<?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 May 11 2017 09:47:33) complex</scalar>
               </parameter>
               <parameter dictRef="v:platform">
                  <scalar dataType="xsd:string">tekla2IFC</scalar>
               </parameter>
               <parameter dictRef="cc:rundate">
                  <scalar dataType="xsd:date">2020-09-07T16:15:17.000+02:00</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <molecule id="initial">
               <crystal>
                  <scalar id="sc1" title="a" units="nonsi:angstrom">9.511124611</scalar>
                  <scalar id="sc2" title="b" units="nonsi:angstrom">3.882900238</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">29.573452</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>
               <atomArray>
                  <atom elementType="Ce"
                        id="a1"
                        x3="0.80259102"
                        xFract="0.08438445"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="1.12268986"
                        zFract="0.03796276"/>
                  <atom elementType="Ce"
                        id="a2"
                        x3="3.97296262"
                        xFract="0.41771744"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="2.24359615"
                        zFract="0.07586521"/>
                  <atom elementType="Ce"
                        id="a3"
                        x3="7.14334364"
                        xFract="0.75105142"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="3.36447493"
                        zFract="0.11376673"/>
                  <atom elementType="Ce"
                        id="a4"
                        x3="0.80259102"
                        xFract="0.08438445"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="4.48538003"
                        zFract="0.15166914"/>
                  <atom elementType="Ce"
                        id="a5"
                        x3="3.97296262"
                        xFract="0.41771744"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="5.60628602"
                        zFract="0.18957158"/>
                  <atom elementType="Ce"
                        id="a6"
                        x3="7.14334364"
                        xFract="0.75105142"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="6.7271651"
                        zFract="0.22747311"/>
                  <atom elementType="Ce"
                        id="a7"
                        x3="0.80259102"
                        xFract="0.08438445"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="7.84807109"
                        zFract="0.26537555"/>
                  <atom elementType="Ce"
                        id="a8"
                        x3="3.97296262"
                        xFract="0.41771744"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="8.96897708"
                        zFract="0.30327799"/>
                  <atom elementType="Ce"
                        id="a9"
                        x3="7.14334364"
                        xFract="0.75105142"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="10.08985498"
                        zFract="0.34117948"/>
                  <atom elementType="Ce"
                        id="a10"
                        x3="0.80259102"
                        xFract="0.08438445"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="11.21076097"
                        zFract="0.37908192"/>
                  <atom elementType="Ce"
                        id="a11"
                        x3="3.97296262"
                        xFract="0.41771744"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="12.33166607"
                        zFract="0.41698433"/>
                  <atom elementType="Ce"
                        id="a12"
                        x3="7.14334364"
                        xFract="0.75105142"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="13.45254603"
                        zFract="0.45488589"/>
                  <atom elementType="O"
                        id="a13"
                        x3="0.0100"
                        xFract="0.0010514"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="0.00178505"
                        zFract="0.00006036"/>
                  <atom elementType="O"
                        id="a14"
                        x3="3.1803716"
                        xFract="0.33438439"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="1.12268986"
                        zFract="0.03796276"/>
                  <atom elementType="O"
                        id="a15"
                        x3="1.59518157"
                        xFract="0.16771745"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="2.24359615"
                        zFract="0.07586521"/>
                  <atom elementType="O"
                        id="a16"
                        x3="6.35074359"
                        xFract="0.66771742"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="2.24359615"
                        zFract="0.07586521"/>
                  <atom elementType="O"
                        id="a17"
                        x3="4.76556259"
                        xFract="0.50105143"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="3.36447493"
                        zFract="0.11376673"/>
                  <atom elementType="O"
                        id="a18"
                        x3="0.0100"
                        xFract="0.0010514"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="3.36447493"
                        zFract="0.11376673"/>
                  <atom elementType="O"
                        id="a19"
                        x3="3.1803716"
                        xFract="0.33438439"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="4.48538003"
                        zFract="0.15166914"/>
                  <atom elementType="O"
                        id="a20"
                        x3="7.93593457"
                        xFract="0.83438446"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="4.48538003"
                        zFract="0.15166914"/>
                  <atom elementType="O"
                        id="a21"
                        x3="1.59518157"
                        xFract="0.16771745"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="5.60628602"
                        zFract="0.18957158"/>
                  <atom elementType="O"
                        id="a22"
                        x3="6.35074359"
                        xFract="0.66771742"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="5.60628602"
                        zFract="0.18957158"/>
                  <atom elementType="O"
                        id="a23"
                        x3="4.76556259"
                        xFract="0.50105143"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="6.7271651"
                        zFract="0.22747311"/>
                  <atom elementType="O"
                        id="a24"
                        x3="0.0100"
                        xFract="0.0010514"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="6.7271651"
                        zFract="0.22747311"/>
                  <atom elementType="O"
                        id="a25"
                        x3="3.1803716"
                        xFract="0.33438439"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="7.84807109"
                        zFract="0.26537555"/>
                  <atom elementType="O"
                        id="a26"
                        x3="7.93593457"
                        xFract="0.83438446"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="7.84807109"
                        zFract="0.26537555"/>
                  <atom elementType="O"
                        id="a27"
                        x3="1.59518157"
                        xFract="0.16771745"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="8.96897708"
                        zFract="0.30327799"/>
                  <atom elementType="O"
                        id="a28"
                        x3="6.35074359"
                        xFract="0.66771742"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="8.96897708"
                        zFract="0.30327799"/>
                  <atom elementType="O"
                        id="a29"
                        x3="4.76556259"
                        xFract="0.50105143"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="10.08985498"
                        zFract="0.34117948"/>
                  <atom elementType="O"
                        id="a30"
                        x3="0.0100"
                        xFract="0.0010514"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="10.08985498"
                        zFract="0.34117948"/>
                  <atom elementType="O"
                        id="a31"
                        x3="3.1803716"
                        xFract="0.33438439"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="11.21076097"
                        zFract="0.37908192"/>
                  <atom elementType="O"
                        id="a32"
                        x3="7.93593457"
                        xFract="0.83438446"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="11.21076097"
                        zFract="0.37908192"/>
                  <atom elementType="O"
                        id="a33"
                        x3="1.59518157"
                        xFract="0.16771745"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="12.33166607"
                        zFract="0.41698433"/>
                  <atom elementType="O"
                        id="a34"
                        x3="6.35074359"
                        xFract="0.66771742"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="12.33166607"
                        zFract="0.41698433"/>
                  <atom elementType="O"
                        id="a35"
                        x3="4.76556259"
                        xFract="0.50105143"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="13.45254603"
                        zFract="0.45488589"/>
                  <atom elementType="O"
                        id="a36"
                        x3="7.93593457"
                        xFract="0.83438446"
                        y3="1.94145"
                        yFract="0.49999997"
                        z3="14.57345202"
                        zFract="0.49278833"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a1 a4" order="S"/>
                  <bond atomRefs2="a1 a15" order="S"/>
                  <bond atomRefs2="a1 a13" order="S"/>
                  <bond atomRefs2="a1 a14" order="S"/>
                  <bond atomRefs2="a1 a18" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a2 a5" order="S"/>
                  <bond atomRefs2="a2 a4" order="S"/>
                  <bond atomRefs2="a2 a14" order="S"/>
                  <bond atomRefs2="a2 a15" order="S"/>
                  <bond atomRefs2="a2 a16" order="S"/>
                  <bond atomRefs2="a2 a17" order="S"/>
                  <bond atomRefs2="a2 a19" order="S"/>
                  <bond atomRefs2="a3 a5" order="S"/>
                  <bond atomRefs2="a3 a6" order="S"/>
                  <bond atomRefs2="a3 a22" order="S"/>
                  <bond atomRefs2="a3 a20" order="S"/>
                  <bond atomRefs2="a3 a17" order="S"/>
                  <bond atomRefs2="a3 a16" order="S"/>
                  <bond atomRefs2="a4 a7" order="S"/>
                  <bond atomRefs2="a4 a5" order="S"/>
                  <bond atomRefs2="a4 a21" order="S"/>
                  <bond atomRefs2="a4 a18" order="S"/>
                  <bond atomRefs2="a4 a19" order="S"/>
                  <bond atomRefs2="a4 a24" order="S"/>
                  <bond atomRefs2="a4 a15" order="S"/>
                  <bond atomRefs2="a5 a8" order="S"/>
                  <bond atomRefs2="a5 a6" order="S"/>
                  <bond atomRefs2="a5 a7" order="S"/>
                  <bond atomRefs2="a5 a17" order="S"/>
                  <bond atomRefs2="a5 a19" order="S"/>
                  <bond atomRefs2="a5 a21" order="S"/>
                  <bond atomRefs2="a5 a22" order="S"/>
                  <bond atomRefs2="a5 a23" order="S"/>
                  <bond atomRefs2="a5 a25" order="S"/>
                  <bond atomRefs2="a6 a8" order="S"/>
                  <bond atomRefs2="a6 a9" order="S"/>
                  <bond atomRefs2="a6 a28" order="S"/>
                  <bond atomRefs2="a6 a26" order="S"/>
                  <bond atomRefs2="a6 a23" order="S"/>
                  <bond atomRefs2="a6 a22" order="S"/>
                  <bond atomRefs2="a6 a20" order="S"/>
                  <bond atomRefs2="a7 a8" order="S"/>
                  <bond atomRefs2="a7 a10" order="S"/>
                  <bond atomRefs2="a7 a24" order="S"/>
                  <bond atomRefs2="a7 a27" order="S"/>
                  <bond atomRefs2="a7 a25" order="S"/>
                  <bond atomRefs2="a7 a21" order="S"/>
                  <bond atomRefs2="a7 a30" order="S"/>
                  <bond atomRefs2="a8 a9" order="S"/>
                  <bond atomRefs2="a8 a11" order="S"/>
                  <bond atomRefs2="a8 a10" order="S"/>
                  <bond atomRefs2="a8 a23" order="S"/>
                  <bond atomRefs2="a8 a25" order="S"/>
                  <bond atomRefs2="a8 a27" order="S"/>
                  <bond atomRefs2="a8 a28" order="S"/>
                  <bond atomRefs2="a8 a29" order="S"/>
                  <bond atomRefs2="a8 a31" order="S"/>
                  <bond atomRefs2="a9 a11" order="S"/>
                  <bond atomRefs2="a9 a12" order="S"/>
                  <bond atomRefs2="a9 a34" order="S"/>
                  <bond atomRefs2="a9 a32" order="S"/>
                  <bond atomRefs2="a9 a29" order="S"/>
                  <bond atomRefs2="a9 a28" order="S"/>
                  <bond atomRefs2="a9 a26" order="S"/>
                  <bond atomRefs2="a10 a11" order="S"/>
                  <bond atomRefs2="a10 a30" order="S"/>
                  <bond atomRefs2="a10 a33" order="S"/>
                  <bond atomRefs2="a10 a31" order="S"/>
                  <bond atomRefs2="a10 a27" order="S"/>
                  <bond atomRefs2="a11 a12" order="S"/>
                  <bond atomRefs2="a11 a29" order="S"/>
                  <bond atomRefs2="a11 a31" order="S"/>
                  <bond atomRefs2="a11 a33" order="S"/>
                  <bond atomRefs2="a11 a34" order="S"/>
                  <bond atomRefs2="a11 a35" order="S"/>
                  <bond atomRefs2="a12 a36" order="S"/>
                  <bond atomRefs2="a12 a35" order="S"/>
                  <bond atomRefs2="a12 a34" order="S"/>
                  <bond atomRefs2="a12 a32" order="S"/>
               </bondArray>
               <formula concise="Ce12O24">
                  <atomArray count="12 24" elementType="Ce O"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">2065.3775999999984</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1S/12Ce.24O">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N: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/rA:36CeCeCeCeCeCeCeCeCeCeCeCeO1OO3OO3OO3OO3O3O3OO3OO3O3O3OO3OOO3OO1/rB:s1;s2;s1s2;s2s3s4;s3s5;s4s5;s5s6s7;s6s8;s7s8;s8s9s10;s9s11;s1;s1s2;s1s2s4;s2s3;s2s3s5;s1s4;s2s4s5;s3s6;s4s5s7;s3s5s6;s5s6s8;s4s7;s5s7s8;s6s9;s7s8s10;s6s8s9;s8s9s11;s7s10;s8s10s11;s9s12;s10s11;s9s11s12;s11s12;s12;/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-06</scalar>
               </parameter>
               <parameter dictRef="v:ediffg">
                  <scalar dataType="xsd:double">0.1E-05</scalar>
               </parameter>
               <parameter dictRef="v:ibrion">
                  <scalar dataType="xsd:integer">-1</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">288.0000</scalar>
               </parameter>
               <parameter dictRef="v:nupdown">
                  <scalar dataType="xsd:double">-1.0000</scalar>
               </parameter>
               <parameter dictRef="v:ismear">
                  <scalar dataType="xsd:integer">0</scalar>
               </parameter>
               <parameter dictRef="v:sigma">
                  <scalar dataType="xsd:double">0.05</scalar>
               </parameter>
               <parameter dictRef="v:ldipol">
                  <scalar dataType="xsd:string">T</scalar>
               </parameter>
               <parameter dictRef="v:idipol">
                  <scalar dataType="xsd:integer">3</scalar>
               </parameter>
               <parameter dictRef="v:ldau">
                  <scalar>true</scalar>
               </parameter>
               <parameter dictRef="v:ldautype">
                  <scalar dataType="xsd:integer">2</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>
               <parameter dictRef="v:ldaul">
                  <array dataType="xsd:integer" size="2">3 -1</array>
               </parameter>
               <parameter dictRef="v:ldauu">
                  <array dataType="xsd:double" size="2">5.5 0.0</array>
               </parameter>
               <parameter dictRef="v:ldauj">
                  <array dataType="xsd:double" size="2">1.0 0.0</array>
               </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 Ce 23Dec2003|PAW_PBE O 08Apr2002</array>
                  <array dictRef="cc:atomType" size="2">Ce O</array>
                  <array dataType="xsd:double" dictRef="cc:mass" size="2">140.115 16.000</array>
                  <array dataType="xsd:double" dictRef="cc:valence" size="2">12.000 6.000</array>
                  <array dataType="xsd:integer" dictRef="cc:atomcount" size="2">12 24</array>
               </module>
               <module cmlx:templateRef="lattice" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="cc:lattice" size="3">9.511124611 0.000000000 0.000000000</array>
                  <array dataType="xsd:double" dictRef="cc:lattice" size="3">0.000000000 3.882900238 0.000000000</array>
                  <array dataType="xsd:double" dictRef="cc:lattice" size="3">0.000000000 0.000000000 29.573452000</array>
               </module>
               <module cmlx:templateRef="kpoints"
                       dictRef="cc:userDefinedModule"
                       id="vasp.kpoints">
                  <scalar dataType="xsd:string" dictRef="v:meshScheme">Gamma</scalar>
                  <array dataType="xsd:integer" dictRef="v:subdivisionN" size="3">5 9 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">
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                  <bond atomRefs2="a3 a16" order="S"/>
                  <bond atomRefs2="a4 a5" order="S"/>
                  <bond atomRefs2="a4 a7" order="S"/>
                  <bond atomRefs2="a4 a18" order="S"/>
                  <bond atomRefs2="a4 a21" order="S"/>
                  <bond atomRefs2="a4 a19" order="S"/>
                  <bond atomRefs2="a4 a15" order="S"/>
                  <bond atomRefs2="a4 a24" order="S"/>
                  <bond atomRefs2="a5 a8" order="S"/>
                  <bond atomRefs2="a5 a6" order="S"/>
                  <bond atomRefs2="a5 a7" order="S"/>
                  <bond atomRefs2="a5 a17" order="S"/>
                  <bond atomRefs2="a5 a19" order="S"/>
                  <bond atomRefs2="a5 a21" order="S"/>
                  <bond atomRefs2="a5 a22" order="S"/>
                  <bond atomRefs2="a5 a23" order="S"/>
                  <bond atomRefs2="a5 a25" order="S"/>
                  <bond atomRefs2="a6 a8" order="S"/>
                  <bond atomRefs2="a6 a9" order="S"/>
                  <bond atomRefs2="a6 a28" order="S"/>
                  <bond atomRefs2="a6 a26" order="S"/>
                  <bond atomRefs2="a6 a23" order="S"/>
                  <bond atomRefs2="a6 a22" order="S"/>
                  <bond atomRefs2="a6 a20" order="S"/>
                  <bond atomRefs2="a7 a8" order="S"/>
                  <bond atomRefs2="a7 a10" order="S"/>
                  <bond atomRefs2="a7 a24" order="S"/>
                  <bond atomRefs2="a7 a27" order="S"/>
                  <bond atomRefs2="a7 a25" order="S"/>
                  <bond atomRefs2="a7 a30" order="S"/>
                  <bond atomRefs2="a7 a21" order="S"/>
                  <bond atomRefs2="a8 a11" order="S"/>
                  <bond atomRefs2="a8 a9" order="S"/>
                  <bond atomRefs2="a8 a10" order="S"/>
                  <bond atomRefs2="a8 a23" order="S"/>
                  <bond atomRefs2="a8 a25" order="S"/>
                  <bond atomRefs2="a8 a27" order="S"/>
                  <bond atomRefs2="a8 a28" order="S"/>
                  <bond atomRefs2="a8 a29" order="S"/>
                  <bond atomRefs2="a8 a31" order="S"/>
                  <bond atomRefs2="a9 a11" order="S"/>
                  <bond atomRefs2="a9 a12" order="S"/>
                  <bond atomRefs2="a9 a34" order="S"/>
                  <bond atomRefs2="a9 a32" order="S"/>
                  <bond atomRefs2="a9 a29" order="S"/>
                  <bond atomRefs2="a9 a26" order="S"/>
                  <bond atomRefs2="a9 a28" order="S"/>
                  <bond atomRefs2="a10 a11" order="S"/>
                  <bond atomRefs2="a10 a33" order="S"/>
                  <bond atomRefs2="a10 a30" order="S"/>
                  <bond atomRefs2="a10 a31" order="S"/>
                  <bond atomRefs2="a10 a27" order="S"/>
                  <bond atomRefs2="a11 a12" order="S"/>
                  <bond atomRefs2="a11 a29" order="S"/>
                  <bond atomRefs2="a11 a31" order="S"/>
                  <bond atomRefs2="a11 a34" order="S"/>
                  <bond atomRefs2="a11 a33" order="S"/>
                  <bond atomRefs2="a11 a35" order="S"/>
                  <bond atomRefs2="a12 a36" order="S"/>
                  <bond atomRefs2="a12 a35" order="S"/>
                  <bond atomRefs2="a12 a32" order="S"/>
                  <bond atomRefs2="a12 a34" order="S"/>
               </bondArray>
               <formula concise="Ce12O24">
                  <atomArray count="12 24" elementType="Ce O"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">2065.3775999999984</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1S/12Ce.24O">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N: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/rA:36CeCeCeCeCeCeCeCeCeCeCeCeO1OO3OO3OO3OO3O3O3OO3OO3O3O3OO3OOO3OO1/rB:s1;s2;s1s2;s2s3s4;s3s5;s4s5;s5s6s7;s6s8;s7s8;s8s9s10;s9s11;s1;s1s2;s1s2s4;s2s3;s2s3s5;s1s4;s2s4s5;s3s6;s4s5s7;s3s5s6;s5s6s8;s4s7;s5s7s8;s6s9;s7s8s10;s6s8s9;s8s9s11;s7s10;s8s10s11;s9s12;s10s11;s9s11s12;s11s12;s12;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
         </module>
      </module>
   </module>
</module>
