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                  <bond atomRefs2="a245 a377" order="S"/>
                  <bond atomRefs2="a246 a392" order="S"/>
                  <bond atomRefs2="a246 a383" order="S"/>
                  <bond atomRefs2="a246 a371" order="S"/>
                  <bond atomRefs2="a247 a380" order="S"/>
                  <bond atomRefs2="a247 a397" order="S"/>
                  <bond atomRefs2="a247 a390" order="S"/>
                  <bond atomRefs2="a248 a395" order="S"/>
                  <bond atomRefs2="a248 a401" order="S"/>
                  <bond atomRefs2="a248 a386" order="S"/>
                  <bond atomRefs2="a249 a404" order="S"/>
                  <bond atomRefs2="a249 a398" order="S"/>
                  <bond atomRefs2="a249 a389" order="S"/>
                  <bond atomRefs2="a250 a407" order="S"/>
                  <bond atomRefs2="a250 a396" order="S"/>
                  <bond atomRefs2="a250 a399" order="S"/>
                  <bond atomRefs2="a251 a403" order="S"/>
                  <bond atomRefs2="a251 a393" order="S"/>
                  <bond atomRefs2="a251 a406" order="S"/>
                  <bond atomRefs2="a252 a405" order="S"/>
                  <bond atomRefs2="a252 a409" order="S"/>
                  <bond atomRefs2="a252 a400" order="S"/>
                  <bond atomRefs2="a253 a408" order="S"/>
                  <bond atomRefs2="a253 a410" order="S"/>
                  <bond atomRefs2="a253 a402" order="S"/>
                  <bond atomRefs2="a254 a415" order="S"/>
                  <bond atomRefs2="a254 a412" order="S"/>
                  <bond atomRefs2="a254 a411" order="S"/>
                  <bond atomRefs2="a255 a414" order="S"/>
                  <bond atomRefs2="a255 a417" order="S"/>
                  <bond atomRefs2="a255 a418" order="S"/>
                  <bond atomRefs2="a256 a422" order="S"/>
                  <bond atomRefs2="a256 a416" order="S"/>
                  <bond atomRefs2="a256 a413" order="S"/>
                  <bond atomRefs2="a257 a423" order="S"/>
                  <bond atomRefs2="a257 a424" order="S"/>
                  <bond atomRefs2="a257 a419" order="S"/>
                  <bond atomRefs2="a258 a421" order="S"/>
                  <bond atomRefs2="a258 a425" order="S"/>
                  <bond atomRefs2="a258 a420" order="S"/>
                  <bond atomRefs2="a259 a432" order="S"/>
                  <bond atomRefs2="a259 a430" order="S"/>
                  <bond atomRefs2="a259 a426" order="S"/>
                  <bond atomRefs2="a260 a428" order="S"/>
                  <bond atomRefs2="a260 a427" order="S"/>
                  <bond atomRefs2="a260 a431" order="S"/>
                  <bond atomRefs2="a435 a436" order="S"/>
               </bondArray>
               <formula concise="C59H174Au144OS58">
                  <atomArray count="59 174 144 1 58" elementType="C H Au O S"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">30947.58389999989</scalar>
               </property>
            </molecule>
            <parameterList>
               <parameter dictRef="v:nwrite">
                  <scalar dataType="xsd:integer">0</scalar>
               </parameter>
               <parameter dictRef="v:ispin">
                  <scalar dataType="xsd:integer">2</scalar>
               </parameter>
               <parameter dictRef="v:energyCutoff">
                  <scalar dataType="xsd:integer" units="nonsi:electronvolt">450</scalar>
               </parameter>
               <parameter dictRef="v:ediff">
                  <scalar dataType="xsd:double">0.1E-03</scalar>
               </parameter>
               <parameter dictRef="v:ediffg">
                  <scalar dataType="xsd:double">-.3E-01</scalar>
               </parameter>
               <parameter dictRef="v:ibrion">
                  <scalar dataType="xsd:integer">2</scalar>
               </parameter>
               <parameter dictRef="v:potim">
                  <scalar dataType="xsd:double">0.1500</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">2348.0000</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">0.03</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>
               <parameter dictRef="v:vdwversion">
                  <scalar dataType="xsd:integer">2</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="6">PAW_PBE Au 04Oct2007|PAW_PBE S 06Sep2000|PAW_PBE C 08Apr2002|PAW_PBE H 15Jun2001|PAW_PBE C 08Apr2002|PAW_PBE O 08Apr2002</array>
                  <array dictRef="cc:atomType" size="6">Au S C H C O</array>
                  <array dataType="xsd:double" dictRef="cc:mass" size="6">196.97 32.07 12.01 1.00 12.01 16.00</array>
                  <array dataType="xsd:double" dictRef="cc:valence" size="6">11.00 6.00 4.00 1.00 4.00 6.00</array>
                  <array dataType="xsd:integer" dictRef="cc:atomcount" size="6">144 58 58 174 1 1</array>
               </module>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation"/>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList/>
            <molecule id="final">
               <crystal>
                  <scalar id="sc1" title="a" units="nonsi:angstrom">30.0</scalar>
                  <scalar id="sc2" title="b" units="nonsi:angstrom">30.0</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">30.0</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="Au"
                        id="a1"
                        x3="15.80931619"
                        xFract="0.52697721"
                        y3="13.60696745"
                        yFract="0.45356558"
                        z3="12.85089266"
                        zFract="0.42836309"/>
                  <atom elementType="Au"
                        id="a2"
                        x3="15.7956534"
                        xFract="0.52652178"
                        y3="16.44848895"
                        yFract="0.54828297"
                        z3="12.84893016"
                        zFract="0.42829767"/>
                  <atom elementType="Au"
                        id="a3"
                        x3="13.3726409"
                        xFract="0.4457547"
                        y3="15.00476305"
                        yFract="0.50015877"
                        z3="12.83126542"
                        zFract="0.42770885"/>
                  <atom elementType="Au"
                        id="a4"
                        x3="16.62489981"
                        xFract="0.55416333"
                        y3="15.06115645"
                        yFract="0.50203855"
                        z3="17.08873141"
                        zFract="0.56962438"/>
                  <atom elementType="Au"
                        id="a5"
                        x3="14.16683973"
                        xFract="0.47222799"
                        y3="13.65798357"
                        yFract="0.45526612"
                        z3="17.0982817"
                        zFract="0.56994272"/>
                  <atom elementType="Au"
                        id="a6"
                        x3="14.12981896"
                        xFract="0.47099397"
                        y3="16.46582591"
                        yFract="0.54886086"
                        z3="17.0541275"
                        zFract="0.56847092"/>
                  <atom elementType="Au"
                        id="a7"
                        x3="13.68961085"
                        xFract="0.45632036"
                        y3="12.72929856"
                        yFract="0.42430995"
                        z3="14.49911871"
                        zFract="0.48330396"/>
                  <atom elementType="Au"
                        id="a8"
                        x3="17.62330565"
                        xFract="0.58744352"
                        y3="15.02202042"
                        yFract="0.50073401"
                        z3="14.46253945"
                        zFract="0.48208465"/>
                  <atom elementType="Au"
                        id="a9"
                        x3="13.64305298"
                        xFract="0.45476843"
                        y3="17.31471181"
                        yFract="0.57715706"
                        z3="14.44502621"
                        zFract="0.48150087"/>
                  <atom elementType="Au"
                        id="a10"
                        x3="16.30149859"
                        xFract="0.54338329"
                        y3="17.33353665"
                        yFract="0.57778455"
                        z3="15.46583007"
                        zFract="0.51552767"/>
                  <atom elementType="Au"
                        id="a11"
                        x3="16.33457545"
                        xFract="0.54448585"
                        y3="12.74695426"
                        yFract="0.42489848"
                        z3="15.50652766"
                        zFract="0.51688426"/>
                  <atom elementType="Au"
                        id="a12"
                        x3="12.32832309"
                        xFract="0.4109441"
                        y3="15.01223262"
                        yFract="0.50040775"
                        z3="15.45345708"
                        zFract="0.51511524"/>
                  <atom elementType="Au"
                        id="a13"
                        x3="11.92594893"
                        xFract="0.39753163"
                        y3="12.56906066"
                        yFract="0.41896869"
                        z3="12.21820393"
                        zFract="0.40727346"/>
                  <atom elementType="Au"
                        id="a14"
                        x3="18.62902715"
                        xFract="0.62096757"
                        y3="13.52153774"
                        yFract="0.45071792"
                        z3="12.18982104"
                        zFract="0.40632737"/>
                  <atom elementType="Au"
                        id="a15"
                        x3="14.4088252"
                        xFract="0.48029417"
                        y3="18.93908144"
                        yFract="0.63130271"
                        z3="12.19329723"
                        zFract="0.40644324"/>
                  <atom elementType="Au"
                        id="a16"
                        x3="15.48011507"
                        xFract="0.51600384"
                        y3="19.01319759"
                        yFract="0.63377325"
                        z3="17.6609035"
                        zFract="0.58869678"/>
                  <atom elementType="Au"
                        id="a17"
                        x3="18.12650296"
                        xFract="0.60421677"
                        y3="12.58486215"
                        yFract="0.4194954"
                        z3="17.8261212"
                        zFract="0.59420404"/>
                  <atom elementType="Au"
                        id="a18"
                        x3="11.31028531"
                        xFract="0.37700951"
                        y3="13.54126234"
                        yFract="0.45137541"
                        z3="17.7630462"
                        zFract="0.59210154"/>
                  <atom elementType="Au"
                        id="a19"
                        x3="10.49358789"
                        xFract="0.34978626"
                        y3="14.99400146"
                        yFract="0.49980005"
                        z3="13.21857611"
                        zFract="0.4406192"/>
                  <atom elementType="Au"
                        id="a20"
                        x3="17.25038464"
                        xFract="0.57501282"
                        y3="11.110932"
                        yFract="0.3703644"
                        z3="13.28278903"
                        zFract="0.44275963"/>
                  <atom elementType="Au"
                        id="a21"
                        x3="17.23427539"
                        xFract="0.57447585"
                        y3="18.95449247"
                        yFract="0.63181642"
                        z3="13.26511102"
                        zFract="0.44217037"/>
                  <atom elementType="Au"
                        id="a22"
                        x3="12.67702312"
                        xFract="0.42256744"
                        y3="18.95350052"
                        yFract="0.63178335"
                        z3="16.69149659"
                        zFract="0.55638322"/>
                  <atom elementType="Au"
                        id="a23"
                        x3="19.52657298"
                        xFract="0.65088577"
                        y3="14.94547343"
                        yFract="0.49818245"
                        z3="16.63237266"
                        zFract="0.55441242"/>
                  <atom elementType="Au"
                        id="a24"
                        x3="12.78072008"
                        xFract="0.426024"
                        y3="11.1327459"
                        yFract="0.37109153"
                        z3="16.78922718"
                        zFract="0.55964091"/>
                  <atom elementType="Au"
                        id="a25"
                        x3="15.01069136"
                        xFract="0.50035638"
                        y3="10.18449567"
                        yFract="0.33948319"
                        z3="15.02997557"
                        zFract="0.50099919"/>
                  <atom elementType="Au"
                        id="a26"
                        x3="19.15684887"
                        xFract="0.63856163"
                        y3="17.40240063"
                        yFract="0.58008002"
                        z3="14.98946888"
                        zFract="0.49964896"/>
                  <atom elementType="Au"
                        id="a27"
                        x3="10.79706587"
                        xFract="0.3599022"
                        y3="17.43089852"
                        yFract="0.58102995"
                        z3="14.9335247"
                        zFract="0.49778416"/>
                  <atom elementType="Au"
                        id="a28"
                        x3="14.48250661"
                        xFract="0.48275022"
                        y3="11.11565294"
                        yFract="0.37052176"
                        z3="12.23902085"
                        zFract="0.40796736"/>
                  <atom elementType="Au"
                        id="a29"
                        x3="18.62871679"
                        xFract="0.62095723"
                        y3="16.51778486"
                        yFract="0.55059283"
                        z3="12.18438545"
                        zFract="0.40614618"/>
                  <atom elementType="Au"
                        id="a30"
                        x3="11.86312017"
                        xFract="0.39543734"
                        y3="17.40116932"
                        yFract="0.58003898"
                        z3="12.15609449"
                        zFract="0.40520315"/>
                  <atom elementType="Au"
                        id="a31"
                        x3="18.16922838"
                        xFract="0.60564095"
                        y3="17.39522558"
                        yFract="0.57984085"
                        z3="17.78193628"
                        zFract="0.59273121"/>
                  <atom elementType="Au"
                        id="a32"
                        x3="15.52988352"
                        xFract="0.51766278"
                        y3="11.21051151"
                        yFract="0.37368372"
                        z3="17.80000518"
                        zFract="0.59333351"/>
                  <atom elementType="Au"
                        id="a33"
                        x3="11.27040673"
                        xFract="0.37568022"
                        y3="16.53162354"
                        yFract="0.55105412"
                        z3="17.69930103"
                        zFract="0.5899767"/>
                  <atom elementType="Au"
                        id="a34"
                        x3="10.83398972"
                        xFract="0.36113299"
                        y3="12.56436047"
                        yFract="0.41881202"
                        z3="15.00111542"
                        zFract="0.50003718"/>
                  <atom elementType="Au"
                        id="a35"
                        x3="19.17075863"
                        xFract="0.63902529"
                        y3="12.56816058"
                        yFract="0.41893869"
                        z3="14.96977815"
                        zFract="0.4989926"/>
                  <atom elementType="Au"
                        id="a36"
                        x3="14.95833566"
                        xFract="0.49861119"
                        y3="19.89144232"
                        yFract="0.66304808"
                        z3="14.91666089"
                        zFract="0.49722203"/>
                  <atom elementType="Au"
                        id="a37"
                        x3="14.14521112"
                        xFract="0.47150704"
                        y3="13.51489486"
                        yFract="0.4504965"
                        z3="10.45303271"
                        zFract="0.34843442"/>
                  <atom elementType="Au"
                        id="a38"
                        x3="16.69545131"
                        xFract="0.55651504"
                        y3="15.05138647"
                        yFract="0.50171288"
                        z3="10.48534822"
                        zFract="0.34951161"/>
                  <atom elementType="Au"
                        id="a39"
                        x3="14.13564668"
                        xFract="0.47118822"
                        y3="16.561819"
                        yFract="0.55206063"
                        z3="10.48576363"
                        zFract="0.34952545"/>
                  <atom elementType="Au"
                        id="a40"
                        x3="15.81436652"
                        xFract="0.52714555"
                        y3="16.71411294"
                        yFract="0.5571371"
                        z3="19.33287573"
                        zFract="0.64442919"/>
                  <atom elementType="Au"
                        id="a41"
                        x3="15.75813181"
                        xFract="0.52527106"
                        y3="13.73754782"
                        yFract="0.45791826"
                        z3="19.42569291"
                        zFract="0.6475231"/>
                  <atom elementType="Au"
                        id="a42"
                        x3="13.14040158"
                        xFract="0.43801339"
                        y3="15.14996036"
                        yFract="0.50499868"
                        z3="19.441081"
                        zFract="0.64803603"/>
                  <atom elementType="Au"
                        id="a43"
                        x3="9.3729393"
                        xFract="0.31243131"
                        y3="14.98404653"
                        yFract="0.49946822"
                        z3="16.0060386"
                        zFract="0.53353462"/>
                  <atom elementType="Au"
                        id="a44"
                        x3="17.77829357"
                        xFract="0.59260979"
                        y3="10.17959504"
                        yFract="0.33931983"
                        z3="16.1211054"
                        zFract="0.53737018"/>
                  <atom elementType="Au"
                        id="a45"
                        x3="17.78537076"
                        xFract="0.59284569"
                        y3="19.8622701"
                        yFract="0.66207567"
                        z3="16.07494686"
                        zFract="0.53583156"/>
                  <atom elementType="Au"
                        id="a46"
                        x3="12.17356332"
                        xFract="0.40578544"
                        y3="19.87705747"
                        yFract="0.66256858"
                        z3="13.91931404"
                        zFract="0.46397713"/>
                  <atom elementType="Au"
                        id="a47"
                        x3="20.59049892"
                        xFract="0.68634996"
                        y3="14.97808925"
                        yFract="0.49926964"
                        z3="13.88271873"
                        zFract="0.46275729"/>
                  <atom elementType="Au"
                        id="a48"
                        x3="12.24418762"
                        xFract="0.40813959"
                        y3="10.11685069"
                        yFract="0.33722836"
                        z3="14.02239948"
                        zFract="0.46741332"/>
                  <atom elementType="Au"
                        id="a49"
                        x3="11.55646664"
                        xFract="0.38521555"
                        y3="14.97935965"
                        yFract="0.49931199"
                        z3="10.42240274"
                        zFract="0.34741342"/>
                  <atom elementType="Au"
                        id="a50"
                        x3="16.736952"
                        xFract="0.5578984"
                        y3="12.02807421"
                        yFract="0.40093581"
                        z3="10.44749037"
                        zFract="0.34824968"/>
                  <atom elementType="Au"
                        id="a51"
                        x3="16.71096194"
                        xFract="0.55703206"
                        y3="18.06951188"
                        yFract="0.60231706"
                        z3="10.47932527"
                        zFract="0.34931084"/>
                  <atom elementType="Au"
                        id="a52"
                        x3="13.18847066"
                        xFract="0.43961569"
                        y3="18.07681272"
                        yFract="0.60256042"
                        z3="19.44122094"
                        zFract="0.6480407"/>
                  <atom elementType="Au"
                        id="a53"
                        x3="18.51451439"
                        xFract="0.61715048"
                        y3="14.92151869"
                        yFract="0.49738396"
                        z3="19.43750397"
                        zFract="0.6479168"/>
                  <atom elementType="Au"
                        id="a54"
                        x3="13.25024639"
                        xFract="0.44167488"
                        y3="12.15172288"
                        yFract="0.40505743"
                        z3="19.53630034"
                        zFract="0.65121001"/>
                  <atom elementType="Au"
                        id="a55"
                        x3="11.96673755"
                        xFract="0.39889125"
                        y3="9.90965855"
                        yFract="0.33032195"
                        z3="11.20791669"
                        zFract="0.37359722"/>
                  <atom elementType="Au"
                        id="a56"
                        x3="20.77536183"
                        xFract="0.69251206"
                        y3="14.88103159"
                        yFract="0.49603439"
                        z3="11.05019279"
                        zFract="0.36833976"/>
                  <atom elementType="Au"
                        id="a57"
                        x3="12.15920355"
                        xFract="0.40530679"
                        y3="20.17484128"
                        yFract="0.67249471"
                        z3="11.09024631"
                        zFract="0.36967488"/>
                  <atom elementType="Au"
                        id="a58"
                        x3="17.73736082"
                        xFract="0.59124536"
                        y3="20.04421511"
                        yFract="0.6681405"
                        z3="18.9255178"
                        zFract="0.63085059"/>
                  <atom elementType="Au"
                        id="a59"
                        x3="17.96880234"
                        xFract="0.59896008"
                        y3="10.01161916"
                        yFract="0.33372064"
                        z3="18.96721577"
                        zFract="0.63224053"/>
                  <atom elementType="Au"
                        id="a60"
                        x3="9.08767781"
                        xFract="0.30292259"
                        y3="14.87319781"
                        yFract="0.49577326"
                        z3="18.84146505"
                        zFract="0.62804884"/>
                  <atom elementType="Au"
                        id="a61"
                        x3="14.1629479"
                        xFract="0.47209826"
                        y3="8.41851808"
                        yFract="0.28061727"
                        z3="12.78896585"
                        zFract="0.42629886"/>
                  <atom elementType="Au"
                        id="a62"
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                  <bond atomRefs2="a247 a397" order="S"/>
                  <bond atomRefs2="a247 a390" order="S"/>
                  <bond atomRefs2="a247 a380" order="S"/>
                  <bond atomRefs2="a248 a401" order="S"/>
                  <bond atomRefs2="a248 a395" order="S"/>
                  <bond atomRefs2="a248 a386" order="S"/>
                  <bond atomRefs2="a249 a404" order="S"/>
                  <bond atomRefs2="a249 a398" order="S"/>
                  <bond atomRefs2="a249 a389" order="S"/>
                  <bond atomRefs2="a250 a399" order="S"/>
                  <bond atomRefs2="a250 a407" order="S"/>
                  <bond atomRefs2="a250 a396" order="S"/>
                  <bond atomRefs2="a251 a403" order="S"/>
                  <bond atomRefs2="a251 a393" order="S"/>
                  <bond atomRefs2="a251 a406" order="S"/>
                  <bond atomRefs2="a252 a405" order="S"/>
                  <bond atomRefs2="a252 a409" order="S"/>
                  <bond atomRefs2="a252 a400" order="S"/>
                  <bond atomRefs2="a253 a402" order="S"/>
                  <bond atomRefs2="a253 a410" order="S"/>
                  <bond atomRefs2="a253 a408" order="S"/>
                  <bond atomRefs2="a254 a415" order="S"/>
                  <bond atomRefs2="a254 a412" order="S"/>
                  <bond atomRefs2="a254 a411" order="S"/>
                  <bond atomRefs2="a255 a414" order="S"/>
                  <bond atomRefs2="a255 a417" order="S"/>
                  <bond atomRefs2="a255 a418" order="S"/>
                  <bond atomRefs2="a256 a422" order="S"/>
                  <bond atomRefs2="a256 a416" order="S"/>
                  <bond atomRefs2="a256 a413" order="S"/>
                  <bond atomRefs2="a257 a424" order="S"/>
                  <bond atomRefs2="a257 a423" order="S"/>
                  <bond atomRefs2="a257 a419" order="S"/>
                  <bond atomRefs2="a258 a421" order="S"/>
                  <bond atomRefs2="a258 a425" order="S"/>
                  <bond atomRefs2="a258 a420" order="S"/>
                  <bond atomRefs2="a259 a432" order="S"/>
                  <bond atomRefs2="a259 a430" order="S"/>
                  <bond atomRefs2="a259 a426" order="S"/>
                  <bond atomRefs2="a260 a427" order="S"/>
                  <bond atomRefs2="a260 a428" order="S"/>
                  <bond atomRefs2="a260 a431" order="S"/>
                  <bond atomRefs2="a435 a436" order="S"/>
               </bondArray>
               <formula concise="C59H174Au144OS58">
                  <atomArray count="59 174 144 1 58" elementType="C H Au O S"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">30947.58389999989</scalar>
               </property>
            </molecule>
         </module>
      </module>
   </module>
</module>
