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        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/"
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        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">
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               </parameter>
               <parameter dictRef="cc:programVersion">
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                  <bond atomRefs2="a32 a104" order="S"/>
                  <bond atomRefs2="a32 a92" order="S"/>
                  <bond atomRefs2="a33 a101" order="S"/>
                  <bond atomRefs2="a33 a109" order="S"/>
                  <bond atomRefs2="a33 a37" order="S"/>
                  <bond atomRefs2="a33 a110" order="S"/>
                  <bond atomRefs2="a34 a111" order="S"/>
                  <bond atomRefs2="a34 a105" order="S"/>
                  <bond atomRefs2="a34 a107" order="S"/>
                  <bond atomRefs2="a35 a102" order="S"/>
                  <bond atomRefs2="a35 a111" order="S"/>
                  <bond atomRefs2="a35 a112" order="S"/>
                  <bond atomRefs2="a36 a108" order="S"/>
                  <bond atomRefs2="a36 a109" order="S"/>
                  <bond atomRefs2="a36 a106" order="S"/>
                  <bond atomRefs2="a36 a112" order="S"/>
                  <bond atomRefs2="a37 a109" order="S"/>
                  <bond atomRefs2="a37 a110" order="S"/>
                  <bond atomRefs2="a37 a103" order="S"/>
                  <bond atomRefs2="a37 a116" order="S"/>
                  <bond atomRefs2="a37 a113" order="S"/>
                  <bond atomRefs2="a38 a114" order="S"/>
                  <bond atomRefs2="a38 a107" order="S"/>
                  <bond atomRefs2="a39 a104" order="S"/>
                  <bond atomRefs2="a39 a115" order="S"/>
                  <bond atomRefs2="a39 a114" order="S"/>
                  <bond atomRefs2="a39 a111" order="S"/>
                  <bond atomRefs2="a39 a112" order="S"/>
                  <bond atomRefs2="a40 a108" order="S"/>
                  <bond atomRefs2="a40 a115" order="S"/>
                  <bond atomRefs2="a40 a116" order="S"/>
                  <bond atomRefs2="a116 a117" order="S"/>
               </bondArray>
               <formula concise="HO76Ru40">
                  <atomArray count="1 76 40" elementType="H O Ru"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">5258.754399999981</scalar>
               </property>
            </molecule>
         </module>
      </module>
   </module>
</module>
