00 0.01 -0.01 0.13 -0.04 0.02 -0.16 0.10 0.03 -0.00 -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 0.00 0.01 0.00 -0.01 -0.01 -0.01 0.01 -0.01 -0.01 0.00 0.02 0.02 -0.02 0.01 0.01 -0.02 -0.01 0.02 -0.03 -0.01 -0.02 0.01 -0.00 -0.02 0.02 0.04 0.02 0.04 -0.06 0.02 0.00 0.26 0.19 0.04 0.65 0.06 0.28 0.20 0.21 -0.00 0.20 0.23 -0.01 0.00 -0.02 0.04 0.01 -0.03 0.00 -0.01 -0.05 0.00 0.00 -0.03 0.03 -0.00 0.00 -0.02 0.03 -0.06 -0.00 -0.02 -0.04 0.04 0.04 0.03 0.00 -0.01 0.07 0.03 -0.04 -0.06 0.04 0.03 -0.01 -0.06 0.01 -0.03 -0.01 0.00 -0.03 -0.01 0.07 0.04 -0.04 -0.09 0.17 0.03 0.04 0.01 -0.00 -0.04 0.01 -0.01 -0.03 -0.01 0.01 0.01 0.00 0.02 -0.03 0.01 -0.02 -0.06 0.02 -0.04 -0.02 -0.02 0.00 -0.06 -0.09 0.01 0.03 0.01 0.02 0.00 0.00 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 -0.00 -0.00 0.00 -0.00 0.00 -0.01 -0.40 0.03 -0.06 0.49 -0.38 -0.13 0.00 0.09 -0.05 0.00 -0.02 0.14 -0.05 0.07 -0.04 0.13 0.03 -0.05 0.01 0.06 0.02 -0.08 0.04 0.02 0.09 0.06 -0.03 0.07 0.03 -0.03 -0.02 -0.07 0.04 -0.05 -0.05 0.06 0.05 -0.07 0.09 0.03 0.08 -0.05 0.04 0.05 -0.07 0.15 -0.05 -0.02 0.11 -0.07 -0.01 0.25 0.15 0.06 0.10 -0.03 0.06 0.10 0.09 0.01 0.11 0.11 0.01 -0.00 0.01 -0.00 -0.01 -0.03 0.00 -0.00 -0.02 0.00 -0.00 0.00 -0.00 -0.01 -0.01 -0.03 -0.02 0.03 0.00 -0.00 0.00 0.00 -0.03 -0.02 -0.01 0.05 0.18 0.05 0.03 0.02 -0.01 0.00 -0.06 -0.03 -0.03 -0.10 -0.03 -0.04 -0.10 -0.04 -0.04 -0.02 0.01 0.01 -0.04 0.00 -0.02 0.01 -0.01 0.02 -0.01 0.02 0.02 0.00 0.00 0.00 -0.01 -0.01 0.01 -0.00 0.01 0.03 -0.00 0.01 0.03 0.02 0.00 0.02 0.03 -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 -0.01 0.19 -0.04 0.06 0.02 0.08 0.06 0.21 0.13 0.12 -0.01 0.37 -0.03 0.23 -0.35 0.37 0.08 -0.02 0.07 0.23 0.06 -0.39 0.13 0.15 -0.13 -0.05 0.01 -0.08 -0.04 0.02 0.02 0.06 -0.03 0.02 0.03 -0.05 -0.03 0.04 -0.05 -0.02 -0.05 0.03 -0.02 -0.03 0.04 -0.07 0.02 0.00 -0.01 0.01 -0.00 -0.12 -0.06 -0.03 0.00 0.03 -0.01 -0.03 -0.02 -0.01 -0.03 -0.03 -0.00 0.00 -0.01 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 -0.04 0.05 0.02 0.00 0.02 -0.01 0.17 0.13 0.02 0.05 -0.00 -0.01 0.06 0.07 -0.03 -0.00 -0.04 0.01 -0.04 -0.00 0.01 -0.03 -0.00 -0.02 -0.07 -0.04 0.04 0.04 -0.08 -0.01 -0.04 -0.01 -0.00 0.04 -0.01 0.02 0.03 0.01 -0.00 0.08 0.00 0.01 -0.07 0.01 -0.05 -0.11 -0.00 -0.05 -0.14 -0.09 -0.03 -0.10 -0.15 0.01 0.08 0.02 0.03 0.00 0.01 -0.00 0.00 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 -0.01 0.24 0.13 0.00 -0.19 0.15 0.07 0.03 -0.04 0.15 0.08 0.03 -0.05 0.06 0.01 -0.11 -0.02 0.01 0.07 0.07 0.02 -0.01 -0.10 -0.01 0.07 -0.16 -0.08 0.03 -0.08 -0.04 0.02 0.04 0.08 -0.05 0.04 0.05 -0.07 -0.04 0.06 -0.08 -0.03 -0.08 0.04 -0.04 -0.04 0.07 0.05 0.03 0.08 0.16 0.01 0.01 0.55 0.25 0.13 -0.15 -0.09 -0.03 0.11 0.06 0.03 0.14 0.11 0.02 -0.01 0.03 -0.03 -0.02 -0.05 -0.00 -0.00 -0.03 0.00 0.00 -0.01 0.01 -0.01 -0.02 -0.06 0.04 -0.06 -0.01 -0.00 -0.04 0.02 -0.03 -0.02 -0.01 0.08 -0.07 -0.02 0.13 0.11 -0.06 0.02 -0.03 -0.02 -0.06 0.05 0.03 -0.06 0.03 -0.03 -0.10 -0.06 0.06 -0.09 0.19 0.03 -0.04 0.01 -0.02 0.04 -0.01 0.02 0.03 0.01 0.00 -0.04 -0.01 0.01 0.02 0.01 0.01 0.02 0.01 0.00 0.02 0.01 0.01 0.02 0.00 0.01 -0.02 -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 0.21 0.20 -0.06 0.17 -0.35 -0.22 0.02 -0.16 0.22 0.10 0.08 -0.26 0.14 -0.10 -0.05 -0.14 -0.00 0.12 0.14 -0.06 -0.05 -0.06 -0.07 0.10 -0.35 -0.15 0.05 -0.12 -0.06 0.04 0.03 0.09 -0.05 0.04 0.06 -0.09 -0.04 0.06 -0.08 -0.04 -0.09 0.05 -0.05 -0.05 0.08 0.11 -0.07 -0.09 0.01 -0.05 -0.01 -0.19 -0.07 -0.05 0.09 0.00 0.03 0.02 0.03 -0.01 -0.00 0.02 -0.01 0.01 -0.02 0.02 0.01 0.02 0.00 0.00 0.03 0.00 0.00 0.02 -0.02 0.00 0.00 0.01 -0.00 -0.01 0.01 0.00 -0.00 -0.00 -0.01 -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 0.01 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.02 0.02 -0.00 -0.03 -0.04 0.00 -0.01 -0.02 0.01 0.02 0.01 0.00 -0.01 0.06 -0.02 0.02 0.01 0.00 -0.01 0.01 0.01 0.00 0.01 -0.02 -0.00 -0.02 -0.01 -0.01 -0.05 -0.00 0.00 0.03 -0.04 0.01 0.02 0.06 0.01 0.02 -0.00 0.01 -0.02 -0.01 0.00 -0.00 0.00 0.00 0.00 -0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 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 0.02 0.02 0.06 0.02 -0.04 -0.02 0.28 0.09 0.09 -0.06 0.02 -0.04 -0.08 -0.07 0.01 -0.02 -0.05 0.01 0.00 0.12 -0.15 -0.05 -0.19 -0.03 -0.10 -0.45 -0.06 0.01 0.28 -0.35 0.11 0.21 0.55 -0.00 -0.03 0.01 0.00 -0.00 -0.00 -0.03 -0.06 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 -0.01 -0.00 0.01 -0.01 0.02 -0.00 -0.01 -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.03 0.04 -0.01 -0.06 -0.08 0.00 -0.01 -0.05 0.02 0.05 0.03 0.01 -0.02 0.14 -0.06 0.04 0.00 0.01 -0.02 0.04 0.00 0.01 0.00 -0.00 0.01 0.01 -0.01 0.00 0.02 0.01 -0.00 -0.03 0.02 -0.01 -0.01 -0.04 0.03 0.03 -0.00 0.02 -0.05 -0.03 0.00 -0.01 0.00 0.00 0.00 -0.01 0.01 -0.00 -0.00 -0.00 0.00 0.01 0.02 -0.00 -0.01 -0.01 -0.00 0.01 -0.01 -0.01 0.01 0.00 0.00 -0.00 0.01 0.01 -0.01 0.01 0.01 -0.01 -0.00 0.01 -0.01 -0.01 -0.01 0.00 -0.00 -0.01 0.01 0.05 0.05 0.13 0.04 -0.10 -0.05 0.62 0.19 0.20 -0.16 0.04 -0.09 -0.12 -0.15 0.03 -0.12 -0.20 0.01 -0.03 -0.03 0.05 -0.01 0.03 -0.00 0.05 0.20 0.04 -0.02 -0.22 0.26 -0.07 -0.13 -0.36 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 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 -0.01 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 0.01 -0.01 -0.02 -0.00 0.00 0.01 -0.02 -0.02 -0.02 0.00 0.03 -0.03 0.02 0.06 0.02 -0.01 -0.04 -0.01 -0.00 -0.03 0.04 -0.00 -0.00 0.00 0.01 0.03 -0.00 0.01 -0.02 -0.01 -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 0.00 0.03 0.01 0.00 0.01 0.01 -0.00 0.01 0.00 -0.01 0.01 0.01 -0.00 -0.01 0.01 -0.02 -0.01 -0.01 -0.00 -0.01 -0.00 0.01 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.01 -0.01 -0.00 -0.00 0.00 0.19 0.22 -0.02 -0.16 -0.21 -0.00 0.01 0.26 -0.31 0.11 0.51 0.08 -0.10 -0.45 -0.06 -0.02 -0.25 0.31 0.01 0.01 0.05 -0.00 -0.00 0.00 0.01 0.01 -0.02 -0.00 -0.00 0.00 0.07 0.02 -0.09 -0.02 0.05 -0.02 -0.01 -0.02 0.03 -0.03 -0.00 0.04 -0.03 -0.01 0.03 0.05 -0.02 0.01 -0.01 0.00 -0.00 0.13 0.16 -0.13 -0.06 -0.05 0.04 -0.05 -0.07 0.05 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 0.01 -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 -0.22 -0.42 -0.00 -0.09 0.18 0.15 0.02 -0.06 0.14 0.05 0.02 -0.01 0.06 -0.04 -0.02 -0.02 -0.01 -0.01 -0.13 0.02 0.04 -0.05 0.03 0.00 -0.48 -0.15 -0.00 -0.23 -0.12 0.06 -0.09 -0.05 0.05 -0.10 -0.09 0.02 0.15 -0.21 0.28 0.09 0.10 0.02 0.11 0.02 -0.07 0.02 -0.00 0.01 -0.00 -0.00 -0.00 0.05 0.02 0.01 -0.01 0.00 -0.00 0.01 0.02 -0.00 -0.02 -0.03 -0.00 0.00 0.04 -0.04 0.01 0.06 0.01 -0.01 -0.05 -0.01 -0.00 -0.03 0.04 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 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -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 -0.01 0.00 -0.01 -0.00 0.00 0.00 -0.00 -0.00 0.02 0.00 -0.06 -0.01 0.04 -0.00 -0.04 -0.12 -0.01 0.00 -0.04 0.05 0.00 -0.01 0.02 0.01 0.05 -0.03 0.01 0.04 0.01 -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 0.01 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 -0.01 0.02 0.03 0.02 -0.02 -0.01 0.11 0.04 0.02 -0.05 0.00 -0.02 0.43 0.55 -0.07 -0.29 -0.32 -0.02 -0.03 -0.15 0.19 0.02 0.08 0.05 0.05 0.26 -0.00 0.02 0.25 -0.25 0.02 0.03 0.08 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.01 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 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 0.02 -0.00 0.00 0.01 0.00 -0.01 -0.00 -0.00 0.01 -0.05 -0.02 0.01 -0.06 0.05 -0.02 0.21 -0.11 0.01 0.02 0.01 0.01 0.03 -0.00 0.01 -0.02 0.07 -0.02 -0.07 -0.02 0.00 0.02 -0.01 -0.01 -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 -0.00 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 0.02 -0.02 -0.04 -0.02 0.03 0.02 -0.11 -0.05 -0.05 0.08 -0.01 0.04 0.16 0.02 0.04 -0.38 -0.60 0.07 -0.02 -0.24 0.35 -0.10 -0.33 -0.06 -0.04 -0.18 0.06 -0.02 -0.07 -0.02 0.02 0.04 0.06 0.01 -0.01 0.00 0.02 0.00 -0.02 -0.00 -0.01 0.00 0.17 0.02 -0.12 -0.00 -0.01 0.06 -0.01 -0.02 0.02 -0.07 -0.00 0.04 -0.05 -0.00 0.03 0.00 0.03 -0.08 -0.03 0.04 0.00 -0.07 -0.09 0.08 0.02 0.03 -0.02 0.03 0.03 -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 0.01 -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 -0.40 -0.49 0.03 -0.06 0.27 0.24 0.04 -0.08 0.28 0.15 0.06 -0.04 0.11 -0.06 -0.09 -0.10 -0.02 0.04 -0.15 0.01 0.04 -0.11 0.02 0.07 0.27 0.14 -0.03 0.14 0.07 -0.03 0.06 0.02 -0.04 0.05 0.05 -0.01 -0.09 0.12 -0.14 -0.04 -0.05 -0.02 -0.07 0.01 0.03 0.08 -0.03 -0.03 -0.01 -0.01 0.00 0.00 0.00 0.01 0.03 -0.00 0.01 -0.01 -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 0.00 0.04 -0.02 -0.01 -0.01 0.01 0.04 -0.06 0.04 -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 0.00 -0.00 -0.00 0.00 0.03 -0.03 0.04 -0.11 0.03 -0.07 0.01 0.00 0.01 -0.09 -0.02 -0.04 0.04 0.07 -0.01 0.02 0.04 -0.02 -0.01 -0.02 0.04 0.00 -0.00 -0.01 -0.00 -0.01 -0.01 -0.00 -0.00 -0.01 0.00 0.01 -0.00 0.00 -0.00 0.01 0.02 0.03 0.00 0.00 -0.00 -0.01 -0.00 0.01 -0.01 -0.01 -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 -0.00 -0.00 0.00 -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 0.40 -0.16 -0.09 -0.06 0.15 0.10 -0.05 -0.02 -0.02 0.69 -0.09 0.35 -0.13 -0.13 0.00 -0.15 -0.19 0.01 -0.01 0.05 -0.07 -0.01 0.01 -0.00 0.01 0.07 -0.01 0.00 0.00 0.01 -0.00 -0.01 -0.01 -0.01 -0.05 0.04 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 0.01 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.03 0.05 -0.01 -0.06 -0.06 -0.03 0.03 0.06 -0.00 -0.05 0.04 -0.04 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 -0.01 -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 -0.00 -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 -0.01 -0.00 0.00 -0.00 -0.49 0.24 0.21 0.64 -0.29 -0.13 -0.17 -0.02 -0.08 0.27 0.02 0.11 -0.01 -0.02 -0.00 -0.01 -0.00 0.00 0.00 -0.01 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 0.00 -0.01 0.00 0.00 0.00 -0.00 -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 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 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 -0.01 0.07 0.05 0.01 -0.02 -0.01 -0.00 0.03 0.00 0.01 -0.02 -0.09 -0.00 0.06 0.09 -0.04 0.02 0.06 0.25 0.00 0.08 -0.12 -0.03 -0.15 -0.04 -0.04 -0.17 -0.04 0.01 0.11 -0.14 0.03 0.05 0.14 0.01 -0.00 0.01 0.02 -0.03 -0.01 0.00 -0.00 0.01 -0.00 -0.00 0.01 -0.00 -0.00 0.01 -0.00 -0.00 -0.01 -0.01 -0.00 0.00 -0.00 0.01 -0.01 -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 -0.00 -0.00 0.00 0.00 -0.23 0.07 0.00 0.04 -0.03 -0.02 -0.03 -0.02 -0.01 -0.05 0.01 -0.03 0.04 0.15 -0.04 -0.31 -0.50 0.13 -0.00 0.10 -0.14 -0.05 -0.09 -0.03 0.07 0.38 0.03 -0.02 -0.20 0.24 -0.03 -0.05 -0.13 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.02 -0.07 0.24 0.03 0.01 -0.06 0.00 0.04 -0.01 -0.01 0.01 -0.04 -0.01 0.02 -0.07 0.01 -0.00 -0.02 0.01 0.00 0.01 0.01 -0.02 0.02 -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 -0.00 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 -0.60 -0.30 -0.18 -0.29 0.19 -0.05 -0.05 0.06 -0.16 0.04 0.03 -0.20 0.05 0.08 -0.19 0.08 0.05 0.19 0.21 0.00 -0.06 -0.00 -0.15 0.13 -0.23 -0.05 -0.01 0.02 0.01 -0.01 0.01 -0.02 0.01 0.00 -0.01 0.02 -0.05 0.05 -0.04 0.02 0.05 -0.07 -0.00 0.04 -0.03 0.01 -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 -0.01 -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 0.01 -0.00 -0.00 -0.00 -0.00 0.01 -0.00 -0.00 -0.00 0.00 0.01 -0.00 0.01 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 0.01 -0.01 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.01 0.01 0.01 -0.04 -0.04 -0.01 0.02 0.01 0.00 -0.01 0.00 -0.01 0.02 0.04 -0.01 -0.05 -0.07 0.02 0.01 0.02 -0.03 0.01 0.09 -0.08 -0.02 -0.11 0.00 -0.01 -0.04 0.01 0.00 0.03 -0.03 0.02 0.04 0.11 0.03 0.04 0.00 -0.03 0.05 0.02 0.00 0.01 0.00 0.01 0.00 -0.00 0.00 -0.00 -0.01 -0.00 0.00 0.01 0.01 -0.00 -0.00 0.00 -0.01 0.00 0.05 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 0.01 0.01 0.00 0.02 0.01 -0.02 0.01 0.17 -0.05 -0.00 -0.01 -0.00 0.01 -0.00 0.01 -0.01 -0.01 0.00 -0.01 0.10 0.14 -0.00 0.16 0.23 -0.04 -0.00 -0.35 0.46 0.12 0.48 0.08 -0.05 -0.25 -0.01 0.01 0.12 -0.15 -0.06 -0.11 -0.29 0.01 -0.01 0.01 -0.00 -0.01 0.01 -0.00 0.00 -0.00 0.08 -0.03 0.07 -0.08 -0.07 -0.00 0.03 -0.01 -0.05 -0.03 0.00 -0.02 -0.02 0.02 -0.02 -0.03 -0.02 0.03 -0.02 0.05 -0.00 0.00 0.08 -0.08 0.01 -0.01 0.02 -0.01 0.00 -0.00 -0.03 0.01 0.00 0.01 0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.01 -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 -0.01 0.18 0.26 0.01 -0.18 0.35 0.13 0.00 0.05 0.04 0.12 0.05 -0.04 0.04 -0.04 -0.05 -0.02 0.02 0.11 0.05 -0.00 -0.02 0.01 -0.07 0.06 0.64 0.16 0.05 -0.12 -0.06 0.03 -0.09 0.04 0.02 -0.07 -0.05 -0.06 0.11 -0.11 0.14 0.01 -0.05 0.15 0.05 -0.13 0.06 0.12 -0.05 -0.06 0.14 -0.09 -0.03 -0.01 -0.01 -0.01 -0.02 -0.00 -0.01 0.01 0.01 -0.00 -0.01 -0.02 0.01 0.00 0.04 -0.06 -0.01 -0.07 -0.01 0.01 0.04 0.00 -0.00 -0.03 0.03 0.01 0.01 0.04 -0.00 0.02 -0.00 -0.00 -0.00 0.00 0.01 0.00 0.01 -0.01 0.00 -0.01 -0.00 0.00 0.00 0.01 -0.01 -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 0.01 0.01 -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 0.02 0.01 -0.08 -0.09 -0.00 0.04 0.04 0.00 -0.01 0.02 -0.01 0.03 0.03 -0.01 -0.09 -0.12 -0.00 0.03 0.06 0.05 -0.00 -0.00 0.01 0.01 0.03 0.01 -0.01 -0.05 0.00 -0.00 0.02 -0.05 -0.00 -0.01 -0.02 0.03 0.03 0.01 -0.03 0.05 0.03 -0.00 -0.00 -0.01 -0.01 -0.01 -0.00 -0.01 0.01 -0.00 -0.00 -0.00 -0.01 -0.00 -0.00 0.00 0.01 0.01 -0.01 -0.12 -0.03 -0.01 0.02 0.01 -0.00 0.02 -0.01 -0.00 0.02 0.01 0.02 -0.02 0.02 -0.03 0.00 0.02 -0.03 -0.00 0.03 -0.02 0.34 -0.09 -0.00 0.01 -0.03 -0.00 -0.06 0.01 -0.03 -0.07 0.02 -0.04 0.34 0.44 -0.06 0.19 0.23 0.03 0.02 0.14 -0.17 -0.06 -0.34 -0.04 0.05 0.23 0.04 -0.01 -0.21 0.23 0.04 0.07 0.20 0.00 -0.02 -0.02 0.00 0.01 -0.01 0.01 0.00 0.01 0.01 0.00 0.01 0.05 0.02 -0.01 -0.04 0.05 0.04 -0.00 0.01 -0.01 -0.00 -0.01 -0.01 -0.03 -0.03 0.02 0.01 -0.03 0.00 -0.04 0.04 -0.06 0.02 -0.00 0.01 -0.00 0.01 -0.01 0.08 -0.01 0.01 -0.04 -0.03 0.01 0.01 0.01 0.00 -0.02 0.01 -0.02 0.01 0.01 -0.00 -0.02 -0.03 0.00 0.01 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.01 0.00 -0.00 0.00 -0.01 -0.00 -0.00 -0.00 -0.21 -0.23 -0.05 0.16 -0.32 -0.16 0.02 -0.01 0.03 0.01 0.01 0.02 -0.01 -0.03 0.04 0.02 0.00 0.00 -0.01 0.00 -0.00 -0.04 -0.00 0.03 0.42 0.10 0.05 -0.07 -0.04 0.02 -0.08 0.07 0.01 -0.07 -0.04 -0.09 0.09 -0.06 0.12 0.00 -0.07 0.15 0.01 -0.15 0.10 -0.32 0.14 0.13 -0.41 0.22 0.09 -0.01 0.00 -0.01 0.04 0.01 0.02 0.07 0.09 -0.01 0.05 0.06 0.00 0.00 0.01 -0.02 -0.01 -0.05 -0.01 0.01 0.03 0.01 -0.00 -0.03 0.03 0.01 0.01 0.03 -0.01 0.04 0.02 -0.01 0.01 0.00 -0.01 -0.00 -0.00 -0.06 0.01 -0.02 0.09 0.05 0.00 -0.03 0.01 0.03 0.02 0.00 0.00 0.02 -0.01 -0.00 -0.02 -0.03 0.01 0.04 -0.06 -0.01 -0.04 0.01 -0.03 0.03 0.01 0.00 -0.00 0.02 -0.02 -0.11 0.02 -0.01 0.04 0.04 -0.02 -0.01 -0.02 0.00 0.02 -0.02 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 -0.27 -0.24 -0.04 0.06 -0.21 -0.09 0.01 -0.01 -0.02 -0.08 -0.03 -0.01 -0.05 0.04 0.04 -0.00 -0.02 -0.04 -0.03 0.00 0.00 -0.04 0.04 0.00 0.21 0.05 0.03 -0.06 -0.03 0.01 -0.09 0.05 0.03 -0.07 -0.07 -0.06 0.09 -0.04 0.12 0.01 -0.06 0.16 0.01 -0.17 0.10 0.40 -0.16 -0.11 0.55 -0.23 -0.10 0.03 -0.01 0.01 -0.04 -0.03 -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 -0.00 0.00 0.01 0.01 -0.04 -0.00 -0.00 0.01 0.00 -0.01 0.00 0.01 -0.03 0.09 -0.09 0.00 0.05 0.01 0.01 -0.01 -0.00 0.01 -0.00 -0.00 -0.02 0.02 0.02 0.02 -0.01 -0.01 0.03 -0.04 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 0.01 -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 0.02 0.01 0.02 0.04 -0.15 0.13 -0.28 0.01 -0.04 -0.35 0.05 0.23 -0.26 0.34 0.16 -0.19 0.37 -0.07 0.00 0.30 -0.12 -0.27 -0.04 -0.00 -0.01 -0.07 -0.01 0.00 -0.06 -0.03 0.07 -0.05 -0.09 0.02 0.09 -0.06 0.09 0.02 -0.05 0.18 0.05 -0.16 0.06 -0.05 0.02 0.01 -0.03 0.02 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 -0.00 -0.00 0.00 -0.00 -0.00 -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 -0.01 0.02 0.01 -0.00 -0.01 0.01 0.01 -0.00 -0.01 0.02 -0.05 -0.00 0.02 -0.02 -0.03 0.02 0.01 -0.02 -0.00 -0.01 0.06 -0.06 -0.08 -0.07 0.05 0.02 -0.05 0.07 -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 -0.04 -0.07 -0.00 0.04 -0.08 -0.03 -0.03 0.05 -0.05 0.02 -0.00 -0.08 0.00 0.04 -0.04 0.18 0.08 -0.09 0.19 -0.03 -0.00 0.14 -0.07 -0.12 0.26 0.06 0.04 0.33 0.07 -0.01 0.27 0.14 -0.30 0.23 0.37 -0.11 -0.14 0.08 -0.13 -0.05 0.06 -0.31 -0.10 0.27 -0.10 0.06 -0.02 -0.01 0.07 -0.03 -0.01 -0.00 -0.00 -0.00 -0.01 -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 -0.00 0.00 0.01 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.02 0.01 0.00 0.00 -0.00 0.01 -0.03 0.02 0.02 -0.00 0.01 -0.02 -0.01 -0.01 0.00 0.00 -0.00 -0.01 0.00 -0.01 0.00 0.00 -0.01 0.00 0.01 -0.00 -0.01 0.01 0.00 0.01 -0.01 0.01 -0.03 -0.01 0.01 -0.01 0.01 -0.02 -0.02 -0.05 -0.00 0.12 0.22 -0.03 -0.08 -0.14 0.02 -0.06 -0.08 0.01 0.02 0.15 -0.05 -0.05 -0.11 0.02 0.01 0.02 -0.01 0.00 0.01 -0.00 0.00 0.01 0.01 -0.00 -0.02 0.01 -0.00 0.01 -0.02 -0.00 -0.00 -0.00 0.04 0.04 0.00 0.00 0.02 0.00 0.01 -0.01 0.03 0.02 0.01 0.04 0.02 -0.04 0.01 -0.03 -0.01 0.03 -0.03 0.01 -0.00 -0.03 0.00 0.03 -0.08 -0.02 -0.01 0.11 0.03 -0.01 0.12 -0.00 -0.09 0.10 0.12 0.01 0.03 -0.02 0.03 0.03 0.00 0.10 0.06 -0.08 0.01 -0.50 0.12 -0.03 0.17 0.02 0.01 0.26 -0.02 0.13 0.27 -0.12 0.17 0.15 0.32 -0.02 0.17 0.24 -0.07 0.00 -0.00 0.02 -0.01 -0.08 -0.00 0.01 0.05 0.02 -0.01 -0.07 0.08 0.01 0.02 0.07 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 0.01 -0.01 -0.01 0.00 -0.00 0.01 0.03 -0.00 -0.01 0.00 0.01 -0.01 -0.00 0.01 0.00 0.02 -0.01 0.02 -0.08 -0.04 0.02 -0.03 0.05 -0.07 0.01 0.01 0.00 -0.02 -0.03 0.01 0.01 0.02 -0.00 0.01 0.01 -0.00 -0.00 -0.02 0.01 0.01 0.02 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.01 0.02 -0.01 -0.02 0.03 0.01 -0.02 0.01 -0.04 -0.01 -0.01 -0.04 0.01 0.04 -0.04 -0.10 -0.05 0.05 -0.11 0.02 0.00 -0.08 0.04 0.07 -0.13 -0.03 -0.01 0.31 0.09 -0.02 0.31 0.04 -0.25 0.26 0.34 0.01 0.19 -0.12 0.21 0.08 -0.07 0.42 0.15 -0.36 0.13 0.04 -0.01 0.00 -0.05 0.00 0.00 -0.04 -0.00 -0.03 -0.03 0.02 -0.02 -0.02 -0.05 0.00 -0.02 -0.04 0.02 0.00 0.00 -0.00 0.00 0.01 0.00 0.00 0.00 -0.00 -0.00 0.01 -0.01 -0.00 -0.00 -0.00 -0.00 0.01 0.00 0.00 0.01 -0.00 -0.00 0.00 -0.00 0.04 -0.01 0.02 -0.02 -0.02 -0.02 -0.02 0.04 0.01 -0.02 0.04 -0.10 -0.09 0.00 0.02 0.01 0.01 -0.01 0.01 -0.03 -0.00 0.01 -0.02 0.02 -0.01 0.00 -0.01 -0.01 0.02 -0.02 -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 -0.01 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 -0.01 0.05 -0.08 -0.05 0.15 -0.16 0.32 0.07 0.08 0.44 0.01 -0.33 0.28 0.31 0.15 -0.07 0.31 -0.05 -0.01 0.25 -0.17 -0.17 -0.13 -0.04 -0.02 0.01 0.01 -0.00 0.04 -0.03 -0.00 0.03 0.02 0.04 0.04 -0.02 0.05 0.03 -0.00 0.12 0.06 -0.10 0.03 0.07 -0.02 0.00 0.07 -0.02 -0.01 -0.01 -0.00 -0.01 -0.02 0.00 -0.01 -0.00 -0.01 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 0.02 0.00 -0.01 0.01 0.01 -0.00 0.00 -0.00 0.14 -0.01 0.02 -0.11 -0.06 -0.05 -0.10 0.14 0.05 -0.05 -0.01 0.04 -0.00 -0.00 -0.01 0.01 0.02 -0.01 0.05 -0.09 -0.02 0.03 -0.01 0.02 -0.01 0.01 -0.01 -0.01 -0.00 0.00 -0.03 0.01 -0.01 -0.00 -0.00 -0.01 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 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.29 0.02 0.03 0.36 -0.42 -0.17 -0.14 0.17 -0.20 0.32 0.10 -0.18 0.21 -0.06 -0.20 -0.10 -0.04 0.12 -0.14 0.04 0.01 -0.13 0.01 0.13 -0.10 -0.03 -0.03 -0.04 0.00 0.01 0.03 -0.06 0.02 0.02 -0.02 0.08 -0.02 -0.01 -0.05 0.01 0.03 -0.01 0.04 0.04 -0.05 0.13 -0.04 0.04 0.16 -0.00 -0.01 -0.01 -0.00 -0.01 -0.03 -0.00 -0.02 -0.00 -0.01 -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 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 -0.01 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.01 0.01 -0.03 -0.03 -0.01 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 -0.01 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 -0.03 -0.01 -0.01 -0.00 0.00 -0.00 0.01 -0.00 0.01 -0.02 -0.01 -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 -0.10 0.43 0.40 0.01 0.32 -0.27 -0.01 -0.25 0.33 0.05 -0.25 -0.28 -0.10 -0.15 0.14 0.21 0.12 -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 -0.02 0.00 0.00 -0.01 0.00 -0.02 0.00 -0.01 0.01 0.00 0.00 0.01 0.00 0.01 0.01 0.00 -0.01 0.02 0.01 0.01 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 -0.01 0.00 -0.01 -0.00 0.01 -0.00 -0.00 -0.00 0.00 0.01 -0.00 -0.01 -0.01 -0.00 -0.00 -0.01 0.00 0.02 0.02 -0.00 -0.06 0.02 -0.05 0.00 0.01 0.06 -0.01 -0.03 -0.01 0.00 0.03 -0.03 0.01 0.05 -0.02 -0.01 -0.05 0.01 0.01 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 -0.00 -0.00 0.05 0.03 0.01 -0.05 0.06 -0.01 -0.04 -0.01 -0.05 -0.03 -0.00 -0.06 0.03 0.02 0.03 0.07 0.01 -0.04 -0.01 0.00 0.01 0.01 0.01 0.00 0.03 0.01 0.01 -0.00 -0.01 0.00 0.55 -0.31 -0.08 0.20 -0.07 0.62 -0.01 0.00 -0.07 -0.01 -0.08 -0.05 -0.04 -0.16 -0.05 -0.00 0.06 -0.13 -0.04 -0.08 -0.21 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -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 -0.03 0.03 0.01 -0.01 -0.00 -0.01 -0.01 0.00 0.01 -0.00 -0.01 -0.00 -0.01 0.00 -0.01 0.00 0.01 0.00 0.01 -0.02 0.03 -0.01 -0.01 -0.02 -0.05 0.01 0.03 0.00 -0.00 -0.02 0.03 -0.00 -0.04 0.02 0.01 0.04 -0.01 -0.01 -0.02 -0.04 -0.02 0.00 -0.00 -0.00 0.00 -0.00 0.01 -0.01 0.01 -0.02 -0.01 -0.01 -0.02 0.02 0.00 0.01 0.01 0.01 -0.01 -0.01 -0.00 0.01 -0.02 0.01 0.04 0.01 0.01 -0.28 -0.02 0.06 0.28 -0.22 -0.01 0.20 0.03 0.36 0.16 -0.06 0.23 -0.22 -0.16 -0.19 -0.35 0.05 0.14 0.01 -0.00 0.08 0.03 0.07 0.02 0.02 0.01 0.01 -0.01 -0.00 -0.00 0.18 -0.25 -0.01 0.08 -0.02 0.25 0.01 -0.03 0.09 0.03 0.08 0.04 0.03 0.10 0.05 0.00 -0.05 0.12 0.04 0.07 0.19 -0.00 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 -0.01 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.01 0.01 -0.00 0.02 -0.03 -0.02 0.01 0.01 0.00 0.01 -0.00 0.00 -0.00 -0.01 0.00 -0.01 0.00 -0.00 0.00 0.01 0.00 0.01 -0.01 0.04 -0.00 -0.02 -0.04 -0.09 0.01 0.06 0.01 -0.00 -0.04 0.05 -0.01 -0.07 0.04 0.01 0.08 -0.02 -0.01 -0.03 -0.07 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 -0.02 0.01 -0.01 -0.00 -0.01 0.02 -0.01 0.01 0.00 -0.00 0.13 -0.04 -0.07 -0.14 0.07 0.04 -0.11 0.00 -0.21 -0.19 0.12 -0.21 0.26 0.21 0.17 0.35 -0.07 -0.13 -0.01 0.00 -0.06 -0.02 -0.06 -0.01 0.02 0.01 -0.00 -0.01 -0.00 -0.00 0.14 -0.31 -0.00 0.07 -0.02 0.23 0.01 -0.04 0.15 0.04 0.14 0.08 0.05 0.20 0.08 0.01 -0.10 0.21 0.07 0.12 0.34 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 0.01 -0.01 -0.01 0.01 0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 -0.00 -0.02 0.01 0.01 0.00 0.00 0.00 0.00 -0.00 0.01 -0.00 -0.00 0.00 -0.05 -0.04 -0.06 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 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -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 0.02 0.01 0.01 -0.07 0.02 -0.09 -0.03 -0.00 -0.01 0.05 -0.03 0.01 0.01 0.09 -0.02 0.08 0.02 0.04 -0.02 -0.03 -0.00 -0.00 -0.00 0.05 -0.01 -0.02 -0.05 0.03 0.01 -0.03 0.01 -0.07 -0.02 -0.00 -0.04 0.03 0.02 0.03 0.06 -0.00 -0.03 0.13 -0.02 0.67 0.26 0.62 0.13 -0.01 -0.00 -0.01 -0.04 -0.00 -0.01 -0.03 0.00 0.00 -0.01 -0.00 -0.02 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 0.00 0.00 0.00 -0.00 0.00 0.02 -0.01 -0.01 -0.01 -0.01 0.00 -0.01 0.01 0.00 0.02 0.02 0.01 -0.02 -0.04 -0.02 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 0.01 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 0.02 0.00 0.01 0.04 -0.04 -0.01 -0.01 -0.32 0.01 -0.29 -0.09 0.04 0.03 0.12 -0.15 -0.01 -0.01 0.51 -0.02 0.57 0.17 0.19 0.00 -0.29 0.02 0.01 0.00 0.00 -0.01 -0.01 -0.00 -0.01 0.01 -0.00 0.00 -0.01 0.00 -0.01 -0.01 -0.01 -0.01 -0.00 -0.00 0.01 -0.01 -0.02 0.00 -0.11 -0.04 -0.10 -0.02 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 0.00 0.00 0.00 -0.00 0.00 0.00 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 0.01 0.00 0.00 0.01 -0.01 -0.01 -0.02 0.01 0.00 0.01 -0.03 0.02 0.02 0.00 0.00 -0.00 0.01 0.00 -0.00 -0.01 -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 -0.00 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 0.01 -0.00 -0.00 -0.00 -0.00 -0.05 -0.00 -0.01 -0.05 0.05 0.01 -0.12 0.03 -0.22 0.27 0.11 0.14 0.25 -0.27 -0.02 -0.28 -0.14 -0.13 0.31 0.20 0.08 -0.10 0.38 -0.33 -0.04 -0.01 0.01 0.10 0.11 0.07 -0.10 0.17 -0.07 -0.09 -0.07 -0.07 0.04 0.05 0.15 -0.04 -0.01 -0.09 -0.16 -0.04 0.10 0.00 0.00 0.04 0.01 0.04 0.01 0.00 0.00 0.00 -0.00 -0.00 0.00 0.01 -0.02 -0.00 0.01 -0.00 0.02 0.00 -0.00 0.01 0.00 0.01 0.01 0.00 0.01 0.01 0.00 -0.01 0.01 0.00 0.01 0.02 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.02 0.00 -0.01 -0.03 -0.01 -0.00 -0.00 0.01 0.00 0.01 -0.00 0.00 -0.00 0.01 -0.01 0.04 0.01 0.01 -0.00 -0.00 -0.00 -0.00 -0.02 -0.00 0.01 -0.03 0.02 0.02 0.00 -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 -0.01 -0.01 0.00 0.01 0.00 -0.00 -0.01 0.01 -0.00 -0.01 0.01 0.00 0.01 -0.00 -0.00 -0.00 -0.01 0.07 0.03 0.01 0.03 -0.01 0.00 0.03 -0.01 0.07 -0.08 -0.03 -0.04 -0.07 0.08 -0.00 0.14 0.07 0.09 -0.17 -0.08 -0.03 0.06 -0.20 0.17 -0.13 -0.04 -0.00 0.26 0.24 0.13 -0.26 0.38 -0.13 -0.22 -0.15 -0.21 0.07 0.12 0.32 -0.06 0.01 -0.19 -0.33 -0.08 0.20 -0.01 0.00 -0.02 -0.00 -0.02 -0.00 0.01 0.01 0.01 -0.00 -0.00 0.00 0.02 -0.04 -0.00 0.01 0.00 0.03 0.00 -0.01 0.02 0.01 0.02 0.01 0.01 0.03 0.01 0.00 -0.01 0.03 0.01 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 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.03 -0.01 -0.00 -0.00 0.00 -0.00 0.01 -0.01 -0.02 -0.00 -0.00 -0.03 -0.01 -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 -0.01 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.01 -0.00 -0.01 -0.00 0.00 0.01 -0.01 0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 0.00 0.01 0.02 -0.00 0.01 -0.00 -0.01 -0.00 0.01 0.00 0.02 -0.03 -0.01 -0.02 -0.03 0.03 0.00 -0.01 -0.00 0.01 0.01 0.02 0.01 0.00 0.01 -0.02 0.08 0.03 0.01 -0.20 0.16 0.20 0.15 0.01 -0.11 0.09 -0.11 0.33 -0.25 0.46 0.19 0.37 0.42 -0.07 0.04 -0.25 0.12 0.00 -0.00 0.02 0.01 0.02 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.02 0.03 0.00 -0.01 -0.00 -0.02 -0.00 -0.00 -0.01 -0.01 -0.03 -0.01 -0.01 -0.03 -0.01 -0.00 0.01 -0.02 -0.01 -0.02 -0.04 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.07 0.00 -0.04 0.04 0.02 0.02 0.02 -0.03 -0.00 -0.02 -0.02 0.01 0.00 -0.00 -0.03 -0.01 -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 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 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 0.00 -0.03 0.03 0.02 -0.07 0.39 -0.16 0.46 0.15 0.01 0.08 -0.27 0.18 0.20 0.09 0.39 -0.27 0.21 0.05 0.23 -0.27 0.03 0.00 0.00 0.00 -0.02 -0.01 -0.00 0.02 -0.02 0.01 0.01 0.00 0.02 -0.01 0.00 -0.02 0.01 0.01 0.02 0.02 -0.01 -0.01 -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 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -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 -0.01 -0.00 -0.01 -0.01 0.01 0.00 0.01 -0.04 -0.03 -0.01 -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 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 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 -0.02 -0.01 0.21 0.47 0.36 0.08 -0.01 -0.32 -0.44 0.18 0.29 -0.14 -0.06 0.05 0.16 0.20 0.07 -0.01 0.17 -0.21 -0.05 -0.03 -0.02 0.02 0.00 -0.01 -0.02 0.01 0.00 -0.01 -0.00 -0.02 0.02 -0.02 0.01 -0.02 -0.02 -0.00 -0.02 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 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -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 -0.01 -0.02 -0.13 0.05 -0.01 0.03 -0.12 0.03 0.09 0.06 0.04 0.15 0.06 -0.00 0.07 -0.14 -0.02 -0.10 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 0.02 -0.01 -0.02 0.00 -0.00 0.00 0.00 0.02 -0.02 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 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.05 0.05 -0.01 -0.03 0.01 -0.06 -0.03 -0.33 0.31 -0.08 -0.42 0.01 -0.10 -0.48 -0.02 -0.03 -0.33 0.35 -0.02 -0.12 0.06 0.01 -0.01 -0.00 0.00 -0.00 -0.00 -0.04 0.03 -0.03 -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 0.01 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.08 0.00 0.05 -0.27 0.14 -0.18 -0.19 0.05 -0.11 0.19 -0.19 0.16 0.39 -0.01 0.18 -0.08 -0.02 -0.03 0.01 0.00 -0.01 -0.00 -0.02 0.02 0.00 0.01 0.00 -0.00 0.00 -0.02 -0.00 0.00 -0.02 0.01 0.01 0.04 -0.00 0.00 0.00 -0.01 0.01 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 0.00 -0.00 -0.00 0.00 0.01 -0.01 -0.00 0.01 0.00 0.01 -0.01 0.02 0.00 0.03 0.03 0.02 0.02 -0.02 0.00 -0.13 0.07 -0.04 0.07 -0.02 0.04 -0.01 0.17 -0.07 -0.50 -0.19 -0.15 -0.25 -0.03 -0.01 -0.19 -0.10 -0.17 0.01 0.04 -0.05 -0.00 -0.03 -0.00 -0.00 -0.00 -0.02 -0.00 -0.02 -0.00 -0.01 -0.03 -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 0.00 0.00 0.00 0.00 0.00 -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 0.04 -0.02 0.03 -0.01 -0.00 -0.01 -0.03 0.02 -0.02 -0.00 0.00 0.00 0.01 0.02 0.03 -0.05 -0.11 -0.27 0.02 -0.03 0.21 0.05 0.15 0.14 -0.05 -0.13 -0.16 -0.03 0.00 -0.22 0.06 0.12 0.33 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 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 0.01 -0.02 0.00 -0.01 0.04 0.02 0.01 0.06 0.03 0.02 -0.04 -0.21 0.03 0.03 0.05 -0.00 0.03 0.26 -0.13 -0.05 -0.29 0.09 0.02 0.19 -0.14 -0.05 -0.25 0.06 -0.09 -0.18 -0.44 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 0.00 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 0.03 -0.01 0.02 -0.13 0.09 -0.10 0.14 -0.01 0.07 0.09 -0.08 0.07 -0.14 0.01 -0.07 0.03 0.04 0.00 -0.03 -0.19 0.05 0.02 0.21 -0.16 0.05 0.27 -0.01 -0.05 -0.24 0.03 -0.02 -0.19 0.13 0.02 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 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -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 0.01 0.00 -0.09 0.03 -0.03 0.07 -0.00 0.02 -0.17 -0.16 -0.02 -0.17 -0.08 -0.04 0.04 -0.02 0.00 0.06 0.05 0.03 0.01 -0.18 0.34 -0.08 -0.35 -0.10 0.07 0.27 0.11 -0.01 0.10 -0.25 0.02 0.12 -0.06 -0.01 0.01 0.00 -0.01 -0.01 0.01 -0.01 -0.01 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 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 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.05 0.02 -0.04 0.22 -0.16 0.17 -0.26 0.02 -0.13 -0.16 0.13 -0.12 0.29 -0.01 0.14 -0.05 -0.00 -0.03 -0.00 -0.10 0.07 0.01 0.13 -0.11 0.03 0.15 -0.03 -0.02 -0.13 0.03 -0.01 -0.12 0.10 0.01 0.06 -0.05 -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 -0.00 0.00 0.00 0.00 -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 0.01 -0.01 -0.00 0.15 -0.05 0.04 -0.13 0.00 -0.03 0.31 0.29 0.03 0.27 0.14 0.06 -0.14 0.02 -0.01 -0.10 -0.04 -0.10 0.01 -0.12 0.20 -0.04 -0.19 -0.08 0.04 0.14 0.07 -0.00 0.09 -0.16 0.02 0.08 -0.01 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.01 -0.01 0.07 0.02 0.00 -0.00 0.00 0.01 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.46 -0.02 -0.14 0.00 -0.01 0.00 0.48 -0.03 0.19 -0.05 -0.01 -0.00 -0.04 0.02 -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 -0.07 -0.01 -0.02 0.00 -0.04 -0.02 -0.01 -0.01 -0.01 -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 0.29 0.23 -0.13 0.21 0.07 -0.02 -0.21 0.02 0.08 -0.16 -0.12 -0.07 0.15 -0.13 0.18 -0.11 -0.00 -0.20 -0.16 0.16 -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 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.03 0.02 -0.04 0.24 0.18 -0.36 0.00 0.00 0.00 -0.01 -0.02 0.01 -0.01 -0.02 0.01 0.05 0.02 -0.07 -0.00 -0.01 0.01 0.00 0.01 -0.01 0.00 0.00 0.00 -0.41 -0.24 0.59 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.03 0.00 0.02 0.02 -0.01 0.01 -0.02 -0.00 -0.01 -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 0.01 0.11 -0.00 0.16 -0.14 -0.14 -0.02 0.12 -0.06 0.07 0.02 -0.07 -0.00 0.00 0.00 -0.04 -0.01 0.03 0.00 0.01 -0.00 0.01 0.00 0.00 0.02 0.01 0.02 -0.00 0.00 0.01 0.01 0.00 -0.01 0.01 0.01 0.01 -0.01 -0.00 -0.01 0.01 0.01 0.01 0.01 -0.00 -0.00 0.11 -0.06 -0.17 0.03 -0.16 -0.01 0.07 0.03 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 -0.00 0.00 -0.00 -0.06 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 0.00 -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 0.02 0.02 0.36 0.70 -0.53 -0.33 -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 0.02 0.01 0.00 -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 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 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 0.01 0.01 0.00 0.00 -0.00 0.00 0.06 -0.10 0.13 -0.14 -0.18 -0.25 -0.12 0.11 0.07 -0.24 -0.16 0.09 0.34 -0.32 -0.16 0.26 0.37 0.53 0.00 0.00 -0.00 0.00 -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 -0.01 0.01 -0.01 0.05 -0.01 -0.01 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.01 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 0.00 0.00 -0.00 -0.07 0.01 0.03 0.06 -0.18 0.01 0.10 0.10 0.09 -0.21 0.55 -0.02 0.02 -0.15 0.46 -0.34 -0.35 -0.29 -0.00 0.00 -0.00 0.02 -0.04 0.04 -0.05 -0.06 -0.08 -0.04 0.04 0.02 0.01 0.01 -0.01 -0.02 0.02 0.01 -0.01 -0.02 -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 -0.00 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 -0.04 -0.03 -0.01 -0.01 0.00 -0.02 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 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 0.01 0.02 -0.05 0.00 0.03 0.03 0.02 -0.03 0.08 -0.00 0.00 -0.02 0.07 -0.05 -0.05 -0.04 0.00 -0.01 0.01 -0.12 0.23 -0.28 0.30 0.39 0.52 0.25 -0.23 -0.14 -0.12 -0.08 0.04 0.16 -0.15 -0.07 0.12 0.17 0.25 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.03 -0.02 0.04 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 0.01 -0.00 -0.01 0.00 0.00 -0.00 0.26 -0.02 -0.11 -0.22 0.66 -0.03 -0.37 -0.35 -0.31 -0.06 0.15 -0.00 0.01 -0.05 0.14 -0.10 -0.10 -0.08 0.00 -0.01 0.01 -0.00 0.01 -0.01 0.01 0.01 0.02 0.01 -0.01 -0.00 -0.01 -0.00 0.00 0.01 -0.01 -0.00 0.00 0.01 0.01 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -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 -0.09 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 0.01 -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 0.10 0.03 0.93 -0.26 0.20 0.10 0.00 -0.00 0.00 -0.00 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 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 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 0.07 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 -0.00 -0.00 0.00 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 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -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 0.02 0.02 0.02 0.04 -0.05 0.05 0.03 -0.08 -0.03 0.04 0.57 -0.50 -0.23 -0.23 -0.30 -0.45 -0.00 -0.00 0.00 -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 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -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 0.01 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 -0.00 -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 -0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.01 -0.11 0.24 -0.26 -0.25 -0.29 -0.39 0.53 -0.44 -0.25 -0.01 -0.01 0.00 0.05 -0.05 -0.02 -0.02 -0.03 -0.04 -0.01 -0.02 0.00 -0.00 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 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -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 -0.02 -0.03 -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 0.02 -0.06 0.00 -0.05 -0.04 -0.04 -0.01 0.03 -0.00 -0.00 0.00 -0.01 0.02 0.02 0.02 -0.00 0.00 -0.00 -0.00 0.01 -0.01 -0.01 -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 0.18 0.56 -0.06 0.02 -0.23 0.76 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -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 -0.03 0.01 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 -0.01 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 0.01 0.00 0.00 -0.00 -0.02 -0.02 0.00 -0.19 0.53 -0.03 0.42 0.37 0.35 0.13 -0.31 0.01 0.00 0.01 0.02 -0.21 -0.20 -0.17 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.01 -0.01 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.02 0.06 -0.01 0.00 -0.03 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 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 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 -0.01 -0.01 -0.08 -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 0.00 -0.00 0.00 0.00 -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 -0.01 0.00 -0.11 0.30 -0.02 0.23 0.20 0.19 -0.24 0.58 -0.02 -0.00 0.01 -0.08 0.37 0.35 0.30 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -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 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -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 -0.03 0.02 -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 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.03 -0.02 -0.12 0.01 0.01 -0.02 -0.00 0.00 0.00 -0.00 0.00 0.00 0.02 0.02 0.02 0.11 -0.28 -0.01 0.02 -0.26 0.81 0.25 0.26 0.19 -0.00 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 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.05 0.06 -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 0.01 -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 -0.01 -0.00 -0.00 -0.00 -0.01 0.04 -0.05 0.24 -0.50 0.60 0.05 0.10 0.11 0.37 -0.32 -0.21 -0.04 -0.03 0.02 0.00 -0.00 0.00 -0.00 -0.01 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -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 -0.08 -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 -0.02 -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 -0.22 0.12 0.91 0.03 0.04 -0.06 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.01 -0.00 -0.00 0.01 -0.03 -0.00 0.00 -0.03 0.11 0.02 0.02 0.02 -0.00 0.02 -0.03 0.01 -0.03 0.03 0.00 0.00 0.00 0.02 -0.02 -0.01 0.20 0.13 -0.08 0.06 -0.06 -0.03 0.01 0.02 0.04 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 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 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.08 -0.03 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 0.06 -0.04 -0.27 -0.01 -0.01 0.02 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.01 0.00 -0.00 0.01 -0.02 -0.01 -0.01 -0.00 0.00 -0.01 0.01 0.01 -0.02 0.02 0.00 0.01 0.01 0.02 -0.01 -0.01 0.71 0.48 -0.28 0.16 -0.17 -0.08 0.06 0.10 0.16 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.02 -0.08 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 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.26 0.76 -0.07 -0.02 0.16 -0.57 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.04 0.00 0.01 -0.00 0.00 -0.00 -0.01 0.05 -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 -0.01 0.01 0.03 0.00 0.00 -0.00 0.35 -0.02 -0.16 0.02 -0.08 0.00 0.05 0.05 0.05 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.01 0.00 0.00 0.13 -0.56 0.70 0.02 -0.04 0.05 0.00 0.00 0.01 0.01 -0.01 -0.01 -0.00 -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 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.08 0.01 0.02 0.00 -0.00 0.00 0.01 -0.02 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 -0.02 -0.01 -0.01 0.01 0.80 -0.05 -0.36 0.05 -0.17 0.01 0.10 0.10 0.10 -0.00 0.00 -0.00 0.00 0.00 -0.01 -0.00 -0.00 -0.00 -0.06 0.25 -0.32 -0.01 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 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 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 0.01 -0.07 -0.00 0.00 -0.02 0.01 0.03 0.03 -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 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 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 -0.02 -0.07 -0.06 0.06 -0.12 0.76 0.02 -0.03 0.20 -0.11 -0.38 -0.32 0.04 0.26 -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 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 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 0.03 0.00 -0.01 0.03 -0.01 0.01 -0.05 0.00 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 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 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 -0.12 -0.40 -0.33 -0.03 0.06 -0.39 0.06 -0.10 0.62 -0.01 -0.02 -0.02 0.05 0.36 -0.15 0.00 -0.00 0.00 -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 0.05 -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 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.02 0.01 0.07 -0.38 -0.59 0.70 -0.01 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 0.03 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 0.01 -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 0.00 0.00 -0.00 0.00 -0.00 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 -0.03 0.00 -0.01 0.03 0.00 0.00 0.01 0.01 0.03 0.02 -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 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 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 0.13 0.43 0.35 -0.03 0.06 -0.38 -0.01 0.02 -0.14 -0.10 -0.34 -0.27 0.08 0.51 -0.20 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 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 -0.03 -0.00 0.01 -0.02 -0.00 0.01 -0.04 -0.01 -0.04 -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 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -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 0.12 0.42 0.34 0.02 -0.04 0.24 0.05 -0.08 0.50 0.13 0.43 0.35 0.03 0.18 -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 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -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 -0.00 0.00 -0.01 0.00 -0.01 0.05 -0.01 -0.03 -0.03 -0.01 -0.05 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 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.06 -0.22 -0.17 0.01 -0.03 0.16 -0.05 0.08 -0.51 0.10 0.34 0.28 0.09 0.59 -0.24 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -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 -0.08 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 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.06 0.25 -0.12 0.19 0.90 -0.26 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.02 -0.08 0.04 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 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.21 0.84 -0.41 -0.06 -0.26 0.08 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</array>
                        <array dataType="xsd:integer" dictRef="cc:atomicNumber" size="51">8 8 8 6 6 6 6 6 6 6 6 6 6 6 6 6 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 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="51">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</array>
                        <array dataType="xsd:integer" dictRef="x:elementType" size="51">8 8 8 6 6 6 6 6 6 6 6 6 6 6 6 6 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 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:double" dictRef="cc:atomicmass" size="51">15.99491 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 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 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">338.18819</scalar>
                     <matrix cols="3"
                             dataType="xsd:double"
                             dictRef="cc:moi.eigenvectors"
                             rows="3">0.99999 -0.00333 9.7E-4 0.00333 0.99999 0.00124 -9.7E-4 -0.00123 1.0</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">0.01479 0.00744 0.00568</array>
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.30825 0.15511 0.11839</array>
                     <scalar dataType="xsd:double" dictRef="cc:zpe" units="u:jmol-1">1126149.4</scalar>
                     <array dataType="xsd:double" dictRef="cc:vibtemp" size="147">23.52 40.42 56.68 61.73 81.07 95.11 106.95 113.62 124.88 176.48 183.57 212.90 225.28 240.39 272.70 293.56 315.21 324.57 349.69 361.71 391.53 403.69 440.35 461.42 467.42 519.34 548.86 559.20 594.14 595.39 616.44 673.65 680.12 713.26 752.47 833.38 864.72 891.99 913.75 915.96 958.56 1000.03 1023.95 1065.82 1072.83 1119.91 1138.50 1158.67 1201.72 1204.50 1205.71 1232.98 1235.47 1245.67 1249.35 1324.84 1327.56 1371.04 1390.69 1392.22 1393.94 1412.02 1422.66 1429.57 1439.56 1448.25 1455.19 1464.78 1465.27 1483.74 1514.15 1535.89 1562.21 1587.08 1590.45 1593.75 1635.85 1652.82 1657.26 1673.03 1707.01 1713.18 1713.93 1743.57 1745.88 1751.07 1761.98 1790.15 1828.87 1864.17 1915.80 1917.26 1948.84 1957.09 1983.03 1996.46 2020.86 2033.54 2036.90 2038.48 2047.30 2054.69 2081.71 2118.08 2123.88 2134.93 2137.61 2139.14 2141.00 2147.75 2150.24 2151.41 2176.07 2185.64 2199.17 2275.91 2335.40 2367.16 2370.49 2476.86 2536.13 4318.25 4327.13 4334.19 4336.02 4346.38 4370.03 4393.40 4414.55 4415.98 4416.53 4423.28 4438.92 4460.77 4466.21 4478.36 4491.43 4518.69 4528.26 4538.91 4548.92 4557.51 4562.20 4573.92 4588.66 4692.06 4695.47</array>
                  </list>
               </property>
               <property dictRef="cc:zeropoint">
                  <list id="l716.zeropoint">
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.correction"
                             units="nonsi:hartree">0.428928</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.thermalcorrener"
                             units="nonsi:hartree">0.453701</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.thermalcorrenthalpy"
                             units="nonsi:hartree">0.454646</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.thermalcorrgfe"
                             units="nonsi:hartree">0.372866</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectzpe"
                             units="nonsi:hartree">-1079.546603</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectthermal"
                             units="nonsi:hartree">-1079.521829</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectthermalent"
                             units="nonsi:hartree">-1079.520885</scalar>
                     <scalar dataType="xsd:string"
                             dictRef="cc:zpe.sumelectthermalfe"
                             units="nonsi:hartree">-1079.602664</scalar>
                  </list>
               </property>
               <property>
                  <module cmlx:templateRef="l716.thermoprops">
                     <list cmlx:templateRef="total">
                        <scalar dataType="xsd:double" dictRef="cc:ethermo.total">284.702</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:cv.total">94.601</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:s.total">172.119</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">43.350</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">35.295</scalar>
                     </list>
                     <list cmlx:templateRef="vib">
                        <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">282.924</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:cv.vib">88.640</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:s.vob">93.475</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">1.986</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">7.035</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">2</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">5.960</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">3</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.594</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.981</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">5.289</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">4</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.595</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.980</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">5.120</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">5</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.596</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.975</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">4.581</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">6</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.598</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.970</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">4.266</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">7</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.599</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.966</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">4.035</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">8</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.600</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.963</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">3.916</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">9</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.601</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.958</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">3.731</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">10</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.610</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.930</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">3.058</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">11</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.611</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.926</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.982</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">12</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.617</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.905</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.698</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">13</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.620</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.895</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.591</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">14</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.624</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.883</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.468</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">15</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.633</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.854</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.232</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">16</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.640</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.834</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">2.096</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">17</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.647</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.812</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.967</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">18</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.650</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.802</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.914</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">19</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.659</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.774</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.780</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">20</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.663</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.760</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.721</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">21</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.675</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.725</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.583</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">22</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.680</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.710</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.530</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">23</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.696</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.662</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.384</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">24</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.706</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.634</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.307</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">25</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.709</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.626</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.285</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">26</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.735</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.553</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.118</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">27</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.751</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.510</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.033</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">28</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.757</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.494</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">1.005</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">29</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.777</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.442</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.916</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">30</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.777</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.440</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.913</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">31</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.790</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.408</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.864</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">32</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.825</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.321</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.743</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">33</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.830</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.311</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.730</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">34</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.851</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.259</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.669</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">35</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.878</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.199</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.603</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">36</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.936</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.076</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.487</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">37</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.959</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">1.030</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.448</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:integer" dictRef="g:nvib">38</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:ethermo.vib">0.980</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:cv.vib">0.990</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:s.vob">0.417</scalar>
                        </list>
                     </list>
                     <list cmlx:templateRef="totalv0">
                        <scalar dataType="xsd:double" dictRef="cc:q.v0">0.611664e+26</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.v0">25.786513</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.v0">59.375641</scalar>
                     </list>
                     <list cmlx:templateRef="vibv0">
                        <scalar dataType="xsd:double" dictRef="cc:q.vibv0">0.216915e+11</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.vibv0">10.336290</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.vibv0">23.800188</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">0.244451e+09</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.trans">8.388192</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.trans">19.314525</scalar>
                     </list>
                     <list cmlx:templateRef="rot">
                        <scalar dataType="xsd:double" dictRef="cc:q.rot">0.115354e+08</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:logq.rot">7.062031</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:lnq.rot">16.260928</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">0.0087 -0.0434 -0.8368</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">0.8380</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-145.5340 -143.2829 -148.6992</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">3.6620 -0.5962 1.2056</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">0.3047 2.5558 -2.8605 3.6620 -0.5962 1.2056</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">69.6613 44.9846 0.6973 -0.2609 -9.1503 -11.4294 -8.1734 -0.2555 13.4012 -0.2371</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-8427.1344 -3468.4503 -1059.4939 -60.8800 71.6234 135.7646 -33.6727 -5.9333 -5.7029 -1976.9070 -1514.2346 -790.4392 13.5706 19.8375 35.0564</array>
                  </list>
               </property>
               <property dictRef="cc:virtualorbs">
                  <array dataType="xsd:string" delimiter="|" size="614">(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)|(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)|(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)|(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)|(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)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)</array>
               </property>
               <property dictRef="cc:occupiedorbs">
                  <array dataType="xsd:string" delimiter="|" size="91">(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>
               </property>
            </propertyList>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l9999.archive" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:string" dictRef="g:zmat">0</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:electronicstate">1-A</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:hfenergy" units="nonsi:hartree">-1079.9755305</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsd" units="nonsi:unknown">4.744E-9</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rmsf" units="nonsi:unknown">3.241E-6</scalar>
                  <scalar dataType="xsd:string" dictRef="x:ZeroPoint">0.4289277</scalar>
                  <scalar dataType="xsd:string" dictRef="x:Thermal">0.4537014</scalar>
                  <scalar dataType="xsd:string" dictRef="x:ETot">-1079.5218292</scalar>
                  <scalar dataType="xsd:string" dictRef="x:HTot">-1079.520885</scalar>
                  <scalar dataType="xsd:string" dictRef="x:GTot">-1079.6026645</scalar>
                  <scalar dataType="xsd:string" dictRef="x:Quadrupole">0.2823842,1.8800642,-2.1624484,2.7467413,-0.6026754,0.6722195</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:pointgroup">C01 [X(C22H26O3)]</scalar>
                  <array dataType="xsd:double"
                         dictRef="cc:dipole"
                         size="3"
                         units="nonsi:debye">-0.0054215 -0.0301945 -0.3282544</array>
                  <array dataType="xsd:double"
                         dictRef="cc:dipolederiv"
                         size="459"
                         units="nonsi:unknown">-0.7798993 0.4559784 0.047968 0.6611726 -1.5757154 0.0519179 0.1243847 0.0333269 -0.3816636 -0.6330836 0.0739296 0.2626269 0.1666232 -0.6868429 0.1003933 0.1914409 0.1407386 -0.7612737 -0.8024185 0.1186164 -0.2231323 -0.034289 -0.4859412 0.1259022 -0.2754042 0.2249515 -0.2584619 0.1789087 0.0668648 -0.0250415 -0.1891143 0.3625298 0.0761182 -0.0018751 0.044561 0.1089409 0.1703393 -0.1121418 0.0043986 -0.0850938 0.2721572 0.1030183 0.0550071 -0.0821872 0.0243264 -0.2682592 0.3309733 0.1252521 0.3591525 -0.6637544 -0.234678 0.1152112 -0.1992074 -0.0744551 -0.0698152 0.0241546 0.0828148 0.0224287 0.0880094 0.0121332 0.0963731 0.0037385 0.0015771 0.0995637 -0.006425 0.0429599 0.0491196 0.0844694 0.002763 -0.0139945 0.0383751 0.0481703 -0.1546381 0.0489193 0.0195295 0.206077 -0.0709182 -0.0642391 -0.0900685 -0.1759376 -0.071143 0.7379755 -0.5707892 -0.4373439 -0.7265972 1.868018 -0.1095935 -0.3778261 -0.0960624 0.8390007 0.3326631 0.0580753 0.0372401 -0.0103498 -0.047706 -0.1947584 0.0914201 -0.1462564 0.0779164 -0.0425601 -0.0328159 0.0458345 0.0192634 0.1129566 0.0495419 0.015099 0.02205 0.0712947 -0.0223634 -0.0028801 -0.0177527 0.0002432 0.0356237 0.1191254 0.0191333 0.1041304 0.0247284 0.8802048 -0.3195926 0.0165632 -0.2918232 0.6056456 0.0714093 -0.0950696 0.2658289 0.3322147 -0.0646449 0.0954536 0.0324008 0.0939663 -0.0130017 -0.047815 -0.0473169 -0.113732 -0.1282378 -0.2606021 -0.0493194 -0.0053377 0.0423843 -0.1108557 0.0090364 -0.0501438 -0.0349886 -0.1510293 0.3988632 -0.0886763 0.2131734 -0.1039587 -0.0331953 -0.068497 0.2684571 -0.088352 0.02729 0.3889367 0.1333086 0.0475101 0.0446254 0.3641446 -0.1568331 0.2033747 -0.0836391 0.0524534 0.1645591 -0.0454833 -0.0222505 0.027839 0.0845483 0.0507251 -0.0870837 -0.0658771 0.1956218 -0.1161102 0.0031831 -0.0059681 0.1175047 0.2923704 -0.0866192 -0.0656083 -0.109401 -0.0252971 -0.1272448 0.0521103 0.0450716 -0.003349 -0.0554386 0.0662336 0.0352033 0.1259333 -0.0557749 -0.1421993 0.0015652 0.0108289 -0.0195354 -0.1443578 0.0036304 0.0809742 -0.0070432 0.0711218 -0.1339957 0.0148294 0.0519693 0.0241911 -0.021092 -0.0254711 0.0034291 -0.0194685 0.122044 -0.127606 0.0256833 0.025611 0.0639187 0.0486335 0.0673064 0.0432756 0.0637654 0.0154535 -0.1430424 0.0187806 0.0099695 0.0333398 0.0362507 -0.0603748 0.0065753 -0.0528214 -0.0466812 -0.0499669 -0.0194544 0.0128175 -0.0348153 -0.0286889 -0.0389031 0.049645 -0.0271415 -0.0878242 0.0165887 -0.0053526 0.0301687 -0.0262329 -0.0207951 0.0308271 0.037573 0.0387986 -0.0157692 0.0079044 -0.0288096 0.0798627 -0.0239943 0.0926089 -0.0052946 0.0739723 0.0016121 0.0321178 0.0414128 0.0717234 -0.0275733 0.1106604 -0.1454209 0.0550445 -0.0352117 0.0036945 0.0323605 -0.0502136 -0.0645052 -0.1053209 -0.1145671 -0.0088885 -0.0759761 -0.0957631 -0.0143158 -0.0129284 -0.0413797 0.0599765 0.0136225 0.1374513 -0.1317939 -0.0004245 0.0136055 0.0187681 0.066088 0.045314 0.0140953 -0.0472283 -0.0071908 0.0501027 0.0620655 0.0247687 0.0448948 -0.1354355 -0.1028299 -0.0428547 -0.0323322 -0.1286854 -0.0133727 -0.0591745 -0.0861995 -0.0731014 0.0146195 0.0160195 -0.0265846 -0.0203104 -0.0158466 0.020066 0.0873115 -0.0075944 0.1375926 -0.0120485 0.0196123 0.0481837 -0.0430932 -0.0052614 -0.0127634 0.0747095 -0.0065731 0.114522 -0.0484464 -0.0400901 -0.0935361 -0.0590385 -0.1321404 -0.0045158 -0.0344472 -0.0772543 -0.0752623 -0.0316075 -0.0171259 0.0018825 0.0010627 0.0501158 -0.0580868 -0.0410858 0.0680311 -0.0096744 0.012801 -0.0382622 -0.0714531 0.0855127 -0.0640096 -0.0009862 0.0540024 0.041682 0.0485546 0.0346683 -0.0430894 0.0703244 0.0000512 0.1032478 0.0214779 0.0131481 -0.001204 -0.0137167 0.0080416 0.0215585 -0.0391832 -0.0922665 -0.0361093 -0.0162431 -0.0946962 -0.118365 -0.0515021 -0.0655761 -0.0181078 -0.0125668 -0.0041062 -0.0281434 -0.1327985 -0.0148062 0.0318357 0.0405517 0.0773045 -0.046182 0.0495062 -0.0204758 0.0393718 0.069757 0.0695106 0.0051093 -0.0586305 -0.0460723 0.187871 0.0010596 -0.0220079 -0.0324605 0.0341932 0.0413658 -0.0297256 0.0584832 0.1079676 0.0673164 -0.051601 -0.024437 -0.0472503 0.0222728 0.0460553 -0.0337502 0.0480209 0.143031 -0.0067055 -0.0605125 -0.0060477 -0.0871011 0.0123966 -0.0434885 -0.0573076 0.0144794 -0.0978007 -0.094201 0.0050961 0.0210516 0.0258562 -0.0842863 0.0091064 0.0741914 -0.0091521 0.0466516 0.123001 -0.0296953 -0.0481143 -0.0220723 -0.0215186 -0.0587767 -0.0536269 -0.0746654 0.0435363 0.1438502 -0.0052651 -0.0079168 -0.0015394 0.0620009 0.0418255 -0.0182857 0.0283553 -0.0881346 0.1278793 -0.0094621 -0.0389535 -0.019182 0.0590092 0.0219277 -0.0112731 0.0290894 -0.0879909 0.1306737 -0.0330817 -0.0222228 -0.0583027 -0.0404855 -0.0666042 -0.035635 -0.0741321 0.0098893 0.135621 -0.0222317 -0.0075998 -0.049538 -0.069779 0.0664024 0.0023873 0.0614518 0.0424205</array>
                  <array dataType="xsd:double"
                         delimiter="|"
                         dictRef="cc:polarizability"
                         size="6"
                         units="nonsi:unknown">286.9409633|10.9389673|274.7742707|12.1406511|-10.9032231|218.5624821</array>
               </module>
            </module>
            <molecule formalCharge="0" id="mol9999" spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="2.25656683"
                        y3="2.09561415"
                        z3="-0.03198735">
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.51" size="3">-0.000001983 -0.000004853 0.000003881</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.52" size="3">0.000000241 0.000002490 0.000005407</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.53" size="3">-0.000000284 0.000001465 -0.000008415</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.54" size="3">-0.000000771 0.000001650 -0.000002826</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.55" size="3">0.000001839 0.000003384 -0.000004791</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.56" size="3">0.000007305 -0.000003398 0.000007753</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.57" size="3">-0.000001847 -0.000005631 0.000003226</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.58" size="3">0.000002814 -0.000000473 -0.000003735</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.59" size="3">-0.000002835 0.000001548 0.000003170</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.60" size="3">-0.000005009 -0.000000645 -0.000013564</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.61" size="3">0.000001766 -0.000001126 0.000000791</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.62" size="3">0.000000519 -0.000004083 -0.000001231</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.63" size="3">-0.000000343 0.000001575 -0.000005274</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.64" size="3">0.000004434 0.000003946 -0.000001139</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.65" size="3">-0.000003542 -0.000005518 0.000002623</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.66" size="3">0.000007012 0.000004989 -0.000002450</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.67" size="3">0.000004362 0.000000961 0.000001033</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.68" size="3">-0.000004399 -0.000002223 0.000010755</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.69" size="3">-0.000000718 -0.000000574 -0.000004753</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.70" size="3">0.000001796 0.000004609 0.000010264</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.71" size="3">0.000000174 0.000003638 -0.000007163</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.72" size="3">-0.000003739 -0.000008902 -0.000002072</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.73" size="3">-0.000002290 -0.000008630 -0.000000162</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.74" size="3">-0.000000282 0.000004413 -0.000005530</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.75" size="3">0.000000691 0.000002845 0.000005248</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.76" size="3">-0.000001080 -0.000001113 -0.000000289</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.77" size="3">-0.000000466 0.000001886 0.000000206</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.78" size="3">0.000001607 -0.000000217 -0.000001008</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.79" size="3">0.000000376 0.000001266 -0.000001457</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.80" size="3">-0.000000167 0.000000154 -0.000000648</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.81" size="3">-0.000000729 0.000000679 -0.000000278</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.82" size="3">-0.000001260 -0.000000082 0.000000791</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.83" size="3">-0.000000995 -0.000000281 -0.000000382</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.84" size="3">0.000000052 -0.000000258 -0.000001405</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.85" size="3">0.000000510 0.000000461 -0.000001834</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.86" size="3">-0.000000232 0.000002064 0.000000607</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.87" size="3">0.000000886 0.000000445 -0.000001090</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.88" size="3">-0.000000526 -0.000001162 -0.000000441</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.89" size="3">0.000000881 0.000001219 0.000001192</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.90" size="3">-0.000001351 0.000001290 0.000001480</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.91" size="3">0.000000044 0.000000344 0.000001660</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.92" size="3">0.000000007 -0.000001666 -0.000000967</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.93" size="3">-0.000001874 -0.000000243 0.000003205</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.94" size="3">-0.000001896 0.000002258 0.000006455</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.95" size="3">0.000000606 0.000000778 0.000001617</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.96" size="3">-0.000000042 0.000000692 0.000000337</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.97" size="3">0.000000418 -0.000000561 0.000000969</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.98" size="3">0.000000334 0.000001367 0.000000503</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.99" size="3">0.000000460 -0.000000396 0.000000104</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.100" size="3">-0.000000358 -0.000000124 0.000000018</array>
                     </property>
                     <property dictRef="cc:force">
                        <array dataType="xsd:double" id="a1.101" size="3">-0.000000118 -0.000000255 -0.000000390</array>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a2"
                        x3="1.81224366"
                        y3="0.36686497"
                        z3="1.35479118"/>
                  <atom elementType="O"
                        id="a3"
                        x3="-2.02156712"
                        y3="3.21049056"
                        z3="-0.85936052"/>
                  <atom elementType="C"
                        id="a4"
                        x3="4.23242527"
                        y3="-1.06103534"
                        z3="-0.01370601"/>
                  <atom elementType="C"
                        id="a5"
                        x3="3.03996679"
                        y3="-1.38541358"
                        z3="-0.86328071"/>
                  <atom elementType="C"
                        id="a6"
                        x3="3.34112958"
                        y3="0.08961139"
                        z3="-0.48681963"/>
                  <atom elementType="C"
                        id="a7"
                        x3="4.26024772"
                        y3="-1.45786023"
                        z3="1.45059784"/>
                  <atom elementType="C"
                        id="a8"
                        x3="5.5983711"
                        y3="-1.12568747"
                        z3="-0.67677605"/>
                  <atom elementType="C"
                        id="a9"
                        x3="1.84743565"
                        y3="-2.1053184"
                        z3="-0.3384449"/>
                  <atom elementType="C"
                        id="a10"
                        x3="2.40531525"
                        y3="0.81332877"
                        z3="0.39752975"/>
                  <atom elementType="C"
                        id="a11"
                        x3="0.60859611"
                        y3="-2.01213181"
                        z3="-0.83508011"/>
                  <atom elementType="C"
                        id="a12"
                        x3="-0.53786331"
                        y3="-2.77486228"
                        z3="-0.22926095"/>
                  <atom elementType="C"
                        id="a13"
                        x3="0.24041862"
                        y3="-1.11669155"
                        z3="-1.98869786"/>
                  <atom elementType="C"
                        id="a14"
                        x3="1.30037411"
                        y3="2.91680672"
                        z3="0.69263227"/>
                  <atom elementType="C"
                        id="a15"
                        x3="-0.08468514"
                        y3="2.75726907"
                        z3="0.16247688"/>
                  <atom elementType="C"
                        id="a16"
                        x3="-0.9559684"
                        y3="1.61430098"
                        z3="0.28542818"/>
                  <atom elementType="C"
                        id="a17"
                        x3="-0.78317335"
                        y3="3.68465242"
                        z3="-0.5430121"/>
                  <atom elementType="C"
                        id="a18"
                        x3="-2.11292367"
                        y3="1.93843486"
                        z3="-0.35050502"/>
                  <atom elementType="C"
                        id="a19"
                        x3="-3.41586981"
                        y3="1.2554217"
                        z3="-0.61746743"/>
                  <atom elementType="C"
                        id="a20"
                        x3="-3.56852208"
                        y3="-0.11582558"
                        z3="0.00507509"/>
                  <atom elementType="C"
                        id="a21"
                        x3="-3.41859266"
                        y3="-0.30318977"
                        z3="1.38437588"/>
                  <atom elementType="C"
                        id="a22"
                        x3="-3.9196297"
                        y3="-1.21469663"
                        z3="-0.78337427"/>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.61463487"
                        y3="-1.55718145"
                        z3="1.95727115"/>
                  <atom elementType="C"
                        id="a24"
                        x3="-4.12691096"
                        y3="-2.4695613"
                        z3="-0.21165575"/>
                  <atom elementType="C"
                        id="a25"
                        x3="-3.97350371"
                        y3="-2.64508418"
                        z3="1.16095737"/>
                  <atom elementType="H"
                        id="a26"
                        x3="3.26210856"
                        y3="-1.58006476"
                        z3="-1.90980279"/>
                  <atom elementType="H"
                        id="a27"
                        x3="3.74161741"
                        y3="0.70657121"
                        z3="-1.28151926"/>
                  <atom elementType="H"
                        id="a28"
                        x3="3.28819904"
                        y3="-1.36067442"
                        z3="1.92850895"/>
                  <atom elementType="H"
                        id="a29"
                        x3="4.59897921"
                        y3="-2.49507973"
                        z3="1.54301873"/>
                  <atom elementType="H"
                        id="a30"
                        x3="4.96783106"
                        y3="-0.82578926"
                        z3="1.9959298"/>
                  <atom elementType="H"
                        id="a31"
                        x3="5.99830691"
                        y3="-2.14332129"
                        z3="-0.61972215"/>
                  <atom elementType="H"
                        id="a32"
                        x3="5.55307847"
                        y3="-0.84143115"
                        z3="-1.73143405"/>
                  <atom elementType="H"
                        id="a33"
                        x3="6.30504858"
                        y3="-0.45690711"
                        z3="-0.17538928"/>
                  <atom elementType="H"
                        id="a34"
                        x3="2.00946757"
                        y3="-2.74933597"
                        z3="0.52080646"/>
                  <atom elementType="H"
                        id="a35"
                        x3="-0.21218552"
                        y3="-3.42319595"
                        z3="0.58679118"/>
                  <atom elementType="H"
                        id="a36"
                        x3="-1.04355082"
                        y3="-3.39238439"
                        z3="-0.98056932"/>
                  <atom elementType="H"
                        id="a37"
                        x3="-1.29371383"
                        y3="-2.08698079"
                        z3="0.16136835"/>
                  <atom elementType="H"
                        id="a38"
                        x3="1.09146746"
                        y3="-0.56278329"
                        z3="-2.38604084"/>
                  <atom elementType="H"
                        id="a39"
                        x3="-0.51469892"
                        y3="-0.38827092"
                        z3="-1.67322456"/>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.20385601"
                        y3="-1.70079805"
                        z3="-2.80338789"/>
                  <atom elementType="H"
                        id="a41"
                        x3="1.65353177"
                        y3="3.9375693"
                        z3="0.54837191"/>
                  <atom elementType="H"
                        id="a42"
                        x3="1.35094135"
                        y3="2.66005516"
                        z3="1.75177799"/>
                  <atom elementType="H"
                        id="a43"
                        x3="-0.72139657"
                        y3="0.68757409"
                        z3="0.78170607"/>
                  <atom elementType="H"
                        id="a44"
                        x3="-0.55338292"
                        y3="4.68283072"
                        z3="-0.87777881"/>
                  <atom elementType="H"
                        id="a45"
                        x3="-3.55698069"
                        y3="1.18451562"
                        z3="-1.70147206"/>
                  <atom elementType="H"
                        id="a46"
                        x3="-4.22055647"
                        y3="1.90959269"
                        z3="-0.25694652"/>
                  <atom elementType="H"
                        id="a47"
                        x3="-3.14421445"
                        y3="0.53867537"
                        z3="2.01030734"/>
                  <atom elementType="H"
                        id="a48"
                        x3="-4.03371847"
                        y3="-1.08815215"
                        z3="-1.85507739"/>
                  <atom elementType="H"
                        id="a49"
                        x3="-3.48808383"
                        y3="-1.68518419"
                        z3="3.02646896"/>
                  <atom elementType="H"
                        id="a50"
                        x3="-4.39784658"
                        y3="-3.309813"
                        z3="-0.8410548"/>
                  <atom elementType="H"
                        id="a51"
                        x3="-4.12572785"
                        y3="-3.62107526"
                        z3="1.60740774"/>
               </atomArray>
               <bondArray/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">312.2335999999998</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1/22C.3O.26H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;1;2;3;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/rA:51nO0O0O0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.2566,2.0956,-.032;1.8122,.3669,1.3548;-2.0216,3.2105,-.8594;4.2324,-1.061,-.0137;3.04,-1.3854,-.8633;3.3411,.0896,-.4868;4.2602,-1.4579,1.4506;5.5984,-1.1257,-.6768;1.8474,-2.1053,-.3384;2.4053,.8133,.3975;.6086,-2.0121,-.8351;-.5379,-2.7749,-.2293;.2404,-1.1167,-1.9887;1.3004,2.9168,.6926;-.0847,2.7573,.1625;-.956,1.6143,.2854;-.7832,3.6847,-.543;-2.1129,1.9384,-.3505;-3.4159,1.2554,-.6175;-3.5685,-.1158,.0051;-3.4186,-.3032,1.3844;-3.9196,-1.2147,-.7834;-3.6146,-1.5572,1.9573;-4.1269,-2.4696,-.2117;-3.9735,-2.6451,1.161;3.2621,-1.5801,-1.9098;3.7416,.7066,-1.2815;3.2882,-1.3607,1.9285;4.599,-2.4951,1.543;4.9678,-.8258,1.9959;5.9983,-2.1433,-.6197;5.5531,-.8414,-1.7314;6.305,-.4569,-.1754;2.0095,-2.7493,.5208;-.2122,-3.4232,.5868;-1.0436,-3.3924,-.9806;-1.2937,-2.087,.1614;1.0915,-.5628,-2.386;-.5147,-.3883,-1.6732;-.2039,-1.7008,-2.8034;1.6535,3.9376,.5484;1.3509,2.6601,1.7518;-.7214,.6876,.7817;-.5534,4.6828,-.8778;-3.557,1.1845,-1.7015;-4.2206,1.9096,-.2569;-3.1442,.5387,2.0103;-4.0337,-1.0882,-1.8551;-3.4881,-1.6852,3.0265;-4.3978,-3.3098,-.8411;-4.1257,-3.6211,1.6074;</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:run.date">
                  <scalar dataType="xsd:string">10-Oct-2024</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">EM64L-G16RevC.01</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:degfreedom">
                  <scalar cmlx:templateRef="degfreedom" dataType="xsd:integer">147</scalar>
               </parameter>
               <parameter dictRef="cc:frameworkgroup">
                  <scalar cmlx:templateRef="framework" dataType="xsd:string">C1[X(C22H26O3)]</scalar>
               </parameter>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string">RB3LYP</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">6-311+G(d,p)</scalar>
               </parameter>
               <parameter dictRef="g:operation">
                  <scalar dataType="xsd:string">SP</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">#P</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">B3LYP</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">6-311+G(d,p)</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">EmpiricalDispersion=gd3</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">geom=check</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">guess=readoutput=wfx</scalar>
               </parameter>
            </parameterList>
            <molecule cmlx:templateRef="atom"
                      formalCharge="0"
                      id="mol.l202.orient"
                      spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="2.184856"
                        y3="2.180139"
                        z3="0.120011">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a2"
                        x3="1.732449"
                        y3="0.390783"
                        z3="1.424881">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a3"
                        x3="-2.087731"
                        y3="3.264701"
                        z3="-0.773666">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a4"
                        x3="4.208753"
                        y3="-0.945484"
                        z3="0.064266">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a5"
                        x3="3.043546"
                        y3="-1.252874"
                        z3="-0.828348">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a6"
                        x3="3.311906"
                        y3="0.210086"
                        z3="-0.385797">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a7"
                        x3="4.205466"
                        y3="-1.400345"
                        z3="1.511857">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a8"
                        x3="5.591992"
                        y3="-0.963485"
                        z3="-0.564999">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a9"
                        x3="1.849441"
                        y3="-2.010627"
                        z3="-0.363839">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a10"
                        x3="2.342657"
                        y3="0.88395"
                        z3="0.501926">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a11"
                        x3="0.622349"
                        y3="-1.915686"
                        z3="-0.888517">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a12"
                        x3="-0.527098"
                        y3="-2.718805"
                        z3="-0.343617">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a13"
                        x3="0.269716"
                        y3="-0.980116"
                        z3="-2.01482">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a14"
                        x3="1.197782"
                        y3="2.957507"
                        z3="0.851531">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a15"
                        x3="-0.170656"
                        y3="2.799164"
                        z3="0.279507">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a16"
                        x3="-1.0268"
                        y3="1.639568"
                        z3="0.334139">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a17"
                        x3="-0.865368"
                        y3="3.743824"
                        z3="-0.40652">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a18"
                        x3="-2.172108"
                        y3="1.972037"
                        z3="-0.318358">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a19"
                        x3="-3.456984"
                        y3="1.281326"
                        z3="-0.646164">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a20"
                        x3="-3.603974"
                        y3="-0.1159"
                        z3="-0.082841">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a21"
                        x3="-3.48632"
                        y3="-0.356294"
                        z3="1.291358">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a22"
                        x3="-3.917646"
                        y3="-1.187235"
                        z3="-0.923257">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.67725"
                        y3="-1.635013"
                        z3="1.808621">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a24"
                        x3="-4.119767"
                        y3="-2.466942"
                        z3="-0.407497">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a25"
                        x3="-3.998651"
                        y3="-2.695187"
                        z3="0.960584">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a26"
                        x3="3.295295"
                        y3="-1.402073"
                        z3="-1.875633">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a27"
                        x3="3.722808"
                        y3="0.86425"
                        z3="-1.144616">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a28"
                        x3="3.220156"
                        y3="-1.336647"
                        z3="1.967741">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a29"
                        x3="4.55792"
                        y3="-2.435379"
                        z3="1.571759">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a30"
                        x3="4.888951"
                        y3="-0.780411"
                        z3="2.100164">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a31"
                        x3="6.006217"
                        y3="-1.976636"
                        z3="-0.53805">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a32"
                        x3="5.569141"
                        y3="-0.637796"
                        z3="-1.60834">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a33"
                        x3="6.275117"
                        y3="-0.305124"
                        z3="-0.019152">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a34"
                        x3="1.999586"
                        y3="-2.686196"
                        z3="0.473054">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a35"
                        x3="-0.212212"
                        y3="-3.394559"
                        z3="0.454222">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a36"
                        x3="-1.003758"
                        y3="-3.312981"
                        z3="-1.131823">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a37"
                        x3="-1.303325"
                        y3="-2.058286"
                        z3="0.054213">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a38"
                        x3="1.121841"
                        y3="-0.398319"
                        z3="-2.367489">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a39"
                        x3="-0.504497"
                        y3="-0.276066"
                        z3="-1.690429">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.144466"
                        y3="-1.537464"
                        z3="-2.863405">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a41"
                        x3="1.538486"
                        y3="3.988292"
                        z3="0.75724">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a42"
                        x3="1.225361"
                        y3="2.659194"
                        z3="1.900586">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a43"
                        x3="-0.790477"
                        y3="0.697186"
                        z3="0.799118">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a44"
                        x3="-0.642769"
                        y3="4.757893"
                        z3="-0.695218">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a45"
                        x3="-3.569307"
                        y3="1.251956"
                        z3="-1.735442">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a46"
                        x3="-4.280731"
                        y3="1.908661"
                        z3="-0.281022">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a47"
                        x3="-3.241182"
                        y3="0.463674"
                        z3="1.957218">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a48"
                        x3="-4.006361"
                        y3="-1.019434"
                        z3="-1.99169">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a49"
                        x3="-3.575992"
                        y3="-1.803988"
                        z3="2.874819">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a50"
                        x3="-4.3614"
                        y3="-3.285109"
                        z3="-1.076666">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a51"
                        x3="-4.146911"
                        y3="-3.69044"
                        z3="1.363744">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
               </atomArray>
               <bondArray/>
               <formula concise="C22H26O3"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">312.2335999999998</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1/22C.3O.26H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;1;2;3;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/rA:51nO0O0O0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.1849,2.1801,.12;1.7324,.3908,1.4249;-2.0877,3.2647,-.7737;4.2088,-.9455,.0643;3.0435,-1.2529,-.8283;3.3119,.2101,-.3858;4.2055,-1.4003,1.5119;5.592,-.9635,-.565;1.8494,-2.0106,-.3638;2.3427,.884,.5019;.6223,-1.9157,-.8885;-.5271,-2.7188,-.3436;.2697,-.9801,-2.0148;1.1978,2.9575,.8515;-.1707,2.7992,.2795;-1.0268,1.6396,.3341;-.8654,3.7438,-.4065;-2.1721,1.972,-.3184;-3.457,1.2813,-.6462;-3.604,-.1159,-.0828;-3.4863,-.3563,1.2914;-3.9176,-1.1872,-.9233;-3.6772,-1.635,1.8086;-4.1198,-2.4669,-.4075;-3.9987,-2.6952,.9606;3.2953,-1.4021,-1.8756;3.7228,.8642,-1.1446;3.2202,-1.3366,1.9677;4.5579,-2.4354,1.5718;4.889,-.7804,2.1002;6.0062,-1.9766,-.5381;5.5691,-.6378,-1.6083;6.2751,-.3051,-.0192;1.9996,-2.6862,.4731;-.2122,-3.3946,.4542;-1.0038,-3.313,-1.1318;-1.3033,-2.0583,.0542;1.1218,-.3983,-2.3675;-.5045,-.2761,-1.6904;-.1445,-1.5375,-2.8634;1.5385,3.9883,.7572;1.2254,2.6592,1.9006;-.7905,.6972,.7991;-.6428,4.7579,-.6952;-3.5693,1.252,-1.7354;-4.2807,1.9087,-.281;-3.2412,.4637,1.9572;-4.0064,-1.0194,-1.9917;-3.576,-1.804,2.8748;-4.3614,-3.2851,-1.0767;-4.1469,-3.6904,1.3637;</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l1" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l1.end">
                     <array dataType="xsd:string" dictRef="g:kk" size="1">oldchk=opt-b3lyp-pople.chk</array>
                     <scalar cmlx:templateRef="title" dataType="xsd:string" dictRef="cc:title">#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 geom=check guess=read ou</scalar>
                     <list cmlx:templateRef="control">
                        <scalar dataType="xsd:string" dictRef="g:control">1/29=2,38=1,172=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">2/12=2,40=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">3/5=4,6=6,7=111,11=2,14=-4,25=1,30=1,74=-5,116=-2,124=31/1,2,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">4/5=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">5/5=2,38=6/2</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">99/5=1,6=200,9=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">Wavefunction Resmethrin_RS CONF10 gas</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>
                  <module cmlx:templateRef="l101.isotope2">
                     <array cmlx:templateRef="atom"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">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</array>
                     <array cmlx:templateRef="iatwgt"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">16 16 16 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 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</array>
                     <array cmlx:templateRef="atmwgt"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="51">15.9949146 15.9949146 15.9949146 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250</array>
                     <array cmlx:templateRef="nucspn"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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</array>
                     <array cmlx:templateRef="atzeff"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="51">5.6000000 5.6000000 5.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000</array>
                  </module>
                  <list cmlx:templateRef="rest">
                     <scalar dataType="xsd:string" dictRef="x:l101">(Enter /usr/local/gaussian/gaussian16/g16/l101.exe)</scalar>
                  </list>
               </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">6-311+G(d,p)</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:diffuse">(5D, 7F)</scalar>
                     <module cmlx:templateRef="ernie">
                        <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                        <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                        <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                     </module>
                     <list cmlx:templateRef="symmadaptcart">
                        <array dataType="xsd:integer" dictRef="cc:adapted" size="1">731</array>
                        <array dataType="xsd:string" dictRef="cc:symm" size="1">A</array>
                     </list>
                     <list cmlx:templateRef="symmadapt">
                        <array dataType="xsd:integer" dictRef="cc:adapted" size="1">706</array>
                        <array dataType="xsd:string" dictRef="cc:symm" size="1">A</array>
                     </list>
                     <scalar dataType="xsd:integer" dictRef="cc:basiscount">706</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:primbasis">1108</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:cartesianbasis">731</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:alphae">91</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:betae">91</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:nucrepener">2216.2392900239</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:natoms">51</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">51</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">51</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>
                     <scalar dataType="xsd:string" dictRef="g:misc">IExCor=  402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX=  0.200000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  0.800000  0.720000  1.000000  0.810000 ScalE2=  1.000000  1.000000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=131</scalar>
                  </module>
                  <module cmlx:templateRef="l301.dispersion">
                     <scalar dataType="xsd:string" dictRef="g:empdispersion">Grimme-D3</scalar>
                     <scalar dataType="xsd:double" dictRef="g:dispenergy" units="nonsi:hartree">-0.0582576528</scalar>
                  </module>
               </module>
               <module cmlx:templateRef="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.stoich">
                     <scalar cmlx:templateRef="stoich"
                             dataType="xsd:string"
                             dictRef="g:stoichiometry">C22H26O3</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:pointgroup">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestconciseabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.3082482 0.1551150 0.1183910</array>
                  </module>
               </module>
               <module cmlx:templateRef="l302">
                  <module cmlx:templateRef="l302.basis">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="11">NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="5">One-electron integrals computed using PRISM.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="6">One-electron integral symmetry used in STVInt</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NBasis= 706 RedAO= T EigKep= 1.11D-06 NBF= 706</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="7">NBsUse= 705 1.00D-06 EigRej= 9.72D-07 NBFU= 705</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l302.basis2">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="5">Precomputing XC quadrature grid using</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">NSgBfM= 726 726 726 726 726 MxSgAt= 51 MxSgA2= 51.</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l303.basis">
                  <list cmlx:templateRef="l303">
                     <scalar dataType="xsd:integer" dictRef="g:dipdrv">1</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l502">
                  <scalar dataType="xsd:string" dictRef="g:l502.type">Closed</scalar>
                  <module cmlx:templateRef="l502.cycle">
                     <list cmlx:templateRef="cycle">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="cc:cycle">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:pass">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:idiag">1</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="l502.e">
                        <list cmlx:templateRef="l502.e">
                           <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553054854</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553054843</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000000000116</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <module cmlx:templateRef="l502.footer">
                     <list cmlx:templateRef="scfdone">
                        <list>
                           <scalar dataType="xsd:double" dictRef="g:rbhflyp" units="nonsi:hartree">-1079.97553055</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:ncycle">2</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="scfdone">
                        <list cmlx:templateRef="scfdone">
                           <list>
                              <scalar dataType="xsd:double" dictRef="cc:kinener">1.075265705475e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:potener">-6.946104992556e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:eener">2.574682724161e+03</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <list cmlx:templateRef="l502">
                     <scalar dataType="xsd:string" dictRef="g:l502">Using DIIS extrapolation, IDIIS=  1040.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NGot=  1415577600 LenX=  1414494764 LenY=  1413959672</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on RMS density matrix=1.00D-08 within 128 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on MAX density matrix=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on             energy=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">No special actions if energy rises.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Fock matrices will be formed incrementally for  20 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502"/>
                  </list>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:jobtime">
                  <scalar dataType="xsd:string">PT1558.800S</scalar>
               </property>
               <property dictRef="cc:jobdatetime.end">
                  <scalar dataType="xsd:date">2024-10-10T02:59:04.000</scalar>
               </property>
               <property dictRef="cc:popanal">
                  <module cmlx:templateRef="l601.popanal">
                     <array dataType="xsd:double" dictRef="g:alphaocc" size="91">-19.18979 -19.16124 -19.10365 -10.29666 -10.23436 -10.23152 -10.22377 -10.19779 -10.19408 -10.19374 -10.18736 -10.18679 -10.18153 -10.18138 -10.18097 -10.18074 -10.17982 -10.17955 -10.17061 -10.16775 -10.16643 -10.15620 -10.15589 -10.15514 -10.15187 -1.11491 -1.10027 -1.01518 -0.88334 -0.87016 -0.82025 -0.80760 -0.80344 -0.75731 -0.75400 -0.74529 -0.72803 -0.69683 -0.69202 -0.68629 -0.68338 -0.64005 -0.61648 -0.60296 -0.58840 -0.57220 -0.55683 -0.54070 -0.52832 -0.52466 -0.51435 -0.49491 -0.48091 -0.47811 -0.47144 -0.46639 -0.45923 -0.45461 -0.45277 -0.44219 -0.44037 -0.43104 -0.42975 -0.42923 -0.41836 -0.41645 -0.41153 -0.40542 -0.39943 -0.39312 -0.38730 -0.38276 -0.38085 -0.37487 -0.36938 -0.36583 -0.35871 -0.35470 -0.35357 -0.35133 -0.35043 -0.32915 -0.30941 -0.29711 -0.28638 -0.28112 -0.27423 -0.26341 -0.25853 -0.23237 -0.22562</array>
                     <array dataType="xsd:double" dictRef="g:alphavirt" size="614">-0.02411 -0.02077 -0.01072 -0.00482 -0.00303 0.00336 0.01154 0.01269 0.01805 0.02183 0.02423 0.02974 0.03011 0.03651 0.03723 0.04193 0.04309 0.04567 0.04666 0.05001 0.05295 0.05721 0.06063 0.06549 0.06975 0.07015 0.07520 0.07817 0.08054 0.08309 0.08585 0.08885 0.09743 0.10021 0.10120 0.10644 0.10844 0.11227 0.11357 0.11512 0.12080 0.12292 0.12353 0.12700 0.13006 0.13321 0.13798 0.14129 0.14240 0.14485 0.14600 0.14886 0.15125 0.15323 0.15842 0.16053 0.16357 0.16556 0.16821 0.17099 0.17212 0.17453 0.17733 0.17952 0.18106 0.18276 0.18507 0.18935 0.19263 0.19341 0.19709 0.19768 0.19881 0.20064 0.20298 0.20541 0.20755 0.20812 0.21089 0.21101 0.21453 0.21853 0.22008 0.22509 0.22600 0.22822 0.22934 0.23066 0.23211 0.23707 0.23910 0.24217 0.24442 0.24477 0.24635 0.24872 0.25142 0.25205 0.25517 0.26004 0.26361 0.26456 0.26758 0.27033 0.27137 0.27749 0.27906 0.28143 0.28266 0.28665 0.28883 0.29047 0.29421 0.29780 0.30000 0.30225 0.30768 0.31085 0.31289 0.31802 0.31949 0.32030 0.32163 0.32345 0.32839 0.32990 0.33579 0.33708 0.33989 0.34297 0.35082 0.35096 0.35437 0.35698 0.36173 0.36864 0.37225 0.37552 0.38115 0.38307 0.38955 0.39760 0.39888 0.40507 0.41110 0.41532 0.41903 0.42694 0.43392 0.43708 0.44685 0.45190 0.45575 0.45977 0.46495 0.46906 0.47074 0.48651 0.49451 0.49759 0.50794 0.51700 0.52381 0.52527 0.53132 0.53689 0.54536 0.54788 0.55514 0.56615 0.56957 0.57055 0.57809 0.58230 0.58433 0.58814 0.59683 0.60079 0.60224 0.60780 0.61203 0.61779 0.62306 0.62869 0.63117 0.63525 0.63738 0.64094 0.64686 0.64802 0.65418 0.65687 0.65935 0.66588 0.66890 0.67294 0.67701 0.67994 0.68169 0.68629 0.68893 0.69447 0.69637 0.69715 0.70379 0.70562 0.70730 0.70881 0.71346 0.71890 0.72267 0.72420 0.72754 0.73185 0.73683 0.74027 0.74325 0.74967 0.75350 0.76118 0.76499 0.76691 0.77161 0.77736 0.78409 0.78571 0.79080 0.79589 0.79813 0.80109 0.80414 0.81290 0.81610 0.82406 0.83282 0.83667 0.84455 0.84995 0.85240 0.85718 0.85982 0.87226 0.87595 0.88690 0.89535 0.91226 0.91339 0.91810 0.92673 0.93218 0.93742 0.94378 0.95319 0.96260 0.96969 0.97277 0.98400 0.99682 1.00047 1.00805 1.01580 1.02726 1.02824 1.03947 1.04669 1.05589 1.06167 1.07057 1.08344 1.08669 1.10046 1.11101 1.11426 1.11525 1.12028 1.13530 1.13717 1.14909 1.16045 1.16765 1.18074 1.19253 1.20470 1.20561 1.21230 1.22183 1.22947 1.24427 1.25708 1.27293 1.28893 1.29377 1.30913 1.31253 1.32029 1.32905 1.33195 1.34794 1.36018 1.36773 1.38075 1.40202 1.40417 1.41065 1.41876 1.42374 1.43764 1.45003 1.45264 1.46052 1.46612 1.47149 1.47712 1.48504 1.49406 1.50414 1.50505 1.51154 1.51436 1.51981 1.52271 1.53476 1.54155 1.54493 1.55561 1.56460 1.57145 1.57623 1.58000 1.58210 1.60478 1.60991 1.61134 1.61943 1.62449 1.62916 1.63713 1.64434 1.64717 1.65307 1.65437 1.65989 1.66191 1.66879 1.66992 1.67669 1.68461 1.68759 1.70098 1.70493 1.70987 1.71666 1.72386 1.72707 1.72930 1.73806 1.75018 1.75882 1.76828 1.77313 1.77631 1.78081 1.78313 1.79239 1.79657 1.80878 1.81266 1.82338 1.83067 1.83269 1.83388 1.84392 1.84810 1.86122 1.86783 1.87280 1.88087 1.88996 1.89629 1.90313 1.91096 1.91659 1.91874 1.92815 1.93513 1.94716 1.94865 1.95806 1.96493 1.97130 1.99026 1.99392 1.99613 1.99895 2.00641 2.01221 2.01737 2.02506 2.03590 2.05229 2.06345 2.07260 2.07572 2.08299 2.09112 2.09588 2.10543 2.11439 2.13341 2.13742 2.15257 2.15939 2.16765 2.18011 2.19179 2.20177 2.21522 2.22104 2.22905 2.23442 2.24836 2.25458 2.26276 2.29615 2.30527 2.32280 2.34504 2.35503 2.36154 2.38515 2.38982 2.40281 2.40351 2.41397 2.43260 2.44025 2.44550 2.45380 2.45680 2.47069 2.48131 2.48874 2.50938 2.52190 2.52414 2.52619 2.53088 2.53214 2.53817 2.54751 2.54941 2.55854 2.56655 2.57334 2.59020 2.59803 2.61042 2.62639 2.63396 2.64167 2.64728 2.65268 2.65859 2.67758 2.68018 2.70749 2.70816 2.71694 2.72529 2.73125 2.73801 2.74153 2.74867 2.75427 2.76166 2.76772 2.77048 2.77220 2.77794 2.79043 2.79333 2.80498 2.80966 2.82532 2.83824 2.84339 2.84499 2.85487 2.86422 2.86631 2.87205 2.88226 2.88962 2.90348 2.90761 2.91207 2.92247 2.93147 2.94029 2.94419 2.95628 2.95851 2.96105 2.96589 2.98481 3.00491 3.02108 3.02807 3.03561 3.04557 3.06239 3.06982 3.08577 3.09967 3.10945 3.11819 3.12649 3.14412 3.16298 3.16958 3.17818 3.18318 3.18940 3.20079 3.20738 3.22162 3.23774 3.24762 3.25701 3.26873 3.33491 3.36817 3.37192 3.38142 3.40301 3.41200 3.43949 3.48327 3.52264 3.55024 3.56687 3.59831 3.61782 3.62199 3.63099 3.64003 3.70356 3.70773 3.72628 3.74033 3.78895 3.79276 3.81466 3.83616 3.84219 3.85774 3.85975 3.86168 3.87474 3.88901 3.95688 3.98709 4.02686 4.03491 4.04678 4.08390 4.13252 4.14841 4.15277 4.15696 4.21061 4.27967 4.31141 4.34623 4.35614 4.36098 4.49016 4.57103 4.61925 4.84487 5.01195 5.11859 5.18912 5.32067 5.41026 5.45337 5.65711 5.82665 5.92183 23.64868 23.70963 23.72891 23.82265 23.83220 23.85461 23.87042 23.90729 23.91961 23.95655 23.96597 23.97594 23.99740 24.00664 24.00990 24.02007 24.08462 24.09577 24.17171 24.19289 24.20730 24.29041 49.91280 49.93752 50.05747</array>
                     <module cmlx:templateRef="l601.state">
                        <scalar dataType="xsd:string" dictRef="g:l601.state">1-A.</scalar>
                     </module>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l601.mullik">
                     <scalar dataType="xsd:string" dictRef="g:title">Mulliken charges:</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:serial">1</scalar>
                     <list cmlx:templateRef="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="51">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</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="51">O O O C C C C C C C C C C C C C 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 H H H H H H H H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="51">0.087941 -0.172179 -0.005157 0.065096 0.135753 -0.012674 -0.630226 -0.214020 -0.061516 -0.594534 0.467799 -0.670412 -0.876958 -0.347598 0.267637 0.748538 -0.128692 -0.889096 -0.640470 1.155475 -0.610099 -0.232677 -0.246153 -0.300402 -0.098888 0.162237 0.162076 0.166901 0.139417 0.139209 0.149992 0.132074 0.148632 0.111687 0.132534 0.146695 0.165808 0.144641 0.171730 0.146599 0.153542 0.180557 0.155301 0.124436 0.163933 0.195056 0.132093 0.110715 0.125365 0.120766 0.121519</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">-0.00000</scalar>
                  </module>
               </property>
               <property dictRef="cc:multipole">
                  <list cmlx:templateRef="multipole">
                     <array dataType="xsd:double" dictRef="cc:dipole" size="3">0.0087 -0.0434 -0.8368</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">0.8380</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-145.5340 -143.2829 -148.6992</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">3.6620 -0.5961 1.2056</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">0.3047 2.5558 -2.8605 3.6620 -0.5961 1.2056</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">69.6613 44.9846 0.6973 -0.2609 -9.1503 -11.4294 -8.1734 -0.2555 13.4011 -0.2371</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-8427.1343 -3468.4503 -1059.4939 -60.8801 71.6234 135.7645 -33.6727 -5.9333 -5.7029 -1976.9070 -1514.2346 -790.4392 13.5707 19.8375 35.0564</array>
                  </list>
               </property>
               <property dictRef="cc:virtualorbs">
                  <array dataType="xsd:string" delimiter="|" size="614">(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)|(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)|(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)|(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)|(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)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)</array>
               </property>
               <property dictRef="cc:occupiedorbs">
                  <array dataType="xsd:string" delimiter="|" size="91">(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>
               </property>
            </propertyList>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l9999.archive" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="ginc">
                     <list dictRef="g:archive">
                        <list dictRef="g:archive1">
                           <scalar dataType="xsd:string" dictRef="cc:hostname">GINC-BELVIS4</scalar>
                           <formula concise="C 22.0 H 26.0 O 3.0" formalCharge="0">
                              <atomArray count="22.0 26.0 3.0" elementType="C H O"/>
                           </formula>
                           <scalar dataType="xsd:string" dictRef="cc:jobname">APULGAR</scalar>
                           <scalar dataType="xsd:date">2024-10-10T00:00:00.000</scalar>
                           <scalar dataType="xsd:string" dictRef="g:zmat">0</scalar>
                        </list>
                        <scalar dataType="xsd:string" dictRef="cc:title">Wavefunction Resmethrin_RS CONF10 gas</scalar>
                        <list dictRef="cc:molecule">
                           <list type="chargemult">
                              <scalar dataType="xsd:string" dictRef="x:formalCharge">0</scalar>
                              <scalar dataType="xsd:string" dictRef="x:spinMultiplicity">1</scalar>
                           </list>
                        </list>
                        <list dictRef="g:archive.namevalue">
                           <scalar dataType="xsd:string">Version=EM64L-G16RevC.01</scalar>
                           <scalar dataType="xsd:string">State=1-A</scalar>
                           <scalar dataType="xsd:string">HF=-1079.9755305</scalar>
                           <scalar dataType="xsd:string">RMSD=6.109e-09</scalar>
                           <scalar dataType="xsd:string">Dipole=-0.0054223,-0.0301944,-0.3282541</scalar>
                           <scalar dataType="xsd:string">Quadrupole=0.2823848,1.880061,-2.1624458,2.7467336,-0.6026723,0.6722216</scalar>
                           <scalar dataType="xsd:string">PG=C01 [X(C22H26O3)]</scalar>
                        </list>
                     </list>
                  </list>
                  <list id="molRoot0">
                     <module id="moleculeRoot">
                        <list type="molecule">
                           <atom elementType="O" id="a1"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">2.2565668273</scalar>
                           <scalar dataType="xsd:string">2.0956141527</scalar>
                           <scalar dataType="xsd:string">-0.0319873493</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="O" id="a2"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.8122436618</scalar>
                           <scalar dataType="xsd:string">0.3668649666</scalar>
                           <scalar dataType="xsd:string">1.3547911778</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="O" id="a3"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-2.0215671194</scalar>
                           <scalar dataType="xsd:string">3.2104905587</scalar>
                           <scalar dataType="xsd:string">-0.859360517</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a4"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.2324252732</scalar>
                           <scalar dataType="xsd:string">-1.0610353435</scalar>
                           <scalar dataType="xsd:string">-0.0137060102</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a5"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.03996679</scalar>
                           <scalar dataType="xsd:string">-1.3854135767</scalar>
                           <scalar dataType="xsd:string">-0.8632807096</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a6"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.3411295836</scalar>
                           <scalar dataType="xsd:string">0.089611387</scalar>
                           <scalar dataType="xsd:string">-0.4868196285</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a7"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.2602477196</scalar>
                           <scalar dataType="xsd:string">-1.4578602278</scalar>
                           <scalar dataType="xsd:string">1.4505978393</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a8"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">5.5983711027</scalar>
                           <scalar dataType="xsd:string">-1.1256874689</scalar>
                           <scalar dataType="xsd:string">-0.6767760525</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a9"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.8474356505</scalar>
                           <scalar dataType="xsd:string">-2.1053184025</scalar>
                           <scalar dataType="xsd:string">-0.3384448974</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a10"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">2.4053152516</scalar>
                           <scalar dataType="xsd:string">0.8133287718</scalar>
                           <scalar dataType="xsd:string">0.3975297499</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a11"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">0.608596111</scalar>
                           <scalar dataType="xsd:string">-2.012131812</scalar>
                           <scalar dataType="xsd:string">-0.8350801069</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a12"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.5378633079</scalar>
                           <scalar dataType="xsd:string">-2.7748622839</scalar>
                           <scalar dataType="xsd:string">-0.2292609547</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a13"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">0.2404186207</scalar>
                           <scalar dataType="xsd:string">-1.1166915509</scalar>
                           <scalar dataType="xsd:string">-1.9886978606</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a14"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.3003741081</scalar>
                           <scalar dataType="xsd:string">2.916806725</scalar>
                           <scalar dataType="xsd:string">0.6926322698</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a15"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.0846851411</scalar>
                           <scalar dataType="xsd:string">2.7572690674</scalar>
                           <scalar dataType="xsd:string">0.1624768789</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a16"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.9559684046</scalar>
                           <scalar dataType="xsd:string">1.6143009779</scalar>
                           <scalar dataType="xsd:string">0.285428177</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a17"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.7831733482</scalar>
                           <scalar dataType="xsd:string">3.6846524183</scalar>
                           <scalar dataType="xsd:string">-0.5430121013</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a18"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-2.112923667</scalar>
                           <scalar dataType="xsd:string">1.9384348596</scalar>
                           <scalar dataType="xsd:string">-0.3505050216</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a19"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.4158698132</scalar>
                           <scalar dataType="xsd:string">1.2554216977</scalar>
                           <scalar dataType="xsd:string">-0.6174674263</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a20"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.5685220848</scalar>
                           <scalar dataType="xsd:string">-0.1158255763</scalar>
                           <scalar dataType="xsd:string">0.005075087</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a21"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.4185926552</scalar>
                           <scalar dataType="xsd:string">-0.3031897697</scalar>
                           <scalar dataType="xsd:string">1.3843758781</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a22"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.9196297042</scalar>
                           <scalar dataType="xsd:string">-1.2146966283</scalar>
                           <scalar dataType="xsd:string">-0.7833742695</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a23"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.6146348717</scalar>
                           <scalar dataType="xsd:string">-1.5571814471</scalar>
                           <scalar dataType="xsd:string">1.9572711543</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a24"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.1269109596</scalar>
                           <scalar dataType="xsd:string">-2.4695613041</scalar>
                           <scalar dataType="xsd:string">-0.2116557537</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a25"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.9735037111</scalar>
                           <scalar dataType="xsd:string">-2.6450841845</scalar>
                           <scalar dataType="xsd:string">1.1609573672</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a26"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.2621085611</scalar>
                           <scalar dataType="xsd:string">-1.5800647592</scalar>
                           <scalar dataType="xsd:string">-1.9098027886</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a27"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.7416174137</scalar>
                           <scalar dataType="xsd:string">0.7065712064</scalar>
                           <scalar dataType="xsd:string">-1.2815192571</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a28"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.2881990437</scalar>
                           <scalar dataType="xsd:string">-1.3606744153</scalar>
                           <scalar dataType="xsd:string">1.9285089502</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a29"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.5989792103</scalar>
                           <scalar dataType="xsd:string">-2.4950797344</scalar>
                           <scalar dataType="xsd:string">1.5430187296</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a30"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.9678310584</scalar>
                           <scalar dataType="xsd:string">-0.8257892568</scalar>
                           <scalar dataType="xsd:string">1.9959297966</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a31"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">5.9983069135</scalar>
                           <scalar dataType="xsd:string">-2.1433212945</scalar>
                           <scalar dataType="xsd:string">-0.619722148</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a32"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">5.5530784654</scalar>
                           <scalar dataType="xsd:string">-0.8414311477</scalar>
                           <scalar dataType="xsd:string">-1.731434047</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a33"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">6.3050485843</scalar>
                           <scalar dataType="xsd:string">-0.4569071073</scalar>
                           <scalar dataType="xsd:string">-0.1753892761</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a34"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">2.0094675695</scalar>
                           <scalar dataType="xsd:string">-2.7493359663</scalar>
                           <scalar dataType="xsd:string">0.5208064597</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a35"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.212185523</scalar>
                           <scalar dataType="xsd:string">-3.4231959537</scalar>
                           <scalar dataType="xsd:string">0.5867911836</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a36"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-1.0435508246</scalar>
                           <scalar dataType="xsd:string">-3.3923843888</scalar>
                           <scalar dataType="xsd:string">-0.9805693154</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a37"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-1.2937138335</scalar>
                           <scalar dataType="xsd:string">-2.0869807899</scalar>
                           <scalar dataType="xsd:string">0.1613683514</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a38"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.0914674559</scalar>
                           <scalar dataType="xsd:string">-0.562783293</scalar>
                           <scalar dataType="xsd:string">-2.3860408403</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a39"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.5146989179</scalar>
                           <scalar dataType="xsd:string">-0.3882709153</scalar>
                           <scalar dataType="xsd:string">-1.6732245617</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a40"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.2038560128</scalar>
                           <scalar dataType="xsd:string">-1.700798051</scalar>
                           <scalar dataType="xsd:string">-2.8033878889</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a41"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.6535317702</scalar>
                           <scalar dataType="xsd:string">3.9375693031</scalar>
                           <scalar dataType="xsd:string">0.5483719121</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a42"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.3509413547</scalar>
                           <scalar dataType="xsd:string">2.6600551633</scalar>
                           <scalar dataType="xsd:string">1.7517779926</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a43"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.7213965734</scalar>
                           <scalar dataType="xsd:string">0.6875740913</scalar>
                           <scalar dataType="xsd:string">0.7817060694</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a44"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.5533829208</scalar>
                           <scalar dataType="xsd:string">4.6828307152</scalar>
                           <scalar dataType="xsd:string">-0.8777788126</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a45"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.5569806886</scalar>
                           <scalar dataType="xsd:string">1.184515622</scalar>
                           <scalar dataType="xsd:string">-1.7014720563</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a46"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.2205564697</scalar>
                           <scalar dataType="xsd:string">1.9095926897</scalar>
                           <scalar dataType="xsd:string">-0.2569465156</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a47"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.1442144537</scalar>
                           <scalar dataType="xsd:string">0.5386753666</scalar>
                           <scalar dataType="xsd:string">2.0103073396</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a48"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.0337184657</scalar>
                           <scalar dataType="xsd:string">-1.0881521491</scalar>
                           <scalar dataType="xsd:string">-1.8550773942</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a49"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.4880838315</scalar>
                           <scalar dataType="xsd:string">-1.6851841943</scalar>
                           <scalar dataType="xsd:string">3.0264689556</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a50"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.3978465828</scalar>
                           <scalar dataType="xsd:string">-3.3098129967</scalar>
                           <scalar dataType="xsd:string">-0.841054803</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a51"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.1257278525</scalar>
                           <scalar dataType="xsd:string">-3.6210752606</scalar>
                           <scalar dataType="xsd:string">1.6074077356</scalar>
                        </list>
                     </module>
                  </list>
               </module>
            </module>
         </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:run.date">
                  <scalar dataType="xsd:string">10-Oct-2024</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">EM64L-G16RevC.01</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:degfreedom">
                  <scalar cmlx:templateRef="degfreedom" dataType="xsd:integer">147</scalar>
               </parameter>
               <parameter dictRef="cc:frameworkgroup">
                  <scalar cmlx:templateRef="framework" dataType="xsd:string">C1[X(C22H26O3)]</scalar>
               </parameter>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string">RB3LYP TD-FC</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">6-311+G(d,p)</scalar>
               </parameter>
               <parameter dictRef="g:operation">
                  <scalar dataType="xsd:string">SP</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">#P</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">B3LYP</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">6-311+G(d,p)</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">EmpiricalDispersion=gd3</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">geom=check</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">guess=read</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">td=(singlets,nstates=10)</scalar>
               </parameter>
            </parameterList>
            <molecule cmlx:templateRef="atom"
                      formalCharge="0"
                      id="mol.l202.orient"
                      spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="2.184856"
                        y3="2.180139"
                        z3="0.120011">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a2"
                        x3="1.732449"
                        y3="0.390783"
                        z3="1.424881">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a3"
                        x3="-2.087731"
                        y3="3.264701"
                        z3="-0.773666">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a4"
                        x3="4.208753"
                        y3="-0.945484"
                        z3="0.064266">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a5"
                        x3="3.043546"
                        y3="-1.252874"
                        z3="-0.828348">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a6"
                        x3="3.311906"
                        y3="0.210086"
                        z3="-0.385797">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a7"
                        x3="4.205466"
                        y3="-1.400345"
                        z3="1.511857">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a8"
                        x3="5.591992"
                        y3="-0.963485"
                        z3="-0.564999">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a9"
                        x3="1.849441"
                        y3="-2.010627"
                        z3="-0.363839">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a10"
                        x3="2.342657"
                        y3="0.88395"
                        z3="0.501926">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a11"
                        x3="0.622349"
                        y3="-1.915686"
                        z3="-0.888517">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a12"
                        x3="-0.527098"
                        y3="-2.718805"
                        z3="-0.343617">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a13"
                        x3="0.269716"
                        y3="-0.980116"
                        z3="-2.01482">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a14"
                        x3="1.197782"
                        y3="2.957507"
                        z3="0.851531">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a15"
                        x3="-0.170656"
                        y3="2.799164"
                        z3="0.279507">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a16"
                        x3="-1.0268"
                        y3="1.639568"
                        z3="0.334139">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a17"
                        x3="-0.865368"
                        y3="3.743824"
                        z3="-0.40652">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a18"
                        x3="-2.172108"
                        y3="1.972037"
                        z3="-0.318358">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a19"
                        x3="-3.456984"
                        y3="1.281326"
                        z3="-0.646164">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a20"
                        x3="-3.603974"
                        y3="-0.1159"
                        z3="-0.082841">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a21"
                        x3="-3.48632"
                        y3="-0.356294"
                        z3="1.291358">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a22"
                        x3="-3.917646"
                        y3="-1.187235"
                        z3="-0.923257">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.67725"
                        y3="-1.635013"
                        z3="1.808621">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a24"
                        x3="-4.119767"
                        y3="-2.466942"
                        z3="-0.407497">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a25"
                        x3="-3.998651"
                        y3="-2.695187"
                        z3="0.960584">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a26"
                        x3="3.295295"
                        y3="-1.402073"
                        z3="-1.875633">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a27"
                        x3="3.722808"
                        y3="0.86425"
                        z3="-1.144616">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a28"
                        x3="3.220156"
                        y3="-1.336647"
                        z3="1.967741">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a29"
                        x3="4.55792"
                        y3="-2.435379"
                        z3="1.571759">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a30"
                        x3="4.888951"
                        y3="-0.780411"
                        z3="2.100164">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a31"
                        x3="6.006217"
                        y3="-1.976636"
                        z3="-0.53805">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a32"
                        x3="5.569141"
                        y3="-0.637796"
                        z3="-1.60834">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a33"
                        x3="6.275117"
                        y3="-0.305124"
                        z3="-0.019152">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a34"
                        x3="1.999586"
                        y3="-2.686196"
                        z3="0.473054">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a35"
                        x3="-0.212212"
                        y3="-3.394559"
                        z3="0.454222">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a36"
                        x3="-1.003758"
                        y3="-3.312981"
                        z3="-1.131823">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a37"
                        x3="-1.303325"
                        y3="-2.058286"
                        z3="0.054213">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a38"
                        x3="1.121841"
                        y3="-0.398319"
                        z3="-2.367489">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a39"
                        x3="-0.504497"
                        y3="-0.276066"
                        z3="-1.690429">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.144466"
                        y3="-1.537464"
                        z3="-2.863405">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a41"
                        x3="1.538486"
                        y3="3.988292"
                        z3="0.75724">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a42"
                        x3="1.225361"
                        y3="2.659194"
                        z3="1.900586">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a43"
                        x3="-0.790477"
                        y3="0.697186"
                        z3="0.799118">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a44"
                        x3="-0.642769"
                        y3="4.757893"
                        z3="-0.695218">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a45"
                        x3="-3.569307"
                        y3="1.251956"
                        z3="-1.735442">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a46"
                        x3="-4.280731"
                        y3="1.908661"
                        z3="-0.281022">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a47"
                        x3="-3.241182"
                        y3="0.463674"
                        z3="1.957218">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a48"
                        x3="-4.006361"
                        y3="-1.019434"
                        z3="-1.99169">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a49"
                        x3="-3.575992"
                        y3="-1.803988"
                        z3="2.874819">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a50"
                        x3="-4.3614"
                        y3="-3.285109"
                        z3="-1.076666">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a51"
                        x3="-4.146911"
                        y3="-3.69044"
                        z3="1.363744">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
               </atomArray>
               <bondArray/>
               <formula concise="C22H26O3"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">312.2335999999998</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1/22C.3O.26H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;1;2;3;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/rA:51nO0O0O0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.1849,2.1801,.12;1.7324,.3908,1.4249;-2.0877,3.2647,-.7737;4.2088,-.9455,.0643;3.0435,-1.2529,-.8283;3.3119,.2101,-.3858;4.2055,-1.4003,1.5119;5.592,-.9635,-.565;1.8494,-2.0106,-.3638;2.3427,.884,.5019;.6223,-1.9157,-.8885;-.5271,-2.7188,-.3436;.2697,-.9801,-2.0148;1.1978,2.9575,.8515;-.1707,2.7992,.2795;-1.0268,1.6396,.3341;-.8654,3.7438,-.4065;-2.1721,1.972,-.3184;-3.457,1.2813,-.6462;-3.604,-.1159,-.0828;-3.4863,-.3563,1.2914;-3.9176,-1.1872,-.9233;-3.6772,-1.635,1.8086;-4.1198,-2.4669,-.4075;-3.9987,-2.6952,.9606;3.2953,-1.4021,-1.8756;3.7228,.8642,-1.1446;3.2202,-1.3366,1.9677;4.5579,-2.4354,1.5718;4.889,-.7804,2.1002;6.0062,-1.9766,-.5381;5.5691,-.6378,-1.6083;6.2751,-.3051,-.0192;1.9996,-2.6862,.4731;-.2122,-3.3946,.4542;-1.0038,-3.313,-1.1318;-1.3033,-2.0583,.0542;1.1218,-.3983,-2.3675;-.5045,-.2761,-1.6904;-.1445,-1.5375,-2.8634;1.5385,3.9883,.7572;1.2254,2.6592,1.9006;-.7905,.6972,.7991;-.6428,4.7579,-.6952;-3.5693,1.252,-1.7354;-4.2807,1.9087,-.281;-3.2412,.4637,1.9572;-4.0064,-1.0194,-1.9917;-3.576,-1.804,2.8748;-4.3614,-3.2851,-1.0767;-4.1469,-3.6904,1.3637;</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l1" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l1.end">
                     <array dataType="xsd:string" dictRef="g:kk" size="1">oldchk=opt-b3lyp-pople.chk</array>
                     <scalar cmlx:templateRef="title" dataType="xsd:string" dictRef="cc:title">#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 geom=check guess=read td</scalar>
                     <list cmlx:templateRef="control">
                        <scalar dataType="xsd:string" dictRef="g:control">1/29=2,38=1,172=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">2/12=2,40=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">3/5=4,6=6,7=111,11=9,14=-4,25=1,30=1,74=-5,116=-2,124=31/1,2,3,8</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">4/5=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">5/5=2,38=6/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">8/6=1,10=2,108=10/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">9/41=10,42=1,48=1,70=2/14</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">6/7=2,8=2,9=2,10=2/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">99/5=1,9=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">Electronic spectrum Resmethrin_RS CONF10 gas</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>
                  <module cmlx:templateRef="l101.isotope2">
                     <array cmlx:templateRef="atom"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">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</array>
                     <array cmlx:templateRef="iatwgt"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">16 16 16 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 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</array>
                     <array cmlx:templateRef="atmwgt"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="51">15.9949146 15.9949146 15.9949146 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250</array>
                     <array cmlx:templateRef="nucspn"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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</array>
                     <array cmlx:templateRef="atzeff"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="51">5.6000000 5.6000000 5.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000</array>
                  </module>
                  <list cmlx:templateRef="rest">
                     <scalar dataType="xsd:string" dictRef="x:l101">(Enter /usr/local/gaussian/gaussian16/g16/l101.exe)</scalar>
                  </list>
               </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">6-311+G(d,p)</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:diffuse">(5D, 7F)</scalar>
                     <module cmlx:templateRef="ernie">
                        <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                        <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                        <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                     </module>
                     <list cmlx:templateRef="symmadaptcart">
                        <array dataType="xsd:integer" dictRef="cc:adapted" size="1">731</array>
                        <array dataType="xsd:string" dictRef="cc:symm" size="1">A</array>
                     </list>
                     <list cmlx:templateRef="symmadapt">
                        <array dataType="xsd:integer" dictRef="cc:adapted" size="1">706</array>
                        <array dataType="xsd:string" dictRef="cc:symm" size="1">A</array>
                     </list>
                     <scalar dataType="xsd:integer" dictRef="cc:basiscount">706</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:primbasis">1108</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:cartesianbasis">731</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:alphae">91</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:betae">91</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:nucrepener">2216.2392900239</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:natoms">51</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">51</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">51</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>
                     <scalar dataType="xsd:string" dictRef="g:misc">IExCor=  402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX=  0.200000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  0.800000  0.720000  1.000000  0.810000 ScalE2=  1.000000  1.000000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=131</scalar>
                  </module>
                  <module cmlx:templateRef="l301.dispersion">
                     <scalar dataType="xsd:string" dictRef="g:empdispersion">Grimme-D3</scalar>
                     <scalar dataType="xsd:double" dictRef="g:dispenergy" units="nonsi:hartree">-0.0582576528</scalar>
                  </module>
               </module>
               <module cmlx:templateRef="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.stoich">
                     <scalar cmlx:templateRef="stoich"
                             dataType="xsd:string"
                             dictRef="g:stoichiometry">C22H26O3</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:pointgroup">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestconciseabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.3082482 0.1551150 0.1183910</array>
                  </module>
               </module>
               <module cmlx:templateRef="l302">
                  <module cmlx:templateRef="l302.basis">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="11">NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="5">One-electron integrals computed using PRISM.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="6">One-electron integral symmetry used in STVInt</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NBasis= 706 RedAO= T EigKep= 1.11D-06 NBF= 706</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="7">NBsUse= 705 1.00D-06 EigRej= 9.72D-07 NBFU= 705</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l302.basis2">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="5">Precomputing XC quadrature grid using</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">NSgBfM= 726 726 726 726 726 MxSgAt= 51 MxSgA2= 51.</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l303.basis">
                  <list cmlx:templateRef="l303">
                     <scalar dataType="xsd:integer" dictRef="g:dipdrv">1</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l502">
                  <scalar dataType="xsd:string" dictRef="g:l502.type">Closed</scalar>
                  <module cmlx:templateRef="l502.cycle">
                     <list cmlx:templateRef="cycle">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="cc:cycle">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:pass">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:idiag">1</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="l502.e">
                        <list cmlx:templateRef="l502.e">
                           <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553054854</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.97553054842</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">0.000000000116</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <module cmlx:templateRef="l502.footer">
                     <list cmlx:templateRef="scfdone">
                        <list>
                           <scalar dataType="xsd:double" dictRef="g:rbhflyp" units="nonsi:hartree">-1079.97553055</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:ncycle">2</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="scfdone">
                        <list cmlx:templateRef="scfdone">
                           <list>
                              <scalar dataType="xsd:double" dictRef="cc:kinener">1.075265705475e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:potener">-6.946104992556e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:eener">2.574682724161e+03</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <list cmlx:templateRef="l502">
                     <scalar dataType="xsd:string" dictRef="g:l502">Using DIIS extrapolation, IDIIS=  1040.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NGot=  1415577600 LenX=  1414494764 LenY=  1413959672</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on RMS density matrix=1.00D-08 within 128 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on MAX density matrix=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on             energy=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">No special actions if energy rises.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Fock matrices will be formed incrementally for  20 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502"/>
                  </list>
               </module>
               <module cmlx:templateRef="l914">
                  <module cmlx:templateRef="l914_excitations">
                     <module cmlx:templateRef="l914_excitations1">
                        <list cmlx:templateRef="l914_excit1">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_enumber">1</scalar>
                              <scalar dataType="xsd:string" dictRef="g:tddft_ttype">Singlet-A</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_eenergy">4.8960</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_wavelength">253.23</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_oscillator_strength">0.0009</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_s2">0.000</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_excit2">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">92</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">-0.22959</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">92</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.66176</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_tote">
                           <scalar dataType="xsd:double" dictRef="g:tddft_totale">-1079.79560415</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="l914_excitations1">
                        <list cmlx:templateRef="l914_excit1">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_enumber">2</scalar>
                              <scalar dataType="xsd:string" dictRef="g:tddft_ttype">Singlet-A</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_eenergy">4.9853</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_wavelength">248.70</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_oscillator_strength">0.0026</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_s2">0.000</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_excit2">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">93</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">-0.20104</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">93</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.65876</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l914_excitations1">
                        <list cmlx:templateRef="l914_excit1">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_enumber">3</scalar>
                              <scalar dataType="xsd:string" dictRef="g:tddft_ttype">Singlet-A</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_eenergy">5.0789</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_wavelength">244.12</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_oscillator_strength">0.0097</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_s2">0.000</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_excit2">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">92</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.66019</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">92</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.22970</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l914_excitations1">
                        <list cmlx:templateRef="l914_excit1">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_enumber">4</scalar>
                              <scalar dataType="xsd:string" dictRef="g:tddft_ttype">Singlet-A</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_eenergy">5.1394</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_wavelength">241.24</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_oscillator_strength">0.0545</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_s2">0.000</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_excit2">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">87</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">94</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.12006</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">94</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.65578</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l914_excitations1">
                        <list cmlx:templateRef="l914_excit1">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_enumber">5</scalar>
                              <scalar dataType="xsd:string" dictRef="g:tddft_ttype">Singlet-A</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_eenergy">5.1600</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_wavelength">240.28</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_oscillator_strength">0.0035</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_s2">0.000</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_excit2">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">93</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.65004</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">93</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.22428</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l914_excitations1">
                        <list cmlx:templateRef="l914_excit1">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_enumber">6</scalar>
                              <scalar dataType="xsd:string" dictRef="g:tddft_ttype">Singlet-A</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_eenergy">5.3335</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_wavelength">232.46</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_oscillator_strength">0.0061</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_s2">0.000</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_excit2">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">88</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">92</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">-0.32420</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">88</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">93</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.30880</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">89</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">92</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.35783</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">89</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">93</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.35008</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">93</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.17519</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l914_excitations1">
                        <list cmlx:templateRef="l914_excit1">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_enumber">7</scalar>
                              <scalar dataType="xsd:string" dictRef="g:tddft_ttype">Singlet-A</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_eenergy">5.3904</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_wavelength">230.01</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_oscillator_strength">0.0048</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_s2">0.000</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_excit2">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">94</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.56265</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">94</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">-0.11685</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">95</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.20360</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">96</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.29820</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l914_excitations1">
                        <list cmlx:templateRef="l914_excit1">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_enumber">8</scalar>
                              <scalar dataType="xsd:string" dictRef="g:tddft_ttype">Singlet-A</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_eenergy">5.4476</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_wavelength">227.60</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_oscillator_strength">0.0152</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_s2">0.000</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_excit2">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">94</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">-0.38032</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">95</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.39328</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">96</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.40090</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l914_excitations1">
                        <list cmlx:templateRef="l914_excit1">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_enumber">9</scalar>
                              <scalar dataType="xsd:string" dictRef="g:tddft_ttype">Singlet-A</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_eenergy">5.5302</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_wavelength">224.19</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_oscillator_strength">0.0226</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_s2">0.000</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_excit2">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">95</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.22571</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">95</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.48391</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">96</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">-0.44556</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l914_excitations1">
                        <list cmlx:templateRef="l914_excit1">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_enumber">10</scalar>
                              <scalar dataType="xsd:string" dictRef="g:tddft_ttype">Singlet-A</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_eenergy">5.5852</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_wavelength">221.99</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_oscillator_strength">0.0053</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_s2">0.000</scalar>
                           </list>
                        </list>
                        <list cmlx:templateRef="l914_excit2">
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">95</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.33900</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">96</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.47663</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">90</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">98</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">0.14170</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">95</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">-0.10498</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">97</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">-0.20142</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">98</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">-0.19848</scalar>
                           </list>
                           <list>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalstart">91</scalar>
                              <scalar dataType="xsd:integer" dictRef="g:tddft_orbitalend">99</scalar>
                              <scalar dataType="xsd:double" dictRef="g:tddft_unknown">-0.12725</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:jobtime">
                  <scalar dataType="xsd:string">PT60803S</scalar>
               </property>
               <property dictRef="cc:jobdatetime.end">
                  <scalar dataType="xsd:date">2024-10-10T05:06:16.000</scalar>
               </property>
               <property dictRef="cc:popanal">
                  <module cmlx:templateRef="l601.popanal">
                     <array dataType="xsd:double" dictRef="g:alphaocc" size="91">-19.18979 -19.16124 -19.10365 -10.29666 -10.23436 -10.23152 -10.22377 -10.19779 -10.19408 -10.19374 -10.18736 -10.18679 -10.18153 -10.18138 -10.18097 -10.18074 -10.17982 -10.17955 -10.17061 -10.16775 -10.16643 -10.15620 -10.15589 -10.15514 -10.15187 -1.11491 -1.10027 -1.01518 -0.88334 -0.87016 -0.82025 -0.80760 -0.80344 -0.75731 -0.75400 -0.74529 -0.72803 -0.69683 -0.69202 -0.68629 -0.68338 -0.64005 -0.61648 -0.60296 -0.58840 -0.57220 -0.55683 -0.54070 -0.52832 -0.52466 -0.51435 -0.49491 -0.48091 -0.47811 -0.47144 -0.46639 -0.45923 -0.45461 -0.45277 -0.44219 -0.44037 -0.43104 -0.42975 -0.42923 -0.41836 -0.41645 -0.41153 -0.40542 -0.39943 -0.39312 -0.38730 -0.38276 -0.38085 -0.37487 -0.36938 -0.36583 -0.35871 -0.35470 -0.35357 -0.35133 -0.35043 -0.32915 -0.30941 -0.29711 -0.28638 -0.28112 -0.27423 -0.26341 -0.25853 -0.23237 -0.22562</array>
                     <array dataType="xsd:double" dictRef="g:alphavirt" size="614">-0.02411 -0.02077 -0.01072 -0.00482 -0.00303 0.00336 0.01154 0.01269 0.01805 0.02183 0.02423 0.02974 0.03011 0.03651 0.03723 0.04193 0.04309 0.04567 0.04666 0.05001 0.05295 0.05721 0.06063 0.06549 0.06975 0.07015 0.07520 0.07817 0.08054 0.08309 0.08585 0.08885 0.09743 0.10021 0.10120 0.10644 0.10844 0.11227 0.11357 0.11512 0.12080 0.12292 0.12353 0.12700 0.13006 0.13321 0.13798 0.14129 0.14240 0.14485 0.14600 0.14886 0.15125 0.15323 0.15842 0.16053 0.16357 0.16556 0.16821 0.17099 0.17212 0.17453 0.17733 0.17952 0.18106 0.18276 0.18507 0.18935 0.19263 0.19341 0.19709 0.19768 0.19881 0.20064 0.20298 0.20541 0.20755 0.20812 0.21089 0.21101 0.21453 0.21853 0.22008 0.22509 0.22600 0.22822 0.22934 0.23066 0.23211 0.23707 0.23910 0.24217 0.24442 0.24477 0.24635 0.24872 0.25142 0.25205 0.25517 0.26004 0.26361 0.26456 0.26758 0.27033 0.27137 0.27749 0.27906 0.28143 0.28266 0.28665 0.28883 0.29047 0.29421 0.29780 0.30000 0.30225 0.30768 0.31085 0.31289 0.31802 0.31949 0.32030 0.32163 0.32345 0.32839 0.32990 0.33579 0.33708 0.33989 0.34297 0.35082 0.35096 0.35437 0.35698 0.36173 0.36864 0.37225 0.37552 0.38115 0.38307 0.38955 0.39760 0.39888 0.40507 0.41110 0.41532 0.41903 0.42694 0.43392 0.43708 0.44685 0.45190 0.45575 0.45977 0.46495 0.46906 0.47074 0.48651 0.49451 0.49759 0.50794 0.51700 0.52381 0.52527 0.53132 0.53689 0.54536 0.54788 0.55514 0.56615 0.56957 0.57055 0.57809 0.58230 0.58433 0.58814 0.59683 0.60079 0.60224 0.60780 0.61203 0.61779 0.62306 0.62869 0.63117 0.63525 0.63738 0.64094 0.64686 0.64802 0.65418 0.65687 0.65935 0.66588 0.66890 0.67294 0.67701 0.67994 0.68169 0.68629 0.68893 0.69447 0.69637 0.69715 0.70379 0.70562 0.70730 0.70881 0.71346 0.71890 0.72267 0.72420 0.72754 0.73185 0.73683 0.74027 0.74325 0.74967 0.75350 0.76118 0.76499 0.76691 0.77161 0.77736 0.78409 0.78571 0.79080 0.79589 0.79813 0.80109 0.80414 0.81290 0.81610 0.82406 0.83282 0.83667 0.84455 0.84995 0.85240 0.85718 0.85982 0.87226 0.87595 0.88690 0.89535 0.91226 0.91339 0.91810 0.92673 0.93218 0.93742 0.94378 0.95319 0.96260 0.96969 0.97277 0.98400 0.99682 1.00047 1.00805 1.01580 1.02726 1.02824 1.03947 1.04669 1.05589 1.06167 1.07057 1.08344 1.08669 1.10046 1.11101 1.11426 1.11525 1.12028 1.13530 1.13717 1.14909 1.16045 1.16765 1.18074 1.19253 1.20470 1.20561 1.21230 1.22183 1.22947 1.24427 1.25708 1.27293 1.28893 1.29377 1.30913 1.31253 1.32029 1.32905 1.33195 1.34794 1.36018 1.36773 1.38075 1.40202 1.40417 1.41065 1.41876 1.42374 1.43764 1.45003 1.45264 1.46052 1.46612 1.47149 1.47712 1.48504 1.49406 1.50414 1.50505 1.51154 1.51436 1.51981 1.52271 1.53476 1.54155 1.54493 1.55561 1.56460 1.57145 1.57623 1.58000 1.58210 1.60478 1.60991 1.61134 1.61943 1.62449 1.62916 1.63713 1.64434 1.64717 1.65307 1.65437 1.65989 1.66191 1.66879 1.66992 1.67669 1.68461 1.68759 1.70098 1.70493 1.70987 1.71666 1.72386 1.72707 1.72930 1.73806 1.75018 1.75882 1.76828 1.77313 1.77631 1.78081 1.78313 1.79239 1.79657 1.80878 1.81266 1.82338 1.83067 1.83269 1.83388 1.84392 1.84810 1.86122 1.86783 1.87280 1.88087 1.88996 1.89629 1.90313 1.91096 1.91659 1.91874 1.92815 1.93513 1.94716 1.94865 1.95806 1.96493 1.97130 1.99026 1.99392 1.99613 1.99895 2.00641 2.01221 2.01737 2.02506 2.03590 2.05229 2.06345 2.07260 2.07572 2.08299 2.09112 2.09588 2.10543 2.11439 2.13341 2.13742 2.15257 2.15939 2.16765 2.18011 2.19179 2.20177 2.21522 2.22104 2.22905 2.23442 2.24836 2.25458 2.26276 2.29615 2.30527 2.32280 2.34504 2.35503 2.36154 2.38515 2.38982 2.40281 2.40351 2.41397 2.43260 2.44025 2.44550 2.45380 2.45680 2.47069 2.48131 2.48874 2.50938 2.52190 2.52414 2.52619 2.53088 2.53214 2.53817 2.54751 2.54941 2.55854 2.56655 2.57334 2.59020 2.59803 2.61042 2.62639 2.63396 2.64167 2.64728 2.65268 2.65859 2.67758 2.68018 2.70749 2.70816 2.71694 2.72529 2.73125 2.73801 2.74153 2.74867 2.75427 2.76166 2.76772 2.77048 2.77220 2.77794 2.79043 2.79333 2.80498 2.80966 2.82532 2.83824 2.84339 2.84499 2.85487 2.86422 2.86631 2.87205 2.88226 2.88962 2.90348 2.90761 2.91207 2.92247 2.93147 2.94029 2.94419 2.95628 2.95851 2.96105 2.96589 2.98481 3.00491 3.02108 3.02807 3.03561 3.04557 3.06239 3.06982 3.08577 3.09967 3.10945 3.11819 3.12649 3.14412 3.16298 3.16958 3.17818 3.18318 3.18940 3.20079 3.20738 3.22162 3.23774 3.24762 3.25701 3.26873 3.33491 3.36817 3.37192 3.38142 3.40301 3.41200 3.43949 3.48327 3.52264 3.55024 3.56687 3.59831 3.61782 3.62199 3.63099 3.64003 3.70356 3.70773 3.72628 3.74033 3.78895 3.79276 3.81466 3.83616 3.84219 3.85774 3.85975 3.86168 3.87474 3.88901 3.95688 3.98709 4.02686 4.03491 4.04678 4.08390 4.13252 4.14841 4.15277 4.15696 4.21061 4.27967 4.31141 4.34623 4.35614 4.36098 4.49016 4.57103 4.61925 4.84487 5.01195 5.11859 5.18912 5.32067 5.41026 5.45337 5.65711 5.82665 5.92183 23.64868 23.70963 23.72891 23.82265 23.83220 23.85461 23.87042 23.90729 23.91961 23.95655 23.96597 23.97594 23.99740 24.00664 24.00990 24.02007 24.08462 24.09577 24.17171 24.19289 24.20730 24.29041 49.91280 49.93752 50.05747</array>
                     <module cmlx:templateRef="l601.state">
                        <scalar dataType="xsd:string" dictRef="g:l601.state">1-A.</scalar>
                     </module>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l601.mullik">
                     <scalar dataType="xsd:string" dictRef="g:title">Mulliken charges:</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:serial">1</scalar>
                     <list cmlx:templateRef="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="51">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</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="51">O O O C C C C C C C C C C C C C 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 H H H H H H H H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="51">0.087941 -0.172179 -0.005157 0.065096 0.135753 -0.012674 -0.630226 -0.214020 -0.061516 -0.594534 0.467799 -0.670412 -0.876958 -0.347598 0.267637 0.748538 -0.128692 -0.889096 -0.640470 1.155475 -0.610099 -0.232677 -0.246153 -0.300402 -0.098888 0.162237 0.162076 0.166901 0.139417 0.139209 0.149992 0.132074 0.148632 0.111687 0.132534 0.146695 0.165808 0.144641 0.171730 0.146599 0.153542 0.180557 0.155301 0.124436 0.163933 0.195056 0.132093 0.110715 0.125365 0.120766 0.121519</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">-0.00000</scalar>
                  </module>
               </property>
               <property dictRef="cc:multipole">
                  <list cmlx:templateRef="multipole">
                     <array dataType="xsd:double" dictRef="cc:dipole" size="3">0.0087 -0.0434 -0.8368</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">0.8380</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-145.5340 -143.2829 -148.6992</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">3.6620 -0.5961 1.2056</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">0.3047 2.5558 -2.8605 3.6620 -0.5961 1.2056</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">69.6613 44.9846 0.6973 -0.2609 -9.1503 -11.4294 -8.1734 -0.2555 13.4011 -0.2371</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-8427.1343 -3468.4503 -1059.4939 -60.8801 71.6234 135.7645 -33.6727 -5.9333 -5.7029 -1976.9070 -1514.2346 -790.4392 13.5707 19.8375 35.0564</array>
                  </list>
               </property>
               <property dictRef="cc:virtualorbs">
                  <array dataType="xsd:string" delimiter="|" size="614">(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)|(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)|(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)|(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)|(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)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)</array>
               </property>
               <property dictRef="cc:occupiedorbs">
                  <array dataType="xsd:string" delimiter="|" size="91">(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>
               </property>
            </propertyList>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l9999.archive" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="ginc">
                     <list dictRef="g:archive">
                        <list dictRef="g:archive1">
                           <scalar dataType="xsd:string" dictRef="cc:hostname">GINC-BELVIS4</scalar>
                           <formula concise="C 22.0 H 26.0 O 3.0" formalCharge="0">
                              <atomArray count="22.0 26.0 3.0" elementType="C H O"/>
                           </formula>
                           <scalar dataType="xsd:string" dictRef="cc:jobname">APULGAR</scalar>
                           <scalar dataType="xsd:date">2024-10-10T00:00:00.000</scalar>
                           <scalar dataType="xsd:string" dictRef="g:zmat">0</scalar>
                        </list>
                        <scalar dataType="xsd:string" dictRef="cc:title">Electronic spectrum Resmethrin_RS CONF10 gas</scalar>
                        <list dictRef="cc:molecule">
                           <list type="chargemult">
                              <scalar dataType="xsd:string" dictRef="x:formalCharge">0</scalar>
                              <scalar dataType="xsd:string" dictRef="x:spinMultiplicity">1</scalar>
                           </list>
                        </list>
                        <list dictRef="g:archive.namevalue">
                           <scalar dataType="xsd:string">Version=EM64L-G16RevC.01</scalar>
                           <scalar dataType="xsd:string">State=1-A</scalar>
                           <scalar dataType="xsd:string">HF=-1079.9755305</scalar>
                           <scalar dataType="xsd:string">RMSD=6.116e-09</scalar>
                           <scalar dataType="xsd:string">PG=C01 [X(C22H26O3)]</scalar>
                        </list>
                     </list>
                  </list>
                  <list id="molRoot0">
                     <module id="moleculeRoot">
                        <list type="molecule">
                           <atom elementType="O" id="a1"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">2.2565668273</scalar>
                           <scalar dataType="xsd:string">2.0956141527</scalar>
                           <scalar dataType="xsd:string">-0.0319873493</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="O" id="a2"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.8122436618</scalar>
                           <scalar dataType="xsd:string">0.3668649666</scalar>
                           <scalar dataType="xsd:string">1.3547911778</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="O" id="a3"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-2.0215671194</scalar>
                           <scalar dataType="xsd:string">3.2104905587</scalar>
                           <scalar dataType="xsd:string">-0.859360517</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a4"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.2324252732</scalar>
                           <scalar dataType="xsd:string">-1.0610353435</scalar>
                           <scalar dataType="xsd:string">-0.0137060102</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a5"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.03996679</scalar>
                           <scalar dataType="xsd:string">-1.3854135767</scalar>
                           <scalar dataType="xsd:string">-0.8632807096</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a6"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.3411295836</scalar>
                           <scalar dataType="xsd:string">0.089611387</scalar>
                           <scalar dataType="xsd:string">-0.4868196285</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a7"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.2602477196</scalar>
                           <scalar dataType="xsd:string">-1.4578602278</scalar>
                           <scalar dataType="xsd:string">1.4505978393</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a8"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">5.5983711027</scalar>
                           <scalar dataType="xsd:string">-1.1256874689</scalar>
                           <scalar dataType="xsd:string">-0.6767760525</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a9"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.8474356505</scalar>
                           <scalar dataType="xsd:string">-2.1053184025</scalar>
                           <scalar dataType="xsd:string">-0.3384448974</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a10"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">2.4053152516</scalar>
                           <scalar dataType="xsd:string">0.8133287718</scalar>
                           <scalar dataType="xsd:string">0.3975297499</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a11"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">0.608596111</scalar>
                           <scalar dataType="xsd:string">-2.012131812</scalar>
                           <scalar dataType="xsd:string">-0.8350801069</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a12"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.5378633079</scalar>
                           <scalar dataType="xsd:string">-2.7748622839</scalar>
                           <scalar dataType="xsd:string">-0.2292609547</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a13"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">0.2404186207</scalar>
                           <scalar dataType="xsd:string">-1.1166915509</scalar>
                           <scalar dataType="xsd:string">-1.9886978606</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a14"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.3003741081</scalar>
                           <scalar dataType="xsd:string">2.916806725</scalar>
                           <scalar dataType="xsd:string">0.6926322698</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a15"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.0846851411</scalar>
                           <scalar dataType="xsd:string">2.7572690674</scalar>
                           <scalar dataType="xsd:string">0.1624768789</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a16"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.9559684046</scalar>
                           <scalar dataType="xsd:string">1.6143009779</scalar>
                           <scalar dataType="xsd:string">0.285428177</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a17"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.7831733482</scalar>
                           <scalar dataType="xsd:string">3.6846524183</scalar>
                           <scalar dataType="xsd:string">-0.5430121013</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a18"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-2.112923667</scalar>
                           <scalar dataType="xsd:string">1.9384348596</scalar>
                           <scalar dataType="xsd:string">-0.3505050216</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a19"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.4158698132</scalar>
                           <scalar dataType="xsd:string">1.2554216977</scalar>
                           <scalar dataType="xsd:string">-0.6174674263</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a20"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.5685220848</scalar>
                           <scalar dataType="xsd:string">-0.1158255763</scalar>
                           <scalar dataType="xsd:string">0.005075087</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a21"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.4185926552</scalar>
                           <scalar dataType="xsd:string">-0.3031897697</scalar>
                           <scalar dataType="xsd:string">1.3843758781</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a22"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.9196297042</scalar>
                           <scalar dataType="xsd:string">-1.2146966283</scalar>
                           <scalar dataType="xsd:string">-0.7833742695</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a23"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.6146348717</scalar>
                           <scalar dataType="xsd:string">-1.5571814471</scalar>
                           <scalar dataType="xsd:string">1.9572711543</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a24"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.1269109596</scalar>
                           <scalar dataType="xsd:string">-2.4695613041</scalar>
                           <scalar dataType="xsd:string">-0.2116557537</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a25"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.9735037111</scalar>
                           <scalar dataType="xsd:string">-2.6450841845</scalar>
                           <scalar dataType="xsd:string">1.1609573672</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a26"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.2621085611</scalar>
                           <scalar dataType="xsd:string">-1.5800647592</scalar>
                           <scalar dataType="xsd:string">-1.9098027886</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a27"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.7416174137</scalar>
                           <scalar dataType="xsd:string">0.7065712064</scalar>
                           <scalar dataType="xsd:string">-1.2815192571</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a28"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.2881990437</scalar>
                           <scalar dataType="xsd:string">-1.3606744153</scalar>
                           <scalar dataType="xsd:string">1.9285089502</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a29"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.5989792103</scalar>
                           <scalar dataType="xsd:string">-2.4950797344</scalar>
                           <scalar dataType="xsd:string">1.5430187296</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a30"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.9678310584</scalar>
                           <scalar dataType="xsd:string">-0.8257892568</scalar>
                           <scalar dataType="xsd:string">1.9959297966</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a31"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">5.9983069135</scalar>
                           <scalar dataType="xsd:string">-2.1433212945</scalar>
                           <scalar dataType="xsd:string">-0.619722148</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a32"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">5.5530784654</scalar>
                           <scalar dataType="xsd:string">-0.8414311477</scalar>
                           <scalar dataType="xsd:string">-1.731434047</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a33"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">6.3050485843</scalar>
                           <scalar dataType="xsd:string">-0.4569071073</scalar>
                           <scalar dataType="xsd:string">-0.1753892761</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a34"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">2.0094675695</scalar>
                           <scalar dataType="xsd:string">-2.7493359663</scalar>
                           <scalar dataType="xsd:string">0.5208064597</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a35"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.212185523</scalar>
                           <scalar dataType="xsd:string">-3.4231959537</scalar>
                           <scalar dataType="xsd:string">0.5867911836</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a36"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-1.0435508246</scalar>
                           <scalar dataType="xsd:string">-3.3923843888</scalar>
                           <scalar dataType="xsd:string">-0.9805693154</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a37"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-1.2937138335</scalar>
                           <scalar dataType="xsd:string">-2.0869807899</scalar>
                           <scalar dataType="xsd:string">0.1613683514</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a38"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.0914674559</scalar>
                           <scalar dataType="xsd:string">-0.562783293</scalar>
                           <scalar dataType="xsd:string">-2.3860408403</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a39"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.5146989179</scalar>
                           <scalar dataType="xsd:string">-0.3882709153</scalar>
                           <scalar dataType="xsd:string">-1.6732245617</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a40"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.2038560128</scalar>
                           <scalar dataType="xsd:string">-1.700798051</scalar>
                           <scalar dataType="xsd:string">-2.8033878889</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a41"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.6535317702</scalar>
                           <scalar dataType="xsd:string">3.9375693031</scalar>
                           <scalar dataType="xsd:string">0.5483719121</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a42"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.3509413547</scalar>
                           <scalar dataType="xsd:string">2.6600551633</scalar>
                           <scalar dataType="xsd:string">1.7517779926</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a43"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.7213965734</scalar>
                           <scalar dataType="xsd:string">0.6875740913</scalar>
                           <scalar dataType="xsd:string">0.7817060694</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a44"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.5533829208</scalar>
                           <scalar dataType="xsd:string">4.6828307152</scalar>
                           <scalar dataType="xsd:string">-0.8777788126</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a45"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.5569806886</scalar>
                           <scalar dataType="xsd:string">1.184515622</scalar>
                           <scalar dataType="xsd:string">-1.7014720563</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a46"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.2205564697</scalar>
                           <scalar dataType="xsd:string">1.9095926897</scalar>
                           <scalar dataType="xsd:string">-0.2569465156</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a47"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.1442144537</scalar>
                           <scalar dataType="xsd:string">0.5386753666</scalar>
                           <scalar dataType="xsd:string">2.0103073396</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a48"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.0337184657</scalar>
                           <scalar dataType="xsd:string">-1.0881521491</scalar>
                           <scalar dataType="xsd:string">-1.8550773942</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a49"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.4880838315</scalar>
                           <scalar dataType="xsd:string">-1.6851841943</scalar>
                           <scalar dataType="xsd:string">3.0264689556</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a50"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.3978465828</scalar>
                           <scalar dataType="xsd:string">-3.3098129967</scalar>
                           <scalar dataType="xsd:string">-0.841054803</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a51"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.1257278525</scalar>
                           <scalar dataType="xsd:string">-3.6210752606</scalar>
                           <scalar dataType="xsd:string">1.6074077356</scalar>
                        </list>
                     </module>
                  </list>
               </module>
            </module>
         </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:run.date">
                  <scalar dataType="xsd:string">10-Oct-2024</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">EM64L-G16RevC.01</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:degfreedom">
                  <scalar cmlx:templateRef="degfreedom" dataType="xsd:integer">147</scalar>
               </parameter>
               <parameter dictRef="cc:frameworkgroup">
                  <scalar cmlx:templateRef="framework" dataType="xsd:string">C1[X(C22H26O3)]</scalar>
               </parameter>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string">RB3LYP</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string">6-311+G(3df,2p)</scalar>
               </parameter>
               <parameter dictRef="g:operation">
                  <scalar dataType="xsd:string">SP</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">#P</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">B3LYP</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">6-311+G(3df,2p)</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">EmpiricalDispersion=gd3</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">geom=check</scalar>
               </parameter>
               <parameter dictRef="g:keyword">
                  <scalar dataType="xsd:string">guess=read</scalar>
               </parameter>
            </parameterList>
            <molecule cmlx:templateRef="atom"
                      formalCharge="0"
                      id="mol.l202.orient"
                      spinMultiplicity="1">
               <atomArray>
                  <atom elementType="O"
                        id="a1"
                        x3="2.184856"
                        y3="2.180139"
                        z3="0.120011">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a2"
                        x3="1.732449"
                        y3="0.390783"
                        z3="1.424881">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="O"
                        id="a3"
                        x3="-2.087731"
                        y3="3.264701"
                        z3="-0.773666">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a4"
                        x3="4.208753"
                        y3="-0.945484"
                        z3="0.064266">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a5"
                        x3="3.043546"
                        y3="-1.252874"
                        z3="-0.828348">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a6"
                        x3="3.311906"
                        y3="0.210086"
                        z3="-0.385797">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a7"
                        x3="4.205466"
                        y3="-1.400345"
                        z3="1.511857">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a8"
                        x3="5.591992"
                        y3="-0.963485"
                        z3="-0.564999">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a9"
                        x3="1.849441"
                        y3="-2.010627"
                        z3="-0.363839">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a10"
                        x3="2.342657"
                        y3="0.88395"
                        z3="0.501926">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a11"
                        x3="0.622349"
                        y3="-1.915686"
                        z3="-0.888517">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a12"
                        x3="-0.527098"
                        y3="-2.718805"
                        z3="-0.343617">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a13"
                        x3="0.269716"
                        y3="-0.980116"
                        z3="-2.01482">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a14"
                        x3="1.197782"
                        y3="2.957507"
                        z3="0.851531">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a15"
                        x3="-0.170656"
                        y3="2.799164"
                        z3="0.279507">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a16"
                        x3="-1.0268"
                        y3="1.639568"
                        z3="0.334139">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a17"
                        x3="-0.865368"
                        y3="3.743824"
                        z3="-0.40652">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a18"
                        x3="-2.172108"
                        y3="1.972037"
                        z3="-0.318358">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a19"
                        x3="-3.456984"
                        y3="1.281326"
                        z3="-0.646164">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a20"
                        x3="-3.603974"
                        y3="-0.1159"
                        z3="-0.082841">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a21"
                        x3="-3.48632"
                        y3="-0.356294"
                        z3="1.291358">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a22"
                        x3="-3.917646"
                        y3="-1.187235"
                        z3="-0.923257">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a23"
                        x3="-3.67725"
                        y3="-1.635013"
                        z3="1.808621">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a24"
                        x3="-4.119767"
                        y3="-2.466942"
                        z3="-0.407497">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="C"
                        id="a25"
                        x3="-3.998651"
                        y3="-2.695187"
                        z3="0.960584">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a26"
                        x3="3.295295"
                        y3="-1.402073"
                        z3="-1.875633">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a27"
                        x3="3.722808"
                        y3="0.86425"
                        z3="-1.144616">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a28"
                        x3="3.220156"
                        y3="-1.336647"
                        z3="1.967741">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a29"
                        x3="4.55792"
                        y3="-2.435379"
                        z3="1.571759">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a30"
                        x3="4.888951"
                        y3="-0.780411"
                        z3="2.100164">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a31"
                        x3="6.006217"
                        y3="-1.976636"
                        z3="-0.53805">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a32"
                        x3="5.569141"
                        y3="-0.637796"
                        z3="-1.60834">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a33"
                        x3="6.275117"
                        y3="-0.305124"
                        z3="-0.019152">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a34"
                        x3="1.999586"
                        y3="-2.686196"
                        z3="0.473054">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a35"
                        x3="-0.212212"
                        y3="-3.394559"
                        z3="0.454222">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a36"
                        x3="-1.003758"
                        y3="-3.312981"
                        z3="-1.131823">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a37"
                        x3="-1.303325"
                        y3="-2.058286"
                        z3="0.054213">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a38"
                        x3="1.121841"
                        y3="-0.398319"
                        z3="-2.367489">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a39"
                        x3="-0.504497"
                        y3="-0.276066"
                        z3="-1.690429">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a40"
                        x3="-0.144466"
                        y3="-1.537464"
                        z3="-2.863405">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a41"
                        x3="1.538486"
                        y3="3.988292"
                        z3="0.75724">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a42"
                        x3="1.225361"
                        y3="2.659194"
                        z3="1.900586">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a43"
                        x3="-0.790477"
                        y3="0.697186"
                        z3="0.799118">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a44"
                        x3="-0.642769"
                        y3="4.757893"
                        z3="-0.695218">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a45"
                        x3="-3.569307"
                        y3="1.251956"
                        z3="-1.735442">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a46"
                        x3="-4.280731"
                        y3="1.908661"
                        z3="-0.281022">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a47"
                        x3="-3.241182"
                        y3="0.463674"
                        z3="1.957218">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a48"
                        x3="-4.006361"
                        y3="-1.019434"
                        z3="-1.99169">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a49"
                        x3="-3.575992"
                        y3="-1.803988"
                        z3="2.874819">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a50"
                        x3="-4.3614"
                        y3="-3.285109"
                        z3="-1.076666">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
                  <atom elementType="H"
                        id="a51"
                        x3="-4.146911"
                        y3="-3.69044"
                        z3="1.363744">
                     <property dictRef="g:atomicType">
                        <scalar dataType="xsd:integer">0</scalar>
                     </property>
                  </atom>
               </atomArray>
               <bondArray/>
               <formula concise="C22H26O3"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">312.2335999999998</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1/22C.3O.26H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;1;2;3;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/rA:51nO0O0O0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.1849,2.1801,.12;1.7324,.3908,1.4249;-2.0877,3.2647,-.7737;4.2088,-.9455,.0643;3.0435,-1.2529,-.8283;3.3119,.2101,-.3858;4.2055,-1.4003,1.5119;5.592,-.9635,-.565;1.8494,-2.0106,-.3638;2.3427,.884,.5019;.6223,-1.9157,-.8885;-.5271,-2.7188,-.3436;.2697,-.9801,-2.0148;1.1978,2.9575,.8515;-.1707,2.7992,.2795;-1.0268,1.6396,.3341;-.8654,3.7438,-.4065;-2.1721,1.972,-.3184;-3.457,1.2813,-.6462;-3.604,-.1159,-.0828;-3.4863,-.3563,1.2914;-3.9176,-1.1872,-.9233;-3.6772,-1.635,1.8086;-4.1198,-2.4669,-.4075;-3.9987,-2.6952,.9606;3.2953,-1.4021,-1.8756;3.7228,.8642,-1.1446;3.2202,-1.3366,1.9677;4.5579,-2.4354,1.5718;4.889,-.7804,2.1002;6.0062,-1.9766,-.5381;5.5691,-.6378,-1.6083;6.2751,-.3051,-.0192;1.9996,-2.6862,.4731;-.2122,-3.3946,.4542;-1.0038,-3.313,-1.1318;-1.3033,-2.0583,.0542;1.1218,-.3983,-2.3675;-.5045,-.2761,-1.6904;-.1445,-1.5375,-2.8634;1.5385,3.9883,.7572;1.2254,2.6592,1.9006;-.7905,.6972,.7991;-.6428,4.7579,-.6952;-3.5693,1.252,-1.7354;-4.2807,1.9087,-.281;-3.2412,.4637,1.9572;-4.0064,-1.0194,-1.9917;-3.576,-1.804,2.8748;-4.3614,-3.2851,-1.0767;-4.1469,-3.6904,1.3637;</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l1" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l1.end">
                     <array dataType="xsd:string" dictRef="g:kk" size="1">oldchk=opt-b3lyp-pople.chk</array>
                     <scalar cmlx:templateRef="title" dataType="xsd:string" dictRef="cc:title">#P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3 geom=check guess=read</scalar>
                     <list cmlx:templateRef="control">
                        <scalar dataType="xsd:string" dictRef="g:control">1/29=2,38=1,172=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">2/12=2,40=1/2</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">3/5=4,6=6,7=216,11=2,14=-4,25=1,30=1,74=-5,116=-2,124=31/1,2,3</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">4/5=1/1</scalar>
                        <scalar dataType="xsd:string" dictRef="g:control">5/5=2,38=6/2</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">99/5=1,9=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">Single Point Resmethrin_RS CONF10 gas</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>
                  <module cmlx:templateRef="l101.isotope2">
                     <array cmlx:templateRef="atom"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">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</array>
                     <array cmlx:templateRef="iatwgt"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">16 16 16 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 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</array>
                     <array cmlx:templateRef="atmwgt"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="51">15.9949146 15.9949146 15.9949146 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250</array>
                     <array cmlx:templateRef="nucspn"
                            dataType="xsd:integer"
                            dictRef="x:x"
                            size="51">0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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</array>
                     <array cmlx:templateRef="atzeff"
                            dataType="xsd:double"
                            dictRef="x:x"
                            size="51">5.6000000 5.6000000 5.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000</array>
                  </module>
                  <list cmlx:templateRef="rest">
                     <scalar dataType="xsd:string" dictRef="x:l101">(Enter /usr/local/gaussian/gaussian16/g16/l101.exe)</scalar>
                  </list>
               </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">6-311+G(3df,2p)</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:diffuse">(5D, 7F)</scalar>
                     <module cmlx:templateRef="ernie">
                        <scalar dataType="xsd:double" dictRef="g:thresh">0.10000e-02</scalar>
                        <scalar dataType="xsd:double" dictRef="g:tol">0.10000e-05</scalar>
                        <scalar dataType="xsd:string" dictRef="g:strict">F</scalar>
                     </module>
                     <list cmlx:templateRef="symmadaptcart">
                        <array dataType="xsd:integer" dictRef="cc:adapted" size="1">1359</array>
                        <array dataType="xsd:string" dictRef="cc:symm" size="1">A</array>
                     </list>
                     <list cmlx:templateRef="symmadapt">
                        <array dataType="xsd:integer" dictRef="cc:adapted" size="1">1209</array>
                        <array dataType="xsd:string" dictRef="cc:symm" size="1">A</array>
                     </list>
                     <scalar dataType="xsd:integer" dictRef="cc:basiscount">1209</scalar>
                     <scalar dataType="xsd:integer" dictRef="g:primbasis">1736</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:cartesianbasis">1359</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:alphae">91</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:betae">91</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:nucrepener">2216.2392900239</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:natoms">51</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:nactiveatoms">51</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:uniqatoms">51</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>
                     <scalar dataType="xsd:string" dictRef="g:misc">IExCor=  402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX=  0.200000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">ScaDFX=  0.800000  0.720000  1.000000  0.810000 ScalE2=  1.000000  1.000000</scalar>
                     <scalar dataType="xsd:string" dictRef="g:misc">IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=131</scalar>
                  </module>
                  <module cmlx:templateRef="l301.dispersion">
                     <scalar dataType="xsd:string" dictRef="g:empdispersion">Grimme-D3</scalar>
                     <scalar dataType="xsd:double" dictRef="g:dispenergy" units="nonsi:hartree">-0.0582576528</scalar>
                  </module>
               </module>
               <module cmlx:templateRef="l202" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="l202.stoich">
                     <scalar cmlx:templateRef="stoich"
                             dataType="xsd:string"
                             dictRef="g:stoichiometry">C22H26O3</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:pointgroup">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:largestconciseabelian">C1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:operatorcount">1</scalar>
                  </module>
                  <module cmlx:templateRef="l202.rotconst">
                     <array cmlx:templateRef="rotconst"
                            dataType="xsd:double"
                            dictRef="cc:rotconst"
                            size="3">0.3082482 0.1551150 0.1183910</array>
                  </module>
               </module>
               <module cmlx:templateRef="l302">
                  <module cmlx:templateRef="l302.basis">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="11">NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="5">One-electron integrals computed using PRISM.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="6">One-electron integral symmetry used in STVInt</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="8">NBasis= 1209 RedAO= T EigKep= 1.21D-06 NBF= 1209</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="7">NBsUse= 1206 1.00D-06 EigRej= 7.77D-07 NBFU= 1206</array>
                     </list>
                  </module>
                  <module cmlx:templateRef="l302.basis2">
                     <list cmlx:templateRef="basis">
                        <array dataType="xsd:string" dictRef="g:basis" size="5">Precomputing XC quadrature grid using</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00.</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="9">Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32</array>
                        <array dataType="xsd:string" dictRef="g:basis" size="10">NSgBfM= 1348 1342 1342 1348 1348 MxSgAt= 51 MxSgA2= 51.</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="l303.basis">
                  <list cmlx:templateRef="l303">
                     <scalar dataType="xsd:integer" dictRef="g:dipdrv">1</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="l502">
                  <scalar dataType="xsd:string" dictRef="g:l502.type">Closed</scalar>
                  <module cmlx:templateRef="l502.cycle">
                     <list cmlx:templateRef="cycle">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="cc:cycle">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:pass">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="g:idiag">1</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="l502.e">
                        <list cmlx:templateRef="l502.e">
                           <scalar dataType="xsd:double" dictRef="g:l502.e">-1079.98243607329</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1080.05011639030</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.067680317006</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1080.05014247269</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000026082385</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1080.05039464025</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000252167566</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1080.05041650604</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000021865790</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1080.05042217525</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000005669212</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1080.05042256682</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000391571</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1080.05042261728</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000050454</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1080.05042262050</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000003222</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1080.05042262066</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000162</scalar>
                           </list>
                        </list>
                     </module>
                     <module cmlx:templateRef="l502.ediff">
                        <list cmlx:templateRef="l502.ediff">
                           <list>
                              <scalar dataType="xsd:double" dictRef="g:l502.e">-1080.05042262114</scalar>
                              <scalar dataType="xsd:double" dictRef="g:l502.deltae">-0.000000000473</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <module cmlx:templateRef="l502.footer">
                     <list cmlx:templateRef="scfdone">
                        <list>
                           <scalar dataType="xsd:double" dictRef="g:rbhflyp" units="nonsi:hartree">-1080.05042262</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:ncycle">11</scalar>
                        </list>
                     </list>
                     <module cmlx:templateRef="scfdone">
                        <list cmlx:templateRef="scfdone">
                           <list>
                              <scalar dataType="xsd:double" dictRef="cc:kinener">1.074952720704e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:potener">-6.946154156315e+03</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:eener">2.574969980619e+03</scalar>
                           </list>
                        </list>
                     </module>
                  </module>
                  <list cmlx:templateRef="l502">
                     <scalar dataType="xsd:string" dictRef="g:l502">Using DIIS extrapolation, IDIIS=  1040.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">NGot=  1415577600 LenX=  1411860328 LenY=  1410012088</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on RMS density matrix=1.00D-08 within 128 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on MAX density matrix=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Requested convergence on             energy=1.00D-06.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">No special actions if energy rises.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502">Fock matrices will be formed incrementally for  20 cycles.</scalar>
                     <scalar dataType="xsd:string" dictRef="g:l502"/>
                  </list>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:jobtime">
                  <scalar dataType="xsd:string">PT51071.700S</scalar>
               </property>
               <property dictRef="cc:jobdatetime.end">
                  <scalar dataType="xsd:date">2024-10-10T06:53:08.000</scalar>
               </property>
               <property dictRef="cc:popanal">
                  <module cmlx:templateRef="l601.popanal">
                     <array dataType="xsd:double" dictRef="g:alphaocc" size="91">-19.18949 -19.16091 -19.10202 -10.29367 -10.23194 -10.22977 -10.22158 -10.19677 -10.19261 -10.19237 -10.18631 -10.18546 -10.18004 -10.17991 -10.17931 -10.17915 -10.17837 -10.17809 -10.16992 -10.16597 -10.16520 -10.15505 -10.15456 -10.15435 -10.15078 -1.11127 -1.09649 -1.01163 -0.88180 -0.86840 -0.81784 -0.80581 -0.80254 -0.75543 -0.75229 -0.74373 -0.72645 -0.69594 -0.69074 -0.68578 -0.68198 -0.63853 -0.61509 -0.60139 -0.58652 -0.57071 -0.55564 -0.53922 -0.52708 -0.52367 -0.51290 -0.49420 -0.47997 -0.47710 -0.47039 -0.46540 -0.45802 -0.45369 -0.45186 -0.44120 -0.43950 -0.43015 -0.42861 -0.42840 -0.41696 -0.41560 -0.41099 -0.40459 -0.39819 -0.39210 -0.38691 -0.38261 -0.38003 -0.37418 -0.36893 -0.36545 -0.35808 -0.35388 -0.35223 -0.35083 -0.34913 -0.32866 -0.30902 -0.29676 -0.28612 -0.28066 -0.27348 -0.26328 -0.25830 -0.23202 -0.22546</array>
                     <array dataType="xsd:double" dictRef="g:alphavirt" size="1115">-0.02445 -0.02111 -0.01047 -0.00513 -0.00374 0.00211 0.01085 0.01177 0.01711 0.02066 0.02279 0.02854 0.02932 0.03518 0.03610 0.04055 0.04224 0.04469 0.04522 0.04838 0.05137 0.05601 0.05891 0.06422 0.06815 0.06889 0.07340 0.07623 0.07894 0.08154 0.08460 0.08760 0.09589 0.09809 0.09960 0.10521 0.10640 0.11059 0.11171 0.11284 0.11924 0.12087 0.12224 0.12470 0.12766 0.13122 0.13625 0.13970 0.14069 0.14136 0.14334 0.14683 0.14796 0.15141 0.15526 0.15780 0.15981 0.16322 0.16579 0.16681 0.16801 0.17137 0.17444 0.17565 0.17830 0.17960 0.18048 0.18475 0.18723 0.18921 0.18990 0.19177 0.19524 0.19597 0.19848 0.19977 0.20036 0.20293 0.20493 0.20608 0.20946 0.21029 0.21636 0.21792 0.21972 0.22006 0.22151 0.22459 0.22535 0.23050 0.23127 0.23357 0.23819 0.23898 0.23939 0.24327 0.24670 0.24825 0.25077 0.25142 0.25495 0.25717 0.26025 0.26348 0.26459 0.26639 0.26907 0.27362 0.27707 0.27771 0.28076 0.28123 0.28587 0.28791 0.28979 0.29224 0.29485 0.29845 0.30143 0.30506 0.30580 0.30948 0.31045 0.31085 0.31298 0.31794 0.32418 0.32507 0.32736 0.33101 0.33287 0.33719 0.34182 0.34392 0.34710 0.34937 0.35320 0.36016 0.36052 0.36289 0.36695 0.36766 0.37269 0.37884 0.38080 0.38764 0.38965 0.39582 0.39849 0.40189 0.40283 0.41038 0.41117 0.41453 0.41608 0.41899 0.42276 0.42752 0.42853 0.43334 0.43603 0.43947 0.44170 0.44424 0.44832 0.45099 0.45422 0.45643 0.46011 0.46496 0.46908 0.47262 0.47795 0.48150 0.48476 0.48762 0.49148 0.49415 0.49635 0.50071 0.50416 0.50686 0.50896 0.51296 0.51613 0.52362 0.52631 0.52961 0.53196 0.53354 0.53779 0.54185 0.54392 0.54846 0.55048 0.55195 0.55446 0.55690 0.56060 0.56155 0.56823 0.57242 0.57315 0.57468 0.57726 0.58034 0.58408 0.58642 0.58963 0.59137 0.59399 0.59695 0.59883 0.60064 0.60279 0.60694 0.60980 0.61112 0.61212 0.61410 0.61555 0.62116 0.62372 0.62720 0.62913 0.63504 0.63925 0.64276 0.64593 0.64904 0.65156 0.65419 0.65754 0.65903 0.66749 0.66799 0.67094 0.67487 0.67749 0.67935 0.68377 0.68657 0.68904 0.69149 0.69856 0.69920 0.70680 0.70726 0.71306 0.71854 0.72063 0.72308 0.72685 0.72759 0.73128 0.73620 0.74232 0.74848 0.75424 0.75909 0.76136 0.76504 0.76912 0.77232 0.77641 0.77895 0.78456 0.78785 0.79052 0.79646 0.80202 0.80749 0.80927 0.81207 0.81492 0.81682 0.82266 0.82400 0.82819 0.83811 0.83900 0.84413 0.84868 0.85507 0.85910 0.86127 0.86518 0.87008 0.87400 0.87865 0.88120 0.89227 0.89827 0.89888 0.90511 0.90586 0.91315 0.91892 0.92608 0.93115 0.93641 0.94419 0.94993 0.95081 0.95545 0.96546 0.97086 0.97747 0.97897 0.98197 0.98807 0.99264 0.99491 1.00345 1.00856 1.00919 1.01854 1.02724 1.03240 1.03656 1.04089 1.04572 1.04832 1.04958 1.05807 1.05873 1.06200 1.06582 1.07162 1.07299 1.08152 1.08723 1.08968 1.09734 1.10433 1.10768 1.11449 1.11778 1.11974 1.12320 1.12495 1.12989 1.13380 1.13811 1.14061 1.14491 1.15041 1.15407 1.15535 1.16337 1.16645 1.17362 1.17678 1.18307 1.18617 1.18870 1.19518 1.19675 1.20088 1.20254 1.20566 1.20725 1.21166 1.21310 1.21941 1.22131 1.22900 1.23248 1.23312 1.23559 1.23902 1.24320 1.24671 1.25282 1.25719 1.25837 1.26470 1.26696 1.26823 1.27603 1.28481 1.28942 1.29255 1.29535 1.30017 1.30091 1.30488 1.30516 1.31237 1.31914 1.32124 1.32567 1.32858 1.33341 1.33849 1.34047 1.34714 1.34879 1.35133 1.35478 1.35808 1.36086 1.36696 1.36965 1.37269 1.37358 1.37531 1.37927 1.38727 1.39160 1.39724 1.40063 1.40291 1.40949 1.41102 1.41887 1.42167 1.42423 1.43026 1.43128 1.43334 1.43677 1.44034 1.44145 1.45095 1.45101 1.45492 1.45772 1.46547 1.47140 1.47631 1.47847 1.48700 1.48899 1.49694 1.50171 1.50270 1.51074 1.51175 1.51423 1.51853 1.52263 1.52273 1.53192 1.53878 1.54310 1.54667 1.54706 1.55449 1.56189 1.56496 1.56632 1.57034 1.57578 1.58526 1.58909 1.59123 1.60008 1.60501 1.60848 1.61359 1.61960 1.62435 1.63751 1.64226 1.64552 1.65198 1.65885 1.66721 1.67169 1.67327 1.68395 1.69065 1.69188 1.69776 1.70320 1.70709 1.71228 1.72884 1.73004 1.73775 1.74955 1.75432 1.75806 1.77151 1.77639 1.77915 1.78377 1.78767 1.79906 1.80840 1.80965 1.82206 1.82294 1.83099 1.84012 1.84368 1.85416 1.86367 1.86757 1.87678 1.87786 1.88694 1.89062 1.90785 1.91074 1.91936 1.92353 1.93108 1.94883 1.95277 1.95468 1.96628 1.97898 1.98687 1.99340 1.99932 2.00924 2.01438 2.02089 2.02271 2.02717 2.03167 2.04028 2.04507 2.05362 2.05666 2.06954 2.07484 2.08044 2.09102 2.09236 2.10480 2.10869 2.11845 2.12660 2.12849 2.14282 2.14736 2.14832 2.16099 2.16694 2.17447 2.17899 2.18908 2.19041 2.19646 2.21208 2.21949 2.22148 2.22489 2.24803 2.24953 2.25811 2.26103 2.26775 2.28740 2.29366 2.29940 2.30803 2.32217 2.32734 2.33280 2.34697 2.35093 2.36068 2.37435 2.37798 2.38414 2.39029 2.41589 2.42359 2.42842 2.43297 2.45741 2.47259 2.47715 2.48806 2.49748 2.50187 2.51869 2.53565 2.54623 2.55380 2.56843 2.57872 2.59534 2.62092 2.62360 2.62807 2.64138 2.65382 2.67327 2.68702 2.70692 2.73067 2.74157 2.75766 2.76109 2.76691 2.77789 2.78120 2.80553 2.80868 2.81374 2.81980 2.82153 2.82988 2.83937 2.84585 2.85375 2.85487 2.86259 2.86737 2.87114 2.87486 2.88688 2.89250 2.89762 2.90383 2.90826 2.91463 2.91667 2.92431 2.92799 2.93179 2.93699 2.94514 2.94938 2.95661 2.95741 2.96404 2.96731 2.96997 2.97617 2.98356 2.99644 2.99880 3.00361 3.01133 3.01893 3.02011 3.02580 3.03163 3.03763 3.04289 3.04775 3.05206 3.06329 3.06853 3.07447 3.07956 3.08601 3.09099 3.09425 3.10487 3.11132 3.11479 3.12186 3.12936 3.13376 3.13721 3.14858 3.14936 3.15772 3.17179 3.17309 3.18358 3.18665 3.19169 3.19795 3.20471 3.20537 3.22268 3.22398 3.23477 3.23657 3.24240 3.25162 3.26150 3.26251 3.26709 3.26841 3.27139 3.27706 3.28537 3.29047 3.29342 3.29706 3.30368 3.30668 3.31053 3.31202 3.32440 3.32908 3.33682 3.33798 3.34259 3.34677 3.35381 3.36779 3.37602 3.37774 3.38454 3.38715 3.38933 3.40478 3.40753 3.41548 3.42246 3.42555 3.42884 3.43793 3.44351 3.45966 3.46310 3.47056 3.48214 3.48699 3.48884 3.49995 3.50569 3.51042 3.52332 3.53493 3.53551 3.54956 3.55224 3.55729 3.56313 3.57341 3.58093 3.58770 3.59786 3.60643 3.61752 3.62094 3.62657 3.63072 3.64704 3.65789 3.66561 3.66915 3.67803 3.68770 3.68934 3.69882 3.70386 3.70730 3.72010 3.72469 3.73008 3.73093 3.74110 3.74390 3.75143 3.76632 3.76923 3.77591 3.78341 3.80307 3.80644 3.81206 3.81732 3.82378 3.83057 3.83591 3.84624 3.84868 3.86411 3.86949 3.87980 3.89249 3.90109 3.90627 3.91467 3.91672 3.94142 3.94537 3.95578 3.98115 3.98914 3.99516 3.99900 4.00698 4.01128 4.03178 4.06174 4.06810 4.08980 4.09619 4.11077 4.11880 4.12367 4.13037 4.14931 4.16150 4.17251 4.18080 4.19629 4.20036 4.21504 4.21934 4.23536 4.23651 4.25446 4.26215 4.27653 4.28275 4.29634 4.30101 4.31033 4.32675 4.32996 4.33257 4.33398 4.34460 4.34841 4.35791 4.36073 4.36355 4.36869 4.37983 4.38329 4.39352 4.39616 4.40199 4.40930 4.41724 4.41976 4.42533 4.43220 4.44000 4.44947 4.45293 4.45868 4.46639 4.46765 4.47303 4.47818 4.48170 4.49525 4.49795 4.51132 4.51849 4.52823 4.53569 4.53733 4.54055 4.55368 4.55605 4.56635 4.56945 4.57093 4.57897 4.58146 4.59485 4.60631 4.61288 4.61861 4.63119 4.63391 4.63812 4.65320 4.66121 4.66924 4.67596 4.68893 4.69496 4.70701 4.71569 4.71746 4.72227 4.73714 4.74645 4.74720 4.75957 4.77799 4.77890 4.80880 4.82421 4.83274 4.83521 4.84020 4.84752 4.86323 4.87924 4.88152 4.88493 4.92968 4.95594 4.98195 5.00808 5.02699 5.04962 5.06352 5.13365 5.15018 5.15867 5.18040 5.23301 5.25113 5.26461 5.27785 5.31077 5.33454 5.34434 5.36622 5.37175 5.38577 5.40928 5.42969 5.44753 5.47638 5.49950 5.52494 5.54161 5.55284 5.56669 5.60779 5.62573 5.63893 5.66057 5.70670 5.74236 5.75165 5.76659 5.78324 5.79192 5.79522 5.80081 5.81207 5.81967 5.82014 5.82184 5.82814 5.84859 5.85826 5.86987 5.88324 5.88576 5.90811 5.90994 5.91997 5.92329 5.95364 5.95903 5.96621 6.01473 6.02011 6.03496 6.12845 6.13273 6.17433 6.23103 6.32022 6.39288 6.42710 6.56699 6.58146 6.64209 6.70058 6.79102 6.97068 7.06168 7.11664 7.12613 7.15560 7.16400 7.18006 7.19575 7.20238 7.20805 7.21363 7.23072 7.23449 7.25057 7.26730 7.27770 7.28900 7.30519 7.30740 7.31243 7.32675 7.33618 7.33751 7.34712 7.35205 7.36416 7.37583 7.38335 7.39423 7.39987 7.41207 7.42355 7.43048 7.43282 7.44721 7.45002 7.46414 7.46836 7.47905 7.49787 7.52168 7.52838 7.54942 7.57376 7.58651 7.59461 7.62473 7.63786 7.63950 7.64736 7.65271 7.67424 7.68158 7.69481 7.69977 7.71661 7.73055 7.74465 7.75390 7.75804 7.79742 7.82867 7.83831 7.86087 7.87182 7.88671 7.90405 7.92142 7.93731 7.95911 7.96812 7.97724 7.98279 8.00322 8.01029 8.01634 8.03836 8.06254 8.07971 8.08622 8.09900 8.11265 8.12783 8.14106 8.15325 8.17105 8.19867 8.20509 8.24262 8.26149 8.27632 8.29736 8.31087 8.33354 8.34913 8.38766 8.43978 8.45321 8.46231 8.48714 8.51765 8.52389 8.56244 8.65175 8.66937 8.69167 8.74120 8.76791 8.88461 8.94342 9.05058 9.38768 14.41961 14.45642 14.47694 14.49027 14.51363 14.52833 14.55158 14.60516 14.73401 14.82402 14.91531 14.97190 15.10902 15.23641 15.31621 24.00265 24.24798 24.28998 24.33308 24.44632 24.46491 24.47255 24.54556 24.56615 24.57238 24.66068 24.77119 24.84697 24.95842 24.98455 25.19141 25.37214 25.40823 25.60381 25.61296 25.77303 25.79691 50.25165 50.25664 50.53908</array>
                     <module cmlx:templateRef="l601.state">
                        <scalar dataType="xsd:string" dictRef="g:l601.state">1-A.</scalar>
                     </module>
                  </module>
               </property>
               <property>
                  <module cmlx:templateRef="l601.mullik">
                     <scalar dataType="xsd:string" dictRef="g:title">Mulliken charges:</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:serial">1</scalar>
                     <list cmlx:templateRef="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="51">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</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="51">O O O C C C C C C C C C C C C C 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 H H H H H H H H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="51">-0.540331 -0.648604 -0.721709 0.218945 0.331655 -0.240640 -0.563852 -0.263631 -0.495480 0.444549 0.272714 -0.595668 -0.840255 -0.016585 0.772387 -0.374356 0.020220 -0.299406 0.094076 1.194404 -0.587810 -0.373543 -0.344214 -0.346567 -0.231676 0.129872 0.127845 0.186216 0.140363 0.134159 0.145067 0.136309 0.144898 0.120039 0.124385 0.160118 0.364621 0.147509 0.296549 0.148315 0.130543 0.175380 0.200058 0.171195 0.132662 0.163577 0.140613 0.129858 0.130634 0.126388 0.128202</array>
                     </list>
                     <scalar dataType="xsd:double" dictRef="x:chargesum">-0.00000</scalar>
                  </module>
               </property>
               <property dictRef="cc:multipole">
                  <list cmlx:templateRef="multipole">
                     <array dataType="xsd:double" dictRef="cc:dipole" size="3">-0.0062 -0.0082 -0.8776</array>
                     <scalar dataType="xsd:double" dictRef="x:dipole">0.8777</scalar>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">-145.1570 -143.2351 -148.6073</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="3">3.4514 -0.6548 1.0770</array>
                     <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">0.5095 2.4313 -2.9408 3.4514 -0.6548 1.0770</array>
                     <array dataType="xsd:double" dictRef="cc:octapole" size="10">67.0826 45.1551 0.6280 -0.0096 -7.3541 -11.1677 -7.9087 0.3310 12.5204 -0.1361</array>
                     <array dataType="xsd:double" dictRef="cc:hexadecapole" size="15">-8412.9455 -3473.1432 -1060.3839 -59.3762 70.5467 128.7879 -33.5295 -4.7538 -6.0007 -1973.2835 -1515.5896 -789.7101 12.7927 19.4799 33.0947</array>
                  </list>
               </property>
               <property dictRef="cc:virtualorbs">
                  <array dataType="xsd:string" delimiter="|" size="1115">(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)|(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)|(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)|(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)|(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)|(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)|(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)|(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)|(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)|(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>
               </property>
               <property dictRef="cc:occupiedorbs">
                  <array dataType="xsd:string" delimiter="|" size="91">(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>
               </property>
            </propertyList>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="l9999.archive" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="ginc">
                     <list dictRef="g:archive">
                        <list dictRef="g:archive1">
                           <scalar dataType="xsd:string" dictRef="cc:hostname">GINC-BELVIS4</scalar>
                           <formula concise="C 22.0 H 26.0 O 3.0" formalCharge="0">
                              <atomArray count="22.0 26.0 3.0" elementType="C H O"/>
                           </formula>
                           <scalar dataType="xsd:string" dictRef="cc:jobname">APULGAR</scalar>
                           <scalar dataType="xsd:date">2024-10-10T00:00:00.000</scalar>
                           <scalar dataType="xsd:string" dictRef="g:zmat">0</scalar>
                        </list>
                        <scalar dataType="xsd:string" dictRef="cc:title">Single Point Resmethrin_RS CONF10 gas</scalar>
                        <list dictRef="cc:molecule">
                           <list type="chargemult">
                              <scalar dataType="xsd:string" dictRef="x:formalCharge">0</scalar>
                              <scalar dataType="xsd:string" dictRef="x:spinMultiplicity">1</scalar>
                           </list>
                        </list>
                        <list dictRef="g:archive.namevalue">
                           <scalar dataType="xsd:string">Version=EM64L-G16RevC.01</scalar>
                           <scalar dataType="xsd:string">State=1-A</scalar>
                           <scalar dataType="xsd:string">HF=-1080.0504226</scalar>
                           <scalar dataType="xsd:string">RMSD=5.375e-09</scalar>
                           <scalar dataType="xsd:string">Dipole=-0.0114874,-0.0169084,-0.3447076</scalar>
                           <scalar dataType="xsd:string">Quadrupole=0.4275506,1.7849842,-2.2125348,2.5823619,-0.646493,0.5830114</scalar>
                           <scalar dataType="xsd:string">PG=C01 [X(C22H26O3)]</scalar>
                        </list>
                     </list>
                  </list>
                  <list id="molRoot0">
                     <module id="moleculeRoot">
                        <list type="molecule">
                           <atom elementType="O" id="a1"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">2.2565668273</scalar>
                           <scalar dataType="xsd:string">2.0956141527</scalar>
                           <scalar dataType="xsd:string">-0.0319873493</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="O" id="a2"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.8122436618</scalar>
                           <scalar dataType="xsd:string">0.3668649666</scalar>
                           <scalar dataType="xsd:string">1.3547911778</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="O" id="a3"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-2.0215671194</scalar>
                           <scalar dataType="xsd:string">3.2104905587</scalar>
                           <scalar dataType="xsd:string">-0.859360517</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a4"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.2324252732</scalar>
                           <scalar dataType="xsd:string">-1.0610353435</scalar>
                           <scalar dataType="xsd:string">-0.0137060102</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a5"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.03996679</scalar>
                           <scalar dataType="xsd:string">-1.3854135767</scalar>
                           <scalar dataType="xsd:string">-0.8632807096</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a6"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.3411295836</scalar>
                           <scalar dataType="xsd:string">0.089611387</scalar>
                           <scalar dataType="xsd:string">-0.4868196285</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a7"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.2602477196</scalar>
                           <scalar dataType="xsd:string">-1.4578602278</scalar>
                           <scalar dataType="xsd:string">1.4505978393</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a8"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">5.5983711027</scalar>
                           <scalar dataType="xsd:string">-1.1256874689</scalar>
                           <scalar dataType="xsd:string">-0.6767760525</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a9"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.8474356505</scalar>
                           <scalar dataType="xsd:string">-2.1053184025</scalar>
                           <scalar dataType="xsd:string">-0.3384448974</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a10"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">2.4053152516</scalar>
                           <scalar dataType="xsd:string">0.8133287718</scalar>
                           <scalar dataType="xsd:string">0.3975297499</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a11"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">0.608596111</scalar>
                           <scalar dataType="xsd:string">-2.012131812</scalar>
                           <scalar dataType="xsd:string">-0.8350801069</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a12"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.5378633079</scalar>
                           <scalar dataType="xsd:string">-2.7748622839</scalar>
                           <scalar dataType="xsd:string">-0.2292609547</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a13"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">0.2404186207</scalar>
                           <scalar dataType="xsd:string">-1.1166915509</scalar>
                           <scalar dataType="xsd:string">-1.9886978606</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a14"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.3003741081</scalar>
                           <scalar dataType="xsd:string">2.916806725</scalar>
                           <scalar dataType="xsd:string">0.6926322698</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a15"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.0846851411</scalar>
                           <scalar dataType="xsd:string">2.7572690674</scalar>
                           <scalar dataType="xsd:string">0.1624768789</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a16"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.9559684046</scalar>
                           <scalar dataType="xsd:string">1.6143009779</scalar>
                           <scalar dataType="xsd:string">0.285428177</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a17"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.7831733482</scalar>
                           <scalar dataType="xsd:string">3.6846524183</scalar>
                           <scalar dataType="xsd:string">-0.5430121013</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a18"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-2.112923667</scalar>
                           <scalar dataType="xsd:string">1.9384348596</scalar>
                           <scalar dataType="xsd:string">-0.3505050216</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a19"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.4158698132</scalar>
                           <scalar dataType="xsd:string">1.2554216977</scalar>
                           <scalar dataType="xsd:string">-0.6174674263</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a20"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.5685220848</scalar>
                           <scalar dataType="xsd:string">-0.1158255763</scalar>
                           <scalar dataType="xsd:string">0.005075087</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a21"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.4185926552</scalar>
                           <scalar dataType="xsd:string">-0.3031897697</scalar>
                           <scalar dataType="xsd:string">1.3843758781</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a22"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.9196297042</scalar>
                           <scalar dataType="xsd:string">-1.2146966283</scalar>
                           <scalar dataType="xsd:string">-0.7833742695</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a23"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.6146348717</scalar>
                           <scalar dataType="xsd:string">-1.5571814471</scalar>
                           <scalar dataType="xsd:string">1.9572711543</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a24"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.1269109596</scalar>
                           <scalar dataType="xsd:string">-2.4695613041</scalar>
                           <scalar dataType="xsd:string">-0.2116557537</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="C" id="a25"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.9735037111</scalar>
                           <scalar dataType="xsd:string">-2.6450841845</scalar>
                           <scalar dataType="xsd:string">1.1609573672</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a26"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.2621085611</scalar>
                           <scalar dataType="xsd:string">-1.5800647592</scalar>
                           <scalar dataType="xsd:string">-1.9098027886</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a27"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.7416174137</scalar>
                           <scalar dataType="xsd:string">0.7065712064</scalar>
                           <scalar dataType="xsd:string">-1.2815192571</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a28"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">3.2881990437</scalar>
                           <scalar dataType="xsd:string">-1.3606744153</scalar>
                           <scalar dataType="xsd:string">1.9285089502</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a29"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.5989792103</scalar>
                           <scalar dataType="xsd:string">-2.4950797344</scalar>
                           <scalar dataType="xsd:string">1.5430187296</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a30"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">4.9678310584</scalar>
                           <scalar dataType="xsd:string">-0.8257892568</scalar>
                           <scalar dataType="xsd:string">1.9959297966</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a31"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">5.9983069135</scalar>
                           <scalar dataType="xsd:string">-2.1433212945</scalar>
                           <scalar dataType="xsd:string">-0.619722148</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a32"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">5.5530784654</scalar>
                           <scalar dataType="xsd:string">-0.8414311477</scalar>
                           <scalar dataType="xsd:string">-1.731434047</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a33"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">6.3050485843</scalar>
                           <scalar dataType="xsd:string">-0.4569071073</scalar>
                           <scalar dataType="xsd:string">-0.1753892761</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a34"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">2.0094675695</scalar>
                           <scalar dataType="xsd:string">-2.7493359663</scalar>
                           <scalar dataType="xsd:string">0.5208064597</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a35"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.212185523</scalar>
                           <scalar dataType="xsd:string">-3.4231959537</scalar>
                           <scalar dataType="xsd:string">0.5867911836</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a36"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-1.0435508246</scalar>
                           <scalar dataType="xsd:string">-3.3923843888</scalar>
                           <scalar dataType="xsd:string">-0.9805693154</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a37"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-1.2937138335</scalar>
                           <scalar dataType="xsd:string">-2.0869807899</scalar>
                           <scalar dataType="xsd:string">0.1613683514</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a38"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.0914674559</scalar>
                           <scalar dataType="xsd:string">-0.562783293</scalar>
                           <scalar dataType="xsd:string">-2.3860408403</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a39"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.5146989179</scalar>
                           <scalar dataType="xsd:string">-0.3882709153</scalar>
                           <scalar dataType="xsd:string">-1.6732245617</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a40"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.2038560128</scalar>
                           <scalar dataType="xsd:string">-1.700798051</scalar>
                           <scalar dataType="xsd:string">-2.8033878889</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a41"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.6535317702</scalar>
                           <scalar dataType="xsd:string">3.9375693031</scalar>
                           <scalar dataType="xsd:string">0.5483719121</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a42"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">1.3509413547</scalar>
                           <scalar dataType="xsd:string">2.6600551633</scalar>
                           <scalar dataType="xsd:string">1.7517779926</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a43"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.7213965734</scalar>
                           <scalar dataType="xsd:string">0.6875740913</scalar>
                           <scalar dataType="xsd:string">0.7817060694</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a44"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-0.5533829208</scalar>
                           <scalar dataType="xsd:string">4.6828307152</scalar>
                           <scalar dataType="xsd:string">-0.8777788126</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a45"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.5569806886</scalar>
                           <scalar dataType="xsd:string">1.184515622</scalar>
                           <scalar dataType="xsd:string">-1.7014720563</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a46"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.2205564697</scalar>
                           <scalar dataType="xsd:string">1.9095926897</scalar>
                           <scalar dataType="xsd:string">-0.2569465156</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a47"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.1442144537</scalar>
                           <scalar dataType="xsd:string">0.5386753666</scalar>
                           <scalar dataType="xsd:string">2.0103073396</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a48"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.0337184657</scalar>
                           <scalar dataType="xsd:string">-1.0881521491</scalar>
                           <scalar dataType="xsd:string">-1.8550773942</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a49"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-3.4880838315</scalar>
                           <scalar dataType="xsd:string">-1.6851841943</scalar>
                           <scalar dataType="xsd:string">3.0264689556</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a50"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.3978465828</scalar>
                           <scalar dataType="xsd:string">-3.3098129967</scalar>
                           <scalar dataType="xsd:string">-0.841054803</scalar>
                        </list>
                        <list type="molecule">
                           <atom elementType="H" id="a51"/>
                           <scalar dataType="xsd:string">0</scalar>
                           <scalar dataType="xsd:string">-4.1257278525</scalar>
                           <scalar dataType="xsd:string">-3.6210752606</scalar>
                           <scalar dataType="xsd:string">1.6074077356</scalar>
                        </list>
                     </module>
                  </list>
               </module>
            </module>
         </module>
      </module>
   </module>
</module>
