<?xml version="1.0" encoding="UTF-8"?>
<module xmlns="http://www.xml-cml.org/schema"
        xmlns:cc="http://www.xml-cml.org/dictionary/compchem/"
        xmlns:cml="http://www.xml-cml.org/schema"
        xmlns:cmlx="http://www.xml-cml.org/schema/cmlx"
        xmlns:convention="http://www.xml-cml.org/convention/"
        xmlns: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:v="http://www.iochem-bd.org/dictionary/vasp/"
        xmlns:xi="http://www.w3.org/2001/XInclude"
        xmlns:xsd="http://www.w3.org/2001/XMLSchema"
        convention="convention:compchem"
        id="vasp.outcar">
   <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">vasp</scalar>
               </parameter>
               <parameter dictRef="cc:programVersion">
                  <scalar dataType="xsd:string">5.4.1</scalar>
               </parameter>
               <parameter dictRef="cc:subversion">
                  <scalar dataType="xsd:string">24Jun15 (build Jul 19 2019 12:39:51) gamma-only</scalar>
               </parameter>
               <parameter dictRef="v:platform">
                  <scalar dataType="xsd:string">IFC91_ompi</scalar>
               </parameter>
               <parameter dictRef="cc:rundate">
                  <scalar dataType="xsd:date">2022-11-25T17:54:20.000</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
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                  <scalar id="sc2" title="b" units="nonsi:angstrom">25.6</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">25.6</scalar>
                  <scalar id="sc4" title="alpha" units="nonsi:degree">90.0</scalar>
                  <scalar id="sc5" title="beta" units="nonsi:degree">90.0</scalar>
                  <scalar id="sc6" title="gamma" units="nonsi:degree">90.0</scalar>
               </crystal>
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                  <bond atomRefs2="a108 a114" order="S"/>
                  <bond atomRefs2="a108 a115" order="S"/>
                  <bond atomRefs2="a108 a116" order="S"/>
                  <bond atomRefs2="a108 a113" order="S"/>
                  <bond atomRefs2="a108 a134" order="S"/>
                  <bond atomRefs2="a109 a110" order="S"/>
                  <bond atomRefs2="a109 a113" order="S"/>
                  <bond atomRefs2="a109 a111" order="S"/>
                  <bond atomRefs2="a110 a115" order="S"/>
                  <bond atomRefs2="a110 a114" order="S"/>
                  <bond atomRefs2="a111 a113" order="S"/>
                  <bond atomRefs2="a111 a134" order="S"/>
                  <bond atomRefs2="a111 a112" order="S"/>
                  <bond atomRefs2="a111 a133" order="S"/>
                  <bond atomRefs2="a112 a133" order="S"/>
                  <bond atomRefs2="a112 a136" order="S"/>
                  <bond atomRefs2="a112 a116" order="S"/>
                  <bond atomRefs2="a112 a113" order="S"/>
                  <bond atomRefs2="a112 a134" order="S"/>
                  <bond atomRefs2="a113 a116" order="S"/>
                  <bond atomRefs2="a113 a115" order="S"/>
                  <bond atomRefs2="a114 a115" order="S"/>
                  <bond atomRefs2="a114 a138" order="S"/>
                  <bond atomRefs2="a115 a116" order="S"/>
                  <bond atomRefs2="a115 a138" order="S"/>
                  <bond atomRefs2="a116 a134" order="S"/>
                  <bond atomRefs2="a116 a138" order="S"/>
                  <bond atomRefs2="a116 a136" order="S"/>
                  <bond atomRefs2="a117 a140" order="S"/>
                  <bond atomRefs2="a119 a139" order="S"/>
                  <bond atomRefs2="a131 a139" order="S"/>
                  <bond atomRefs2="a139 a140" order="S"/>
               </bondArray>
               <formula concise="Ni22Pt116Zr2">
                  <atomArray count="22 116 2" elementType="Ni Pt Zr"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">24102.75080000003</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1S/22Ni.116Pt.2Zr">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:117;118;119;120;121;122;123;124;125;126;127;128;129;130;131;132;133;134;135;136;137;138;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;139;140/rA:140PtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiZrZr/rB:s1;s1;s2s3;s1;s5;s5s6;s5s6;s2;s7s9;s9s10;s1s2s5s7s9s10;s1s2s3s4s12;s9s10s12s13;s1s3s5s8s13;s3s15;s8s15s16;s13s15s16s17;s16s17;s9s11s14;s2s4s9s13s14s20;s4s21;s13s14s18s21s22;s20s21s22s23;s3s4s13s16s18s22s23;s16s18s19s25;s22s23s25s26;s22s24s27;;;s7s10;s29s31;s31s32;s6s7s8;s29s30s34;s6s8s30s34s35;s8s17s36;s34s35s36s37;s10s11s14s20;s31s33s39;s39s40;s14s18s23;s34s38s42;s39s40s42s43;s8s17s18s34s37s38s42s43;s17s18s19s26s45;s42s43s45s46;s19;s48;s46s48s49;s41;s11s20s39s41s51;s20s24s52;s51s52s53;s14s20s23s24s39s42s44s53;s23s24s27s28s55;s42s44s47s55s56;s18s23s26s27s42s46s47s56s57;s26s27s58;s56s57s58s59;s19s26s46s48s50s59;s48s50s61;s59s61s62;s53s54;s24s28s53s56s64;s28s65;s56s60s65s66;s27s28s56s59s60s66s67;s59s60s63s68;s66s67s68s69;s29s30s35;s29s32s35s71;s35s38s43s72;s71s72s73;s72s73s74;s30s35s38s71s73s74;s38s76;s73s74s76s77;s41s51;s33s40s41s79;s40s41s44s80;s75s80s81;s79s80s81s82;s40s43s44s73s75s81s82;s73s75s78s84;s81s82s84s85;s38s43s47s73s77s78s85;s47s50s87;s49s50s77s88;s49s50s62s89;s88s89s90;s41s51s54s79s81s83;s54s64s92;s81s83s86s92s93;s44s57s81s86s93s94;s57s60s67s95;s86s95s96;s93s94s95s96s97;s47s57s60s88s96s97;s96s97s99;s50s62s63s88s90s91;s64s67s93s96s98;s67s70s102;s96s98s100s102s103;s74s75s78s85;s82s83s86s94;s75s82s85s86s105s106;s85s86s97s107;s105s107s108;s106s107s108s109;s78s85s105s108s109;s91s111;s108s109s111s112;s86s94s97s98s106s108s110;s108s110s113s114;s97s100s108s112s113s115;s5s7s8s12s13s14s15s18s34s42s45;s6s29s30s35s36;s6s7s29s31s32s34s35;s30s36s37s38s76s77;s37s49s77s89;s11s41s51s52;s33s41s79s80;s10s11s31s33s39s40s41;s37s38s45s46s47s50s77s87s88s89;s17s19s37s46s48s49s50;s39s41s44s52s53s54s55s81s92s93s95;s53s55s56s57s64s65s67s93s95s96s102;s46s47s50s58s59s60s61s63s88s99s101;s64s65s66s67s102s103;s32s33s40s72s75s80s82s84;s43s44s47s57s84s85s86s87s95s97s99;s77s78s87s88s89s91s111s112;s85s87s88s97s99s108s111s112s116;s60s63s69s99s100s101;s88s91s99s100s101s112s116;s60s67s69s70s96s100s103s104;s97s98s100s104s114s115s116;s31s32s34s35s40s43s72s73s84s119s131;s7s10s14s31s34s39s40s42s43s44s117s139;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
            <parameterList>
               <parameter dictRef="v:ispin">
                  <scalar dataType="xsd:integer">2</scalar>
               </parameter>
               <parameter dictRef="v:energyCutoff">
                  <scalar dataType="xsd:integer" units="nonsi:electronvolt">270</scalar>
               </parameter>
               <parameter dictRef="v:ediff">
                  <scalar dataType="xsd:double">0.2E-04</scalar>
               </parameter>
               <parameter dictRef="v:ediffg">
                  <scalar dataType="xsd:double">-.2E-01</scalar>
               </parameter>
               <parameter dictRef="v:ibrion">
                  <scalar dataType="xsd:integer">2</scalar>
               </parameter>
               <parameter dictRef="v:potim">
                  <scalar dataType="xsd:double">0.3000</scalar>
               </parameter>
               <parameter dictRef="cc:temp">
                  <scalar dataType="xsd:double" units="si:k">0.0</scalar>
               </parameter>
               <parameter dictRef="v:nelect">
                  <scalar dataType="xsd:double">1404.0000</scalar>
               </parameter>
               <parameter dictRef="v:nupdown">
                  <scalar dataType="xsd:double">-1.0000</scalar>
               </parameter>
               <parameter dictRef="v:ismear">
                  <scalar dataType="xsd:integer">1</scalar>
               </parameter>
               <parameter dictRef="v:sigma">
                  <scalar dataType="xsd:double">0.10</scalar>
               </parameter>
               <parameter dictRef="v:ldipol">
                  <scalar dataType="xsd:string">F</scalar>
               </parameter>
               <parameter dictRef="v:idipol">
                  <scalar dataType="xsd:integer">0</scalar>
               </parameter>
               <parameter dictRef="v:gga">
                  <scalar dataType="xsd:string">PE</scalar>
               </parameter>
               <parameter dictRef="v:lexch">
                  <scalar dataType="xsd:string">8</scalar>
               </parameter>
               <parameter dictRef="v:voskown">
                  <scalar dataType="xsd:string">0</scalar>
               </parameter>
               <parameter dictRef="v:lhfcalc">
                  <scalar dataType="xsd:boolean">false</scalar>
               </parameter>
               <parameter dictRef="v:lhfone">
                  <scalar dataType="xsd:string">F</scalar>
               </parameter>
               <parameter dictRef="v:aexx">
                  <scalar dataType="xsd:double">0.0000</scalar>
               </parameter>
            </parameterList>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="potcar" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:string"
                         delimiter="|"
                         dictRef="v:pseudopotential"
                         size="3">PAW_PBE Pt 05Jan2001|PAW_PBE Ni 06Sep2000|PAW_PBE Zr_sv 07Sep2000</array>
                  <array dictRef="cc:atomType" size="3">Pt Ni Zr</array>
                  <array dataType="xsd:double" dictRef="cc:mass" size="3">195.080 58.690 91.224</array>
                  <array dataType="xsd:double" dictRef="cc:valence" size="3">10.000 10.000 12.000</array>
                  <array dataType="xsd:integer" dictRef="cc:atomcount" size="3">116 22 2</array>
               </module>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation">
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="eigenvalues">
                  <list id="spin">
                     <scalar dataType="xsd:integer" dictRef="cc:spin">1</scalar>
                     <array dataType="xsd:integer" dictRef="cc:serial" size="1">1</array>
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            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
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               <property dictRef="cc:energies">
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                     <array dataType="xsd:double"
                            dictRef="cc:freeEnergy"
                            size="1"
                            units="nonsi:electronvolt">-759.91917979</array>
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                            dictRef="v:noEntropyEnergy"
                            size="1"
                            units="nonsi:electronvolt">-760.00485802</array>
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                            dictRef="cc:e0"
                            size="1"
                            units="nonsi:electronvolt">-759.94773920</array>
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                            dictRef="v:efermi"
                            size="1"
                            units="nonsi:electronvolt">-3.7590</array>
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                            dictRef="cc:deltaEnergy"
                            size="1"
                            units="nonsi:electronvolt">0.8647337E-03</array>
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                  <scalar id="sc2" title="b" units="nonsi:angstrom">25.6</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">25.6</scalar>
                  <scalar id="sc4" title="alpha" units="nonsi:degree">90.0</scalar>
                  <scalar id="sc5" title="beta" units="nonsi:degree">90.0</scalar>
                  <scalar id="sc6" title="gamma" units="nonsi:degree">90.0</scalar>
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                  <bond atomRefs2="a94 a114" order="S"/>
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                  <bond atomRefs2="a95 a98" order="S"/>
                  <bond atomRefs2="a95 a97" order="S"/>
                  <bond atomRefs2="a95 a96" order="S"/>
                  <bond atomRefs2="a95 a128" order="S"/>
                  <bond atomRefs2="a95 a127" order="S"/>
                  <bond atomRefs2="a96 a98" order="S"/>
                  <bond atomRefs2="a96 a102" order="S"/>
                  <bond atomRefs2="a96 a100" order="S"/>
                  <bond atomRefs2="a96 a99" order="S"/>
                  <bond atomRefs2="a96 a97" order="S"/>
                  <bond atomRefs2="a96 a137" order="S"/>
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                  <bond atomRefs2="a97 a98" order="S"/>
                  <bond atomRefs2="a97 a114" order="S"/>
                  <bond atomRefs2="a97 a100" order="S"/>
                  <bond atomRefs2="a97 a116" order="S"/>
                  <bond atomRefs2="a97 a99" order="S"/>
                  <bond atomRefs2="a97 a132" order="S"/>
                  <bond atomRefs2="a97 a134" order="S"/>
                  <bond atomRefs2="a97 a108" order="S"/>
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                  <bond atomRefs2="a98 a104" order="S"/>
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                  <bond atomRefs2="a99 a100" order="S"/>
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                  <bond atomRefs2="a99 a129" order="S"/>
                  <bond atomRefs2="a99 a135" order="S"/>
                  <bond atomRefs2="a99 a134" order="S"/>
                  <bond atomRefs2="a99 a136" order="S"/>
                  <bond atomRefs2="a100 a138" order="S"/>
                  <bond atomRefs2="a100 a104" order="S"/>
                  <bond atomRefs2="a100 a116" order="S"/>
                  <bond atomRefs2="a100 a137" order="S"/>
                  <bond atomRefs2="a100 a136" order="S"/>
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                  <bond atomRefs2="a101 a129" order="S"/>
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                  <bond atomRefs2="a103 a130" order="S"/>
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                  <bond atomRefs2="a103 a137" order="S"/>
                  <bond atomRefs2="a104 a137" order="S"/>
                  <bond atomRefs2="a104 a138" order="S"/>
                  <bond atomRefs2="a105 a111" order="S"/>
                  <bond atomRefs2="a105 a107" order="S"/>
                  <bond atomRefs2="a105 a109" order="S"/>
                  <bond atomRefs2="a106 a114" order="S"/>
                  <bond atomRefs2="a106 a107" order="S"/>
                  <bond atomRefs2="a106 a110" order="S"/>
                  <bond atomRefs2="a107 a108" order="S"/>
                  <bond atomRefs2="a107 a110" order="S"/>
                  <bond atomRefs2="a107 a109" order="S"/>
                  <bond atomRefs2="a108 a114" order="S"/>
                  <bond atomRefs2="a108 a111" order="S"/>
                  <bond atomRefs2="a108 a116" order="S"/>
                  <bond atomRefs2="a108 a110" order="S"/>
                  <bond atomRefs2="a108 a115" order="S"/>
                  <bond atomRefs2="a108 a113" order="S"/>
                  <bond atomRefs2="a108 a109" order="S"/>
                  <bond atomRefs2="a108 a134" order="S"/>
                  <bond atomRefs2="a109 a113" order="S"/>
                  <bond atomRefs2="a109 a110" order="S"/>
                  <bond atomRefs2="a109 a111" order="S"/>
                  <bond atomRefs2="a110 a115" order="S"/>
                  <bond atomRefs2="a110 a114" order="S"/>
                  <bond atomRefs2="a111 a134" order="S"/>
                  <bond atomRefs2="a111 a113" order="S"/>
                  <bond atomRefs2="a111 a112" order="S"/>
                  <bond atomRefs2="a111 a133" order="S"/>
                  <bond atomRefs2="a112 a116" order="S"/>
                  <bond atomRefs2="a112 a113" order="S"/>
                  <bond atomRefs2="a112 a136" order="S"/>
                  <bond atomRefs2="a112 a133" order="S"/>
                  <bond atomRefs2="a112 a134" order="S"/>
                  <bond atomRefs2="a113 a115" order="S"/>
                  <bond atomRefs2="a113 a116" order="S"/>
                  <bond atomRefs2="a114 a138" order="S"/>
                  <bond atomRefs2="a114 a115" order="S"/>
                  <bond atomRefs2="a115 a116" order="S"/>
                  <bond atomRefs2="a115 a138" order="S"/>
                  <bond atomRefs2="a116 a138" order="S"/>
                  <bond atomRefs2="a116 a136" order="S"/>
                  <bond atomRefs2="a117 a140" order="S"/>
                  <bond atomRefs2="a118 a119" order="S"/>
                  <bond atomRefs2="a119 a139" order="S"/>
                  <bond atomRefs2="a120 a121" order="S"/>
                  <bond atomRefs2="a121 a126" order="S"/>
                  <bond atomRefs2="a121 a125" order="S"/>
                  <bond atomRefs2="a122 a124" order="S"/>
                  <bond atomRefs2="a122 a123" order="S"/>
                  <bond atomRefs2="a123 a124" order="S"/>
                  <bond atomRefs2="a131 a139" order="S"/>
                  <bond atomRefs2="a135 a136" order="S"/>
                  <bond atomRefs2="a135 a137" order="S"/>
                  <bond atomRefs2="a139 a140" order="S"/>
               </bondArray>
               <formula concise="Ni22Pt116Zr2">
                  <atomArray count="22 116 2" elementType="Ni Pt Zr"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">24102.75080000003</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1S/22Ni.116Pt.2Zr">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:117;118;119;120;121;122;123;124;125;126;127;128;129;130;131;132;133;134;135;136;137;138;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;139;140/rA:140PtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiNiZrZr/rB:s1;s1;s2s3;s1;s5;s5s6;s5s6;s2;s7s9;s9s10;s1s2s5s7s9s10;s1s2s3s4;s9s12s13;s1s3s5s8s13;s3s15;s8s15s16;s13s15s16s17;s16s17;s9s11s14;s2s4s9s14s20;s4s21;s13s14s18s22;s20s21s22s23;s3s4s13s16s18s22s23;s16s19s25;s22s23s25s26;s22s24s27;;;s7s10;s29s31;s31s32;s6s7;s29s30s34;s6s8s30s35;s8s17s36;s34s35s36s37;s11s14s20;s33s39;s39s40;s14s18s23;s34s38s42;s39s40s42s43;s8s17s18s34s37s38s42s43;s17s18s19s45;s42s43s45s46;s19;s48;s46s48s49;s41;s11s20s39s41s51;s20s24s52;s51s52s53;s14s20s23s24s39s42s44s53;s23s28s55;s42s44s47s55s56;s18s23s26s27s42s46s47s56s57;s26s27s58;s56s57s58s59;s19s26s46s48s50s59;s48s50s61;s59s61s62;s53s54;s24s28s53s56s64;s28s65;s56s60s65s66;s27s28s56s59s60s66s67;s59s60s63s68;s66s67s68s69;s29s30s35;s29s32s71;s35s38s43;s71s72s73;s72s73s74;s30s35s38s71s73s74;s38s76;s73s74s76s77;s41s51;s33s40s41s79;s40s41s44s80;s75s80s81;s79s80s81s82;s40s43s44s73s75s81s82;s73s84;s81s84s85;s38s43s47s73s77s78s85;s47s50s87;s49s50s77s88;s49s50s62s89;s88s89s90;s41s51s54s79s81s83;s54s64s92;s81s83s86s92s93;s44s57s81s86s93s94;s57s60s67s95;s86s95s96;s93s94s95s96s97;s47s57s60s88s96s97;s96s97s99;s50s62s63s88s90s91;s64s67s93s96s98;s67s70s102;s96s98s100s102s103;s74s75s78s85;s82s83s86s94;s75s82s85s86s105s106;s85s86s97s107;s105s107s108;s106s107s108s109;s78s85s105s108s109;s91s111;s108s109s111s112;s86s94s97s98s106s108s110;s108s110s113s114;s97s100s108s112s113s115;s5s12s13s15s18s34s42s45;s6s29s30s35s36;s6s7s29s31s34s118;s30s36s37s38s76s77;s37s49s77s89s120;s11s41s51s52;s33s41s79s80s122;s10s11s31s33s39s40s122s123;s37s38s46s47s50s77s87s88s89s121;s17s19s37s46s48s49s50s121;s39s41s44s54s55s81s95;s55s56s57s64s67s95s96s102;s46s47s50s58s60s61s63s88s99s101;s64s65s66s67s102s103;s33s72s75s80s82s84;s43s44s47s57s85s86s87s97s99;s77s78s87s88s89s91s111s112;s85s87s88s97s99s108s111s112;s60s63s69s99s100s101;s88s91s99s100s101s112s116s135;s60s67s69s70s96s100s103s104s135;s97s98s100s104s114s115s116;s31s32s34s35s40s43s72s73s84s119s131;s7s10s14s31s34s39s40s42s44s117s139;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
         </module>
      </module>
   </module>
</module>
