<?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">5.4.4</scalar>
               </parameter>
               <parameter dictRef="cc:subversion">
                  <scalar dataType="xsd:string">18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complex</scalar>
               </parameter>
               <parameter dictRef="v:platform">
                  <scalar dataType="xsd:string">LinuxIFC</scalar>
               </parameter>
               <parameter dictRef="cc:rundate">
                  <scalar dataType="xsd:date">2022-10-25T13:26:07.000</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <molecule id="initial">
               <crystal>
                  <scalar id="sc1" title="a" units="nonsi:angstrom">5.667241101813827</scalar>
                  <scalar id="sc2" title="b" units="nonsi:angstrom">5.667240973429664</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">23.194183</scalar>
                  <scalar id="sc4" title="alpha" units="nonsi:degree">86.5</scalar>
                  <scalar id="sc5" title="beta" units="nonsi:degree">86.5</scalar>
                  <scalar id="sc6" title="gamma" units="nonsi:degree">60.0</scalar>
               </crystal>
               <atomArray>
                  <atom elementType="Pt"
                        id="a1"
                        x3="2.86415874"
                        xFract="0.337978"
                        y3="1.65775167"
                        yFract="0.337978"
                        z3="1.39371295"
                        zFract="0.0500"/>
                  <atom elementType="Pt"
                        id="a2"
                        x3="4.27302674"
                        xFract="0.337978"
                        y3="4.11020667"
                        yFract="0.837978"
                        z3="1.56680395"
                        zFract="0.0500"/>
                  <atom elementType="Pt"
                        id="a3"
                        x3="5.69248774"
                        xFract="0.837978"
                        y3="1.65775167"
                        yFract="0.337978"
                        z3="1.56680395"
                        zFract="0.0500"/>
                  <atom elementType="Pt"
                        id="a4"
                        x3="7.10135574"
                        xFract="0.837978"
                        y3="4.11020667"
                        yFract="0.837978"
                        z3="1.73989495"
                        zFract="0.0500"/>
                  <atom elementType="Pt"
                        id="a5"
                        x3="4.13530936"
                        xFract="0.487977"
                        y3="2.39348327"
                        yFract="0.487977"
                        z3="3.81698516"
                        zFract="0.1500"/>
                  <atom elementType="Pt"
                        id="a6"
                        x3="5.54417736"
                        xFract="0.487977"
                        y3="4.84593827"
                        yFract="0.987977"
                        z3="3.99007616"
                        zFract="0.1500"/>
                  <atom elementType="Pt"
                        id="a7"
                        x3="6.96363836"
                        xFract="0.987977"
                        y3="2.39348327"
                        yFract="0.487977"
                        z3="3.99007616"
                        zFract="0.1500"/>
                  <atom elementType="Pt"
                        id="a8"
                        x3="8.37250636"
                        xFract="0.987977"
                        y3="4.84593827"
                        yFract="0.987977"
                        z3="4.16316716"
                        zFract="0.1500"/>
                  <atom elementType="Pt"
                        id="a9"
                        x3="1.15788993"
                        xFract="0.13630985"
                        y3="0.67336856"
                        yFract="0.13728459"
                        z3="5.90175942"
                        zFract="0.25036648"/>
                  <atom elementType="Pt"
                        id="a10"
                        x3="2.57257376"
                        xFract="0.13649951"
                        y3="3.1340798"
                        yFract="0.63896785"
                        z3="6.0757762"
                        zFract="0.25037844"/>
                  <atom elementType="Pt"
                        id="a11"
                        x3="3.99557248"
                        xFract="0.63795696"
                        y3="0.67343193"
                        yFract="0.13729751"
                        z3="6.07646536"
                        zFract="0.25041133"/>
                  <atom elementType="Pt"
                        id="a12"
                        x3="5.40659796"
                        xFract="0.63773893"
                        y3="3.1317894"
                        yFract="0.63850089"
                        z3="6.17487032"
                        zFract="0.24717659"/>
                  <atom elementType="Pt"
                        id="a13"
                        x3="2.43804954"
                        xFract="0.28735433"
                        y3="1.4144878"
                        yFract="0.28838201"
                        z3="8.244256"
                        zFract="0.3468519"/>
                  <atom elementType="Pt"
                        id="a14"
                        x3="3.78316155"
                        xFract="0.272688"
                        y3="3.90037595"
                        yFract="0.79519827"
                        z3="8.47230457"
                        zFract="0.34933852"/>
                  <atom elementType="Pt"
                        id="a15"
                        x3="5.26329136"
                        xFract="0.79403547"
                        y3="1.34332668"
                        yFract="0.27387387"
                        z3="8.47373157"
                        zFract="0.3493997"/>
                  <atom elementType="Pt"
                        id="a16"
                        x3="6.73340146"
                        xFract="0.79420279"
                        y3="3.90073994"
                        yFract="0.79527248"
                        z3="8.65045733"
                        zFract="0.34923453"/>
                  <atom elementType="O"
                        id="a17"
                        x3="3.77670847"
                        xFract="0.44525461"
                        y3="2.18993141"
                        yFract="0.44647739"
                        z3="9.58823772"
                        zFract="0.40008032"/>
                  <atom elementType="O"
                        id="a18"
                        x3="6.60274195"
                        xFract="0.94469905"
                        y3="2.19140598"
                        yFract="0.44677802"
                        z3="9.76043819"
                        zFract="0.40004573"/>
                  <atom elementType="O"
                        id="a19"
                        x3="5.18520929"
                        xFract="0.44567752"
                        y3="4.63758299"
                        yFract="0.94549808"
                        z3="9.75996851"
                        zFract="0.40002998"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a3" order="S"/>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a1 a5" order="S"/>
                  <bond atomRefs2="a2 a5" order="S"/>
                  <bond atomRefs2="a2 a4" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a2 a6" order="S"/>
                  <bond atomRefs2="a3 a5" order="S"/>
                  <bond atomRefs2="a3 a4" order="S"/>
                  <bond atomRefs2="a3 a7" order="S"/>
                  <bond atomRefs2="a4 a6" order="S"/>
                  <bond atomRefs2="a4 a7" order="S"/>
                  <bond atomRefs2="a4 a8" order="S"/>
                  <bond atomRefs2="a5 a10" order="S"/>
                  <bond atomRefs2="a5 a11" order="S"/>
                  <bond atomRefs2="a5 a7" order="S"/>
                  <bond atomRefs2="a5 a6" order="S"/>
                  <bond atomRefs2="a5 a12" order="S"/>
                  <bond atomRefs2="a6 a8" order="S"/>
                  <bond atomRefs2="a6 a7" order="S"/>
                  <bond atomRefs2="a6 a12" order="S"/>
                  <bond atomRefs2="a7 a8" order="S"/>
                  <bond atomRefs2="a7 a12" order="S"/>
                  <bond atomRefs2="a9 a10" order="S"/>
                  <bond atomRefs2="a9 a11" order="S"/>
                  <bond atomRefs2="a9 a13" order="S"/>
                  <bond atomRefs2="a10 a11" order="S"/>
                  <bond atomRefs2="a10 a12" order="S"/>
                  <bond atomRefs2="a10 a14" order="S"/>
                  <bond atomRefs2="a10 a13" order="S"/>
                  <bond atomRefs2="a11 a12" order="S"/>
                  <bond atomRefs2="a11 a15" order="S"/>
                  <bond atomRefs2="a11 a13" order="S"/>
                  <bond atomRefs2="a12 a14" order="S"/>
                  <bond atomRefs2="a12 a15" order="S"/>
                  <bond atomRefs2="a12 a16" order="S"/>
                  <bond atomRefs2="a13 a14" order="S"/>
                  <bond atomRefs2="a13 a15" order="S"/>
                  <bond atomRefs2="a13 a17" order="S"/>
                  <bond atomRefs2="a14 a17" order="S"/>
                  <bond atomRefs2="a14 a19" order="S"/>
                  <bond atomRefs2="a15 a18" order="S"/>
                  <bond atomRefs2="a15 a17" order="S"/>
                  <bond atomRefs2="a16 a18" order="S"/>
                  <bond atomRefs2="a16 a19" order="S"/>
               </bondArray>
               <formula concise="O3Pt16">
                  <atomArray count="3 16" elementType="O Pt"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">3169.2462000000005</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1S/3O.16Pt">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:17;18;19;1;2;3;4;5;6;7;8;9;10;11;12;13;14;15;16/rA:19PtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtO3OO/rB:s1;s1s2;s2s3;s1s2s3;s2s4s5;s3s4s5s6;s4s6s7;;s5s9;s5s9s10;s5s6s7s10s11;s9s10s11;s10s12s13;s11s12s13;s12;s13s14s15;s15s16;s14s16;/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">500</scalar>
               </parameter>
               <parameter dictRef="v:ediff">
                  <scalar dataType="xsd:double">0.1E-05</scalar>
               </parameter>
               <parameter dictRef="v:ediffg">
                  <scalar dataType="xsd:double">-.1E-01</scalar>
               </parameter>
               <parameter dictRef="v:ibrion">
                  <scalar dataType="xsd:integer">2</scalar>
               </parameter>
               <parameter dictRef="v:potim">
                  <scalar dataType="xsd:double">0.1000</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">178.0000</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">0.20</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">BF</scalar>
               </parameter>
               <parameter dictRef="v:lexch">
                  <scalar dataType="xsd:string">17</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="2">PAW_PBE Pt 05Jan2001|PAW_PBE O 08Apr2002</array>
                  <array dictRef="cc:atomType" size="2">Pt O</array>
                  <array dataType="xsd:double" dictRef="cc:mass" size="2">195.080 16.000</array>
                  <array dataType="xsd:double" dictRef="cc:valence" size="2">10.000 6.000</array>
                  <array dataType="xsd:integer" dictRef="cc:atomcount" size="2">16 3</array>
               </module>
               <module cmlx:templateRef="kpoints"
                       dictRef="cc:userDefinedModule"
                       id="vasp.kpoints">
                  <scalar dataType="xsd:string" dictRef="v:comment">K-Points file</scalar>
                  <scalar dataType="xsd:integer" dictRef="v:kpointnum">0</scalar>
                  <scalar dataType="xsd:string" dictRef="v:meshScheme">Gamma</scalar>
                  <array dataType="xsd:integer" dictRef="v:subdivisionN" size="3">7 7 1</array>
                  <array dataType="xsd:double" dictRef="v:shiftS" size="3">0 0 0</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="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:double" dictRef="cc:eigen" size="2900">-20.6773 -20.1717 -20.1710 -9.5755 -8.6936 -8.4281 -8.2070 -8.2043 -7.8796 -7.1417 -7.1408 -7.0213 -6.9514 -6.8998 -6.8981 -6.6628 -6.6620 -6.6254 -6.5982 -6.5974 -6.5774 -6.5002 -6.1869 -6.1864 -6.0655 -5.9362 -5.9358 -5.9208 -5.1855 -5.1852 -5.1503 -4.8175 -4.6955 -4.6951 -4.5437 -4.2869 -4.2852 -4.1694 -4.1684 -4.1479 -4.0073 -3.8864 -3.8849 -3.8568 -3.8565 -3.6844 -3.6446 -3.6425 -3.5129 -3.5117 -3.3754 -3.3748 -3.2719 -3.1755 -3.0805 -3.0791 -3.0478 -2.5978 -2.5945 -2.5553 -2.3890 -2.3846 -2.3506 -2.2444 -2.2403 -1.9209 -1.9185 -1.7725 -1.7710 -1.5166 -1.5141 -1.4618 -1.3040 -1.1072 -1.1071 -1.0222 -0.9667 -0.9434 -0.9430 -0.7606 -0.7599 -0.7279 -0.6433 -0.6407 -0.5678 -0.5671 -0.5126 -0.4920 -0.4916 -0.3717 -0.2379 -0.2363 -0.1548 -0.1517 -0.1512 0.2675 0.3917 0.7322 0.7340 1.3760 1.8362 1.9275 1.9353 2.2519 2.2525 2.2832 3.9601 4.3516 4.3545 4.6115 4.9267 5.1329 5.1339 5.2057 5.4559 5.7222 -20.6517 -20.1914 -20.1693 -9.4272 -8.5956 -8.3668 -8.1378 -8.1090 -7.7369 -7.1505 -7.1011 -6.9263 -6.8593 -6.8452 -6.8042 -6.7188 -6.6282 -6.5746 -6.5053 -6.5043 -6.4565 -6.4352 -6.1372 -6.1112 -5.9742 -5.8851 -5.8109 -5.8071 -5.2199 -5.1588 -5.1121 -4.7990 -4.7126 -4.6854 -4.5605 -4.3510 -4.3126 -4.2301 -4.1312 -4.1064 -4.0862 -3.9447 -3.9149 -3.9064 -3.7563 -3.6926 -3.6824 -3.6257 -3.5437 -3.5025 -3.4894 -3.4052 -3.3084 -3.3046 -3.2369 -3.2284 -3.2035 -2.8695 -2.7836 -2.6187 -2.5142 -2.3825 -2.3622 -2.2468 -2.2340 -1.9864 -1.9424 -1.8047 -1.7634 -1.6558 -1.6249 -1.5208 -1.4717 -1.3983 -1.2962 -1.2816 -1.1276 -1.1143 -1.0813 -1.0480 -0.9092 -0.8779 -0.8623 -0.7645 -0.7600 -0.7077 -0.6881 -0.6158 -0.5766 -0.4751 -0.4091 -0.3565 -0.2828 -0.1598 -0.1004 0.2539 0.2608 0.5803 0.8829 0.9870 1.5224 1.7432 1.9215 2.8561 3.0458 3.0928 4.2226 4.4441 4.6892 4.7436 4.9746 5.2183 5.2470 5.4177 5.7298 5.9974 -20.5834 -20.2464 -20.1654 -9.0284 -8.4135 -8.1627 -7.9034 -7.8651 -7.3931 -7.1738 -7.0751 -6.9868 -6.8724 -6.6821 -6.4977 -6.4866 -6.4485 -6.4236 -6.3052 -6.2379 -6.1564 -6.1173 -5.9809 -5.8698 -5.7958 -5.6922 -5.5708 -5.4955 -5.1884 -5.1162 -5.0930 -4.8985 -4.8077 -4.7682 -4.6770 -4.5721 -4.5565 -4.3973 -4.3251 -4.1305 -4.0623 -3.9892 -3.9678 -3.9333 -3.8676 -3.7484 -3.7379 -3.6884 -3.6080 -3.5974 -3.5796 -3.5143 -3.4705 -3.4371 -3.3654 -3.3152 -3.2567 -3.1466 -2.9551 -2.9501 -2.7882 -2.5722 -2.5363 -2.3934 -2.3346 -2.3274 -2.2267 -2.2257 -2.0963 -2.0697 -1.9837 -1.9617 -1.9304 -1.7868 -1.7216 -1.6002 -1.5815 -1.4743 -1.3912 -1.3888 -1.2759 -1.2378 -1.2071 -1.1649 -1.0048 -0.9639 -0.8982 -0.8012 -0.7383 -0.6752 -0.5652 -0.4770 -0.4333 -0.1974 -0.0546 -0.0527 0.2488 1.0026 1.1673 1.2485 1.7144 1.9109 1.9911 3.0016 3.6764 3.7798 4.0781 4.9478 4.9529 5.0745 5.4053 5.6595 5.8143 6.0647 6.3576 6.3681 -20.5028 -20.3165 -20.1623 -8.6236 -8.2128 -7.9030 -7.6363 -7.6311 -7.3207 -7.2147 -7.1952 -6.9575 -6.6918 -6.5481 -6.4278 -6.3894 -6.2160 -6.0116 -5.9605 -5.9184 -5.7997 -5.7703 -5.7550 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                  </list>
               </module>
               <module cmlx:templateRef="forces" id="forces">
                  <matrix cols="57"
                          dataType="xsd:double"
                          dictRef="cc:force"
                          rows="1"
                          units="nonsi2:ev.angstrom-1">0.004441 0.002349 0.087696 0.006069 0.018937 -0.164134 0.019105 -0.004522 -0.163963 0.033296 0.019110 -0.161827 -0.049469 -0.026259 0.063542 -0.011678 0.042076 0.062816 0.026314 -0.025159 0.063902 -0.022656 -0.008131 0.217586 0.000329 -0.001711 -0.001783 -0.000625 -0.002933 0.000582 0.001002 -0.001734 -0.002912 0.000422 -0.001133 -0.000921 0.000407 0.001267 -0.000788 -0.000936 -0.002275 0.001747 0.001573 -0.000373 0.001019 -0.000511 -0.003264 -0.002234 -0.006172 -0.006024 0.000143 -0.000500 -0.002075 -0.002538 -0.000413 0.001852 0.002068</matrix>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="v:magnetization">
                  <module cmlx:templateRef="magnetization">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="19">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19</array>
                     <array dataType="xsd:double" dictRef="v:coeffs" size="19">0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000</array>
                     <array dataType="xsd:double" dictRef="v:coeffp" size="19">-0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000</array>
                     <array dataType="xsd:double" dictRef="v:coeffd" size="19">0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 -0.000 -0.000 -0.000 -0.000 0.000 0.000 0.000</array>
                     <array dataType="xsd:double" dictRef="v:coefftotal" size="19">0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000</array>
                     <list cmlx:templateRef="totals">
                        <scalar dataType="xsd:double" dictRef="v:totalcoeffs">0.000</scalar>
                        <scalar dataType="xsd:double" dictRef="v:totalcoeffp">-0.000</scalar>
                        <scalar dataType="xsd:double" dictRef="v:totalcoeffd">0.000</scalar>
                        <scalar dataType="xsd:double" dictRef="v:coefftotalsum">0.000</scalar>
                     </list>
                  </module>
               </property>
               <property dictRef="cc:energies">
                  <module cmlx:templateRef="energies">
                     <array dataType="xsd:double"
                            dictRef="cc:freeEnergy"
                            size="1"
                            units="nonsi:electronvolt">-82.29874798</array>
                     <array dataType="xsd:double"
                            dictRef="v:noEntropyEnergy"
                            size="1"
                            units="nonsi:electronvolt">-82.24944312</array>
                     <array dataType="xsd:double"
                            dictRef="cc:e0"
                            size="1"
                            units="nonsi:electronvolt">-82.28231303</array>
                     <array dataType="xsd:double"
                            dictRef="v:efermi"
                            size="1"
                            units="nonsi:electronvolt">-0.6996</array>
                  </module>
               </property>
            </propertyList>
            <molecule id="final">
               <crystal>
                  <scalar id="sc1" title="a" units="nonsi:angstrom">5.667241101813827</scalar>
                  <scalar id="sc2" title="b" units="nonsi:angstrom">5.667240973429664</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">23.194183</scalar>
                  <scalar id="sc4" title="alpha" units="nonsi:degree">86.5</scalar>
                  <scalar id="sc5" title="beta" units="nonsi:degree">86.5</scalar>
                  <scalar id="sc6" title="gamma" units="nonsi:degree">60.0</scalar>
               </crystal>
               <atomArray>
                  <atom elementType="Pt"
                        id="a1"
                        x3="2.86416"
                        xFract="0.33797839"
                        y3="1.65775"
                        yFract="0.33797766"
                        z3="1.39371"
                        zFract="0.04999987"/>
                  <atom elementType="Pt"
                        id="a2"
                        x3="4.27303"
                        xFract="0.33797824"
                        y3="4.11021"
                        yFract="0.83797868"
                        z3="1.5668"
                        zFract="0.04999982"/>
                  <atom elementType="Pt"
                        id="a3"
                        x3="5.69249"
                        xFract="0.83797857"
                        y3="1.65775"
                        yFract="0.33797766"
                        z3="1.5668"
                        zFract="0.04999983"/>
                  <atom elementType="Pt"
                        id="a4"
                        x3="7.10136"
                        xFract="0.83797842"
                        y3="4.11021"
                        yFract="0.83797868"
                        z3="1.73989"
                        zFract="0.04999977"/>
                  <atom elementType="Pt"
                        id="a5"
                        x3="4.13531"
                        xFract="0.48797744"
                        y3="2.39348"
                        yFract="0.48797633"
                        z3="3.81699"
                        zFract="0.15000021"/>
                  <atom elementType="Pt"
                        id="a6"
                        x3="5.54418"
                        xFract="0.48797729"
                        y3="4.84594"
                        yFract="0.98797735"
                        z3="3.99008"
                        zFract="0.15000016"/>
                  <atom elementType="Pt"
                        id="a7"
                        x3="6.96364"
                        xFract="0.98797762"
                        y3="2.39348"
                        yFract="0.48797633"
                        z3="3.99008"
                        zFract="0.15000017"/>
                  <atom elementType="Pt"
                        id="a8"
                        x3="8.37251"
                        xFract="0.98797747"
                        y3="4.84594"
                        yFract="0.98797735"
                        z3="4.16317"
                        zFract="0.15000011"/>
                  <atom elementType="Pt"
                        id="a9"
                        x3="1.15789"
                        xFract="0.13630972"
                        y3="0.67337"
                        yFract="0.13728488"
                        z3="5.90176"
                        zFract="0.2503665"/>
                  <atom elementType="Pt"
                        id="a10"
                        x3="2.57257"
                        xFract="0.13649882"
                        y3="3.13408"
                        yFract="0.63896789"
                        z3="6.07578"
                        zFract="0.25037861"/>
                  <atom elementType="Pt"
                        id="a11"
                        x3="3.99557"
                        xFract="0.63795672"
                        y3="0.67343"
                        yFract="0.13729712"
                        z3="6.07647"
                        zFract="0.25041154"/>
                  <atom elementType="Pt"
                        id="a12"
                        x3="5.4066"
                        xFract="0.63773923"
                        y3="3.13179"
                        yFract="0.63850101"
                        z3="6.17487"
                        zFract="0.24717657"/>
                  <atom elementType="Pt"
                        id="a13"
                        x3="2.43805"
                        xFract="0.28735419"
                        y3="1.41449"
                        yFract="0.28838246"
                        z3="8.24426"
                        zFract="0.34685207"/>
                  <atom elementType="Pt"
                        id="a14"
                        x3="3.78316"
                        xFract="0.27268731"
                        y3="3.90038"
                        yFract="0.7951991"
                        z3="8.4723"
                        zFract="0.34933832"/>
                  <atom elementType="Pt"
                        id="a15"
                        x3="5.26329"
                        xFract="0.79403489"
                        y3="1.34333"
                        yFract="0.27387455"
                        z3="8.47373"
                        zFract="0.34939963"/>
                  <atom elementType="Pt"
                        id="a16"
                        x3="6.7334"
                        xFract="0.79420253"
                        y3="3.90074"
                        yFract="0.79527249"
                        z3="8.65046"
                        zFract="0.34923465"/>
                  <atom elementType="O"
                        id="a17"
                        x3="3.77671"
                        xFract="0.44525502"
                        y3="2.18993"
                        yFract="0.4464771"
                        z3="9.58824"
                        zFract="0.40008042"/>
                  <atom elementType="O"
                        id="a18"
                        x3="6.60274"
                        xFract="0.9446983"
                        y3="2.19141"
                        yFract="0.44677884"
                        z3="9.76044"
                        zFract="0.40004581"/>
                  <atom elementType="O"
                        id="a19"
                        x3="5.18521"
                        xFract="0.44567795"
                        y3="4.63758"
                        yFract="0.94549747"
                        z3="9.75997"
                        zFract="0.40003005"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a1 a3" order="S"/>
                  <bond atomRefs2="a1 a5" order="S"/>
                  <bond atomRefs2="a2 a5" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a2 a4" order="S"/>
                  <bond atomRefs2="a2 a6" order="S"/>
                  <bond atomRefs2="a3 a5" order="S"/>
                  <bond atomRefs2="a3 a4" order="S"/>
                  <bond atomRefs2="a3 a7" order="S"/>
                  <bond atomRefs2="a4 a7" order="S"/>
                  <bond atomRefs2="a4 a6" order="S"/>
                  <bond atomRefs2="a4 a8" order="S"/>
                  <bond atomRefs2="a5 a10" order="S"/>
                  <bond atomRefs2="a5 a11" order="S"/>
                  <bond atomRefs2="a5 a6" order="S"/>
                  <bond atomRefs2="a5 a7" order="S"/>
                  <bond atomRefs2="a5 a12" order="S"/>
                  <bond atomRefs2="a6 a7" order="S"/>
                  <bond atomRefs2="a6 a8" order="S"/>
                  <bond atomRefs2="a6 a12" order="S"/>
                  <bond atomRefs2="a7 a8" order="S"/>
                  <bond atomRefs2="a7 a12" order="S"/>
                  <bond atomRefs2="a9 a10" order="S"/>
                  <bond atomRefs2="a9 a11" order="S"/>
                  <bond atomRefs2="a9 a13" order="S"/>
                  <bond atomRefs2="a10 a11" order="S"/>
                  <bond atomRefs2="a10 a12" order="S"/>
                  <bond atomRefs2="a10 a14" order="S"/>
                  <bond atomRefs2="a10 a13" order="S"/>
                  <bond atomRefs2="a11 a12" order="S"/>
                  <bond atomRefs2="a11 a15" order="S"/>
                  <bond atomRefs2="a11 a13" order="S"/>
                  <bond atomRefs2="a12 a14" order="S"/>
                  <bond atomRefs2="a12 a15" order="S"/>
                  <bond atomRefs2="a12 a16" order="S"/>
                  <bond atomRefs2="a13 a14" order="S"/>
                  <bond atomRefs2="a13 a15" order="S"/>
                  <bond atomRefs2="a13 a17" order="S"/>
                  <bond atomRefs2="a14 a17" order="S"/>
                  <bond atomRefs2="a14 a19" order="S"/>
                  <bond atomRefs2="a15 a18" order="S"/>
                  <bond atomRefs2="a15 a17" order="S"/>
                  <bond atomRefs2="a16 a18" order="S"/>
                  <bond atomRefs2="a16 a19" order="S"/>
               </bondArray>
               <formula concise="O3Pt16">
                  <atomArray count="3 16" elementType="O Pt"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">3169.2462000000005</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1S/3O.16Pt">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:17;18;19;1;2;3;4;5;6;7;8;9;10;11;12;13;14;15;16/rA:19PtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtO3OO/rB:s1;s1s2;s2s3;s1s2s3;s2s4s5;s3s4s5s6;s4s6s7;;s5s9;s5s9s10;s5s6s7s10s11;s9s10s11;s10s12s13;s11s12s13;s12;s13s14s15;s15s16;s14s16;/rC:;;;;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
         </module>
      </module>
   </module>
</module>
