<?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:o="http://www.iochem-bd.org/dictionary/orca/"
        xmlns:si="http://www.xml-cml.org/unit/si/"
        xmlns:xi="http://www.w3.org/2001/XInclude"
        xmlns:xsd="http://www.w3.org/2001/XMLSchema"
        convention="convention:compchem"
        id="orca.log">
   <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">Orca</scalar>
               </parameter>
               <parameter dictRef="cc:programVersion">
                  <scalar dataType="xsd:string" id="copy.0">5.0.4</scalar>
               </parameter>
               <parameter dictRef="cc:programSubversion">
                  <scalar dataType="xsd:string" id="copy.1">RELEASE</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <module cmlx:templateRef="basis">
                  <list cmlx:templateRef="group">
                     <array dataType="xsd:integer" dictRef="o:group" size="4">1 2 3 4</array>
                     <array dataType="xsd:string" dictRef="o:primitive" size="4">7s4p1d 7s6p5d1f 10s7p1d 4s1p</array>
                     <array dataType="xsd:string" dictRef="o:contraction" size="4">3s2p1d 5s3p2d1f 4s3p1d 2s1p</array>
                  </list>
                  <list dictRef="atombasis">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="19">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="19">C C C C C Rh P P H H H H H H H H H H H</array>
                     <array dataType="xsd:integer" dictRef="o:group" size="19">1 1 1 1 1 2 3 3 4 4 4 4 4 4 4 4 4 4 4</array>
                  </list>
               </module>
               <module cmlx:templateRef="basisecp">
                  <module cmlx:templateRef="basisgroups">
                     <list cmlx:templateRef="group">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="o:group">1</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:elementType">Rh</scalar>
                           <scalar dataType="xsd:string" dictRef="o:ecptype">ECP Def2-ECP</scalar>
                        </list>
                     </list>
                  </module>
                  <module cmlx:templateRef="atombasis">
                     <list cmlx:templateRef="missingID">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="cc:serial">5</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:elementType">Rh</scalar>
                           <scalar dataType="xsd:integer" dictRef="o:group">1</scalar>
                        </list>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="basisecp">
                  <module cmlx:templateRef="basisgroups">
                     <list cmlx:templateRef="group">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="o:group">1</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:elementType">Rh</scalar>
                           <scalar dataType="xsd:string" dictRef="o:ecptype">ECP Def2-ECP</scalar>
                        </list>
                     </list>
                  </module>
                  <module cmlx:templateRef="atombasis">
                     <list cmlx:templateRef="missingID">
                        <list>
                           <scalar dataType="xsd:integer" dictRef="cc:serial">5</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:elementType">Rh</scalar>
                           <scalar dataType="xsd:integer" dictRef="o:group">1</scalar>
                        </list>
                     </list>
                  </module>
               </module>
            </parameterList>
            <molecule id="molecule">
               <atomArray>
                  <atom elementType="C"
                        id="a1"
                        x3="-1.18751"
                        y3="-0.32869"
                        z3="-1.09543"/>
                  <atom elementType="C"
                        id="a2"
                        x3="-2.42517"
                        y3="0.08142"
                        z3="-0.50264"/>
                  <atom elementType="C"
                        id="a3"
                        x3="-2.62808"
                        y3="-0.29729"
                        z3="0.79437"/>
                  <atom elementType="C"
                        id="a4"
                        x3="-1.58922"
                        y3="-1.13772"
                        z3="1.31796"/>
                  <atom elementType="C"
                        id="a5"
                        x3="-0.49578"
                        y3="-1.31118"
                        z3="0.5349"/>
                  <atom elementType="Rh"
                        id="a6"
                        x3="0.68442"
                        y3="-0.16425"
                        z3="-0.73302"/>
                  <atom elementType="P"
                        id="a7"
                        x3="2.78028"
                        y3="-0.69545"
                        z3="0.13391"/>
                  <atom elementType="P"
                        id="a8"
                        x3="0.94867"
                        y3="2.01124"
                        z3="-0.85322"/>
                  <atom elementType="H"
                        id="a9"
                        x3="1.85259"
                        y3="2.74327"
                        z3="-0.03269"/>
                  <atom elementType="H"
                        id="a10"
                        x3="1.34908"
                        y3="2.57916"
                        z3="-2.09998"/>
                  <atom elementType="H"
                        id="a11"
                        x3="-0.20097"
                        y3="2.82529"
                        z3="-0.65206"/>
                  <atom elementType="H"
                        id="a12"
                        x3="3.99321"
                        y3="-1.02761"
                        z3="-0.54074"/>
                  <atom elementType="H"
                        id="a13"
                        x3="3.38408"
                        y3="0.20346"
                        z3="1.06377"/>
                  <atom elementType="H"
                        id="a14"
                        x3="2.80074"
                        y3="-1.81734"
                        z3="1.02116"/>
                  <atom elementType="H"
                        id="a15"
                        x3="-3.52278"
                        y3="-0.04625"
                        z3="1.36692"/>
                  <atom elementType="H"
                        id="a16"
                        x3="-1.66951"
                        y3="-1.61342"
                        z3="2.29889"/>
                  <atom elementType="H"
                        id="a17"
                        x3="-3.20369"
                        y3="0.5634"
                        z3="-1.10042"/>
                  <atom elementType="H"
                        id="a18"
                        x3="-1.25126"
                        y3="-0.64228"
                        z3="-2.16267"/>
                  <atom elementType="H"
                        id="a19"
                        x3="0.27336"
                        y3="-2.01564"
                        z3="0.87979"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a1 a18" order="S"/>
                  <bond atomRefs2="a1 a6" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a2 a17" order="S"/>
                  <bond atomRefs2="a3 a15" order="S"/>
                  <bond atomRefs2="a3 a4" order="S"/>
                  <bond atomRefs2="a4 a16" order="S"/>
                  <bond atomRefs2="a4 a5" order="S"/>
                  <bond atomRefs2="a5 a6" order="S"/>
                  <bond atomRefs2="a5 a19" order="S"/>
                  <bond atomRefs2="a6 a8" order="S"/>
                  <bond atomRefs2="a6 a7" order="S"/>
                  <bond atomRefs2="a7 a12" order="S"/>
                  <bond atomRefs2="a7 a14" order="S"/>
                  <bond atomRefs2="a7 a13" order="S"/>
                  <bond atomRefs2="a8 a11" order="S"/>
                  <bond atomRefs2="a8 a9" order="S"/>
                  <bond atomRefs2="a8 a10" order="S"/>
               </bondArray>
               <formula concise="C5H11P2Rh">
                  <atomArray count="5 11 2 1" elementType="C H P Rh"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">224.906522</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1875,-.3287,-1.0954;-2.4252,.0814,-.5026;-2.6281,-.2973,.7944;-1.5892,-1.1377,1.318;-.4958,-1.3112,.5349;.6844,-.1643,-.733;2.7803,-.6955,.1339;.9487,2.0112,-.8532;1.8526,2.7433,-.0327;1.3491,2.5792,-2.1;-.201,2.8253,-.6521;3.9932,-1.0276,-.5407;3.3841,.2035,1.0638;2.8007,-1.8173,1.0212;-3.5228,-.0462,1.3669;-1.6695,-1.6134,2.2989;-3.2037,.5634,-1.1004;-1.2513,-.6423,-2.1627;.2734,-2.0156,.8798;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="scfsettings" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="section" name="Hamiltonian">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Method</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">DFT(GTOs)</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Exchange</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">PBE</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">PBE kappa parameter   XKappa</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.804000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">XMuePBE</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.219520</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Correlation</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">PBE</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">PBE beta parameter  CBetaPBE</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.066725</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">LDAOpt</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">PW91-LDA</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">PostSCFGGA</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">off</scalar>
                     </list>
                     <scalar dataType="xsd:string" dictRef="o:comment">Hybrid DFT is turned on</scalar>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ScalHFX</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.250000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ScalDFX</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.750000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ScalDFC</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ScalLDAC</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Perturbative correction</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.000000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Density functional embedding theory</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">OFF</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">NL short-range parameter</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">6.900000</scalar>
                     </list>
                     <scalar dataType="xsd:string" dictRef="o:comment">RI-approximation to the Coulomb term is turned on</scalar>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">functions</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">557</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">RIJ-COSX (HFX calculated with COS-X))</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">on</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="section" name="General Settings">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">IntName</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">reaction-12-ieip-optts</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">HFTyp</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">RHF</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Charge</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Mult</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">NEL</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">88</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Dim</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">192</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ENuc</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">631.0375031927 Eh</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="section" name="Convergence Acceleration">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVDIIS</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">on</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DIISMaxIt</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">12</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DIISStart</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.200000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DIISMaxEq</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">5</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DIISBfac</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.050</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DIISMaxC</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">10.000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVTRAH</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">auto</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Auto Start mean grad. ratio tolernc.</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.125000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Auto Start start iteration</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">20</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Auto Start num. interpolation iter.</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">10</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">iterations</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">16</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">iterations</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">Maxiter - #DIIS iter</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Number of Davidson start vectors</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">2</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Converg. threshold I  (grad. norm)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-05</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Converg. threshold II (energy diff.)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-08</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Micro threshold</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.100</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Minimum threshold for Micro iter.</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.010</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">NR start threshold (gradient norm)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.001</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Initial trust radius</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.400</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Minimum AH scaling param. (alpha)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Maximum AH scaling param. (alpha)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1000.000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Orbital update algorithm</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">Taylor</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">David. guess</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">on</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Maximum white noise</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.010</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Quad. conv. algorithm</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">NR</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVSOSCF</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">off</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVShift</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">on</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">LevelShift</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.2500</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ShiftErr</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.0010</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVZerner</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">off</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVDamp</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">on</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DampFac</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.7000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DampMax</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.9800</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DampMin</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.0000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DampErr</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.1000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVRico</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">off</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="section" name="SCF Procedure">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">MaxIter</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">125</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">SCFMode</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">Direct</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Integral package</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">SHARK and LIBINT hybrid scheme</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DirectResetFreq</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">20</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Thresh</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">2.500e-11 Eh</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">TCut</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">2.500e-12 Eh</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="section" name="Convergence Tolerance">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ConvCheckMode</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">Total+1el-Energy</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ConvForced</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">TolE</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-08 Eh</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">1-El. energy change</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-05 Eh</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">TolErr</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">5.000e-07</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="section" name="Diagonalization of the overlap matrix">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Smallest eigenvalue</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">8.752e-04</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Time for diagonalization</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.008 sec</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Threshold for overlap eigenvalues</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-08</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Number of eigenvalues below threshold</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Time for construction of square roots</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.002 sec</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Total time needed</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.011 sec</scalar>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="scfsettings" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="section" name="Hamiltonian">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Method</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">DFT(GTOs)</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Exchange</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">PBE</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">PBE kappa parameter   XKappa</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.804000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">XMuePBE</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.219520</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Correlation</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">PBE</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">PBE beta parameter  CBetaPBE</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.066725</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">LDAOpt</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">PW91-LDA</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">PostSCFGGA</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">off</scalar>
                     </list>
                     <scalar dataType="xsd:string" dictRef="o:comment">Hybrid DFT is turned on</scalar>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ScalHFX</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.250000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ScalDFX</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.750000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ScalDFC</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ScalLDAC</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Perturbative correction</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.000000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Density functional embedding theory</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">OFF</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">NL short-range parameter</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">6.900000</scalar>
                     </list>
                     <scalar dataType="xsd:string" dictRef="o:comment">RI-approximation to the Coulomb term is turned on</scalar>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">functions</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">557</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">RIJ-COSX (HFX calculated with COS-X))</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">on</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="section" name="General Settings">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">IntName</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">reaction-12-ieip-optts</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">HFTyp</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">RHF</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Charge</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Mult</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">NEL</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">88</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Dim</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">192</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ENuc</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">637.2658774385 Eh</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="section" name="Convergence Acceleration">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVDIIS</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">on</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DIISMaxIt</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">12</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DIISStart</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.200000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DIISMaxEq</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">5</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DIISBfac</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.050</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DIISMaxC</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">10.000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVTRAH</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">auto</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Auto Start mean grad. ratio tolernc.</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.125000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Auto Start start iteration</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Auto Start num. interpolation iter.</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">10</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">iterations</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">16</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">iterations</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">Maxiter - #DIIS iter</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Number of Davidson start vectors</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">2</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Converg. threshold I  (grad. norm)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-05</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Converg. threshold II (energy diff.)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-08</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Micro threshold</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.100</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Minimum threshold for Micro iter.</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.010</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">NR start threshold (gradient norm)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.001</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Initial trust radius</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.400</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Minimum AH scaling param. (alpha)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Maximum AH scaling param. (alpha)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1000.000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Orbital update algorithm</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">Taylor</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">David. guess</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">on</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Maximum white noise</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.010</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Quad. conv. algorithm</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">NR</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVSOSCF</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">off</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVShift</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">on</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">LevelShift</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.2500</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ShiftErr</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.0010</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVZerner</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">off</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVDamp</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">on</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DampFac</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.7000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DampMax</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.9800</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DampMin</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.0000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DampErr</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.1000</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">CNVRico</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">off</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="section" name="SCF Procedure">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">MaxIter</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">125</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">SCFMode</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">Direct</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Integral package</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">SHARK and LIBINT hybrid scheme</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">DirectResetFreq</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">20</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Thresh</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">2.500e-11 Eh</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">TCut</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">2.500e-12 Eh</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="section" name="Convergence Tolerance">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ConvCheckMode</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">Total+1el-Energy</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ConvForced</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">TolE</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-08 Eh</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">1-El. energy change</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-05 Eh</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">TolErr</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">5.000e-07</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="section" name="Diagonalization of the overlap matrix">
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Smallest eigenvalue</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">8.473e-04</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Time for diagonalization</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.005 sec</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Threshold for overlap eigenvalues</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-08</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Number of eigenvalues below threshold</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Time for construction of square roots</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.003 sec</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Total time needed</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.008 sec</scalar>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="input" id="initialization">
                  <module cmlx:templateRef="job">
                     <scalar dataType="xsd:integer" dictRef="o:charge">0</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:multiplicity">1</scalar>
                     <array dataType="xsd:string" dictRef="cc:keywords" size="10">PBE0 D3BJ def2-SVP def2/J TightSCF defgrid3 RIJCOSX OptTS TightOpt pal8</array>
                     <module cmlx:templateRef="block">
                        <scalar dataType="xsd:string" dictRef="o:type">geom</scalar>
                        <scalar dataType="xsd:string" dictRef="o:parameters"/>
                        <scalar dataType="xsd:string" dictRef="o:parameter">calc_hess true</scalar>
                        <scalar dataType="xsd:string" dictRef="o:parameter">trust -0.1</scalar>
                        <scalar dataType="xsd:string" dictRef="o:parameter">maxiter 300</scalar>
                     </module>
                     <module cmlx:templateRef="block">
                        <scalar dataType="xsd:string" dictRef="o:type">maxcore</scalar>
                        <scalar dataType="xsd:string" dictRef="o:parameters">4000</scalar>
                        <scalar dataType="xsd:string" dictRef="o:parameter"/>
                     </module>
                  </module>
               </module>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation">
            <module dictRef="cc:userDefined" id="otherComponents">
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.181236"
                              y3="-0.345789"
                              z3="-1.100319"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.42129"
                              y3="0.076046"
                              z3="-0.525591"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.632213"
                              y3="-0.275265"
                              z3="0.778946"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.597325"
                              y3="-1.103775"
                              z3="1.324675"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.50059"
                              y3="-1.295683"
                              z3="0.54801"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.69281"
                              y3="-0.187092"
                              z3="-0.737988"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.799443"
                              y3="-0.705605"
                              z3="0.109658"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.930084"
                              y3="1.990372"
                              z3="-0.824101"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.828793"
                              y3="2.713213"
                              z3="0.010321"/>
                        <atom elementType="H"
                              id="a10"
                              x3="1.318867"
                              y3="2.591047"
                              z3="-2.058878"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.229666"
                              y3="2.783363"
                              z3="-0.599159"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.008092"
                              y3="-1.026422"
                              z3="-0.578571"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.403985"
                              y3="0.202663"
                              z3="1.029425"/>
                        <atom elementType="H"
                              id="a14"
                              x3="2.844074"
                              y3="-1.825423"
                              z3="0.998386"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.530087"
                              y3="-0.010609"
                              z3="1.34059"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.681723"
                              y3="-1.557585"
                              z3="2.315687"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.194895"
                              y3="0.546702"
                              z3="-1.138559"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.232579"
                              y3="-0.668596"
                              z3="-2.165542"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.267916"
                              y3="-1.991442"
                              z3="0.91181"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1812,-.3458,-1.1003;-2.4213,.076,-.5256;-2.6322,-.2753,.7789;-1.5973,-1.1038,1.3247;-.5006,-1.2957,.548;.6928,-.1871,-.738;2.7994,-.7056,.1097;.9301,1.9904,-.8241;1.8288,2.7132,.0103;1.3189,2.591,-2.0589;-.2297,2.7834,-.5992;4.0081,-1.0264,-.5786;3.404,.2027,1.0294;2.8441,-1.8254,.9984;-3.5301,-.0106,1.3406;-1.6817,-1.5576,2.3157;-3.1949,.5467,-1.1386;-1.2326,-.6686,-2.1655;.2679,-1.9914,.9118;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.175943"
                              y3="-0.363298"
                              z3="-1.106479"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.417271"
                              y3="0.070296"
                              z3="-0.548724"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.633334"
                              y3="-0.251736"
                              z3="0.763911"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.602097"
                              y3="-1.068175"
                              z3="1.329822"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.503937"
                              y3="-1.280124"
                              z3="0.557572"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.700691"
                              y3="-0.20949"
                              z3="-0.744318"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.817224"
                              y3="-0.716499"
                              z3="0.086881"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.909974"
                              y3="1.969064"
                              z3="-0.794799"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.802876"
                              y3="2.682593"
                              z3="0.053839"/>
                        <atom elementType="H"
                              id="a10"
                              x3="1.28659"
                              y3="2.602869"
                              z3="-2.016512"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.260367"
                              y3="2.738985"
                              z3="-0.546429"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.022369"
                              y3="-1.027734"
                              z3="-0.612185"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.421833"
                              y3="0.201035"
                              z3="0.997037"/>
                        <atom elementType="H"
                              id="a14"
                              x3="2.883405"
                              y3="-1.833231"
                              z3="0.977972"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.532683"
                              y3="0.027473"
                              z3="1.316365"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.688493"
                              y3="-1.498972"
                              z3="2.330941"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.187644"
                              y3="0.528078"
                              z3="-1.175332"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.214542"
                              y3="-0.693637"
                              z3="-2.170009"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.263807"
                              y3="-1.967377"
                              z3="0.939248"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1759,-.3633,-1.1065;-2.4173,.0703,-.5487;-2.6333,-.2517,.7639;-1.6021,-1.0682,1.3298;-.5039,-1.2801,.5576;.7007,-.2095,-.7443;2.8172,-.7165,.0869;.91,1.9691,-.7948;1.8029,2.6826,.0538;1.2866,2.6029,-2.0165;-.2604,2.739,-.5464;4.0224,-1.0277,-.6122;3.4218,.201,.997;2.8834,-1.8332,.978;-3.5327,.0275,1.3164;-1.6885,-1.499,2.3309;-3.1876,.5281,-1.1753;-1.2145,-.6936,-2.17;.2638,-1.9674,.9392;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.170651"
                              y3="-0.381087"
                              z3="-1.112492"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.412921"
                              y3="0.064367"
                              z3="-0.571629"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.63387"
                              y3="-0.227749"
                              z3="0.748523"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.606345"
                              y3="-1.031825"
                              z3="1.334328"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.506833"
                              y3="-1.264305"
                              z3="0.567151"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.708291"
                              y3="-0.231461"
                              z3="-0.749863"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.8345"
                              y3="-0.72708"
                              z3="0.064606"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.889751"
                              y3="1.947545"
                              z3="-0.765177"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.77711"
                              y3="2.651718"
                              z3="0.097046"/>
                        <atom elementType="H"
                              id="a10"
                              x3="1.253594"
                              y3="2.613882"
                              z3="-1.973202"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.290832"
                              y3="2.693544"
                              z3="-0.493966"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.035554"
                              y3="-1.02773"
                              z3="-0.646346"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.439193"
                              y3="0.198997"
                              z3="0.965709"/>
                        <atom elementType="H"
                              id="a14"
                              x3="2.92287"
                              y3="-1.841303"
                              z3="0.956718"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.534466"
                              y3="0.066045"
                              z3="1.29155"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.694974"
                              y3="-1.439566"
                              z3="2.344918"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.179976"
                              y3="0.509177"
                              z3="-1.211473"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.196831"
                              y3="-0.719395"
                              z3="-2.173948"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.259294"
                              y3="-1.943653"
                              z3="0.966346"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1707,-.3811,-1.1125;-2.4129,.0644,-.5716;-2.6339,-.2277,.7485;-1.6063,-1.0318,1.3343;-.5068,-1.2643,.5672;.7083,-.2315,-.7499;2.8345,-.7271,.0646;.8898,1.9475,-.7652;1.7771,2.6517,.097;1.2536,2.6139,-1.9732;-.2908,2.6935,-.494;4.0356,-1.0277,-.6463;3.4392,.199,.9657;2.9229,-1.8413,.9567;-3.5345,.066,1.2915;-1.695,-1.4396,2.3449;-3.18,.5092,-1.2115;-1.1968,-.7194,-2.1739;.2593,-1.9437,.9663;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.165402"
                              y3="-0.399294"
                              z3="-1.118486"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.408264"
                              y3="0.058086"
                              z3="-0.594227"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.633647"
                              y3="-0.203448"
                              z3="0.732841"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.6098"
                              y3="-0.994899"
                              z3="1.338177"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.509134"
                              y3="-1.248501"
                              z3="0.576687"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.715489"
                              y3="-0.25265"
                              z3="-0.754933"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.85095"
                              y3="-0.737249"
                              z3="0.04291"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.86957"
                              y3="1.926232"
                              z3="-0.735454"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.751882"
                              y3="2.620861"
                              z3="0.139641"/>
                        <atom elementType="H"
                              id="a10"
                              x3="1.219933"
                              y3="2.624514"
                              z3="-1.929188"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.320715"
                              y3="2.64767"
                              z3="-0.441726"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.047467"
                              y3="-1.026645"
                              z3="-0.680517"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.455777"
                              y3="0.196445"
                              z3="0.935748"/>
                        <atom elementType="H"
                              id="a14"
                              x3="2.961493"
                              y3="-1.849599"
                              z3="0.934672"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.535197"
                              y3="0.104962"
                              z3="1.266312"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.700838"
                              y3="-1.379506"
                              z3="2.35764"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.171983"
                              y3="0.489849"
                              z3="-1.246834"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.179694"
                              y3="-0.746163"
                              z3="-2.177439"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.254574"
                              y3="-1.920545"
                              z3="0.992975"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1654,-.3993,-1.1185;-2.4083,.0581,-.5942;-2.6336,-.2034,.7328;-1.6098,-.9949,1.3382;-.5091,-1.2485,.5767;.7155,-.2526,-.7549;2.851,-.7372,.0429;.8696,1.9262,-.7355;1.7519,2.6209,.1396;1.2199,2.6245,-1.9292;-.3207,2.6477,-.4417;4.0475,-1.0266,-.6805;3.4558,.1964,.9357;2.9615,-1.8496,.9347;-3.5352,.105,1.2663;-1.7008,-1.3795,2.3576;-3.172,.4898,-1.2468;-1.1797,-.7462,-2.1774;.2546,-1.9205,.993;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.160148"
                              y3="-0.417832"
                              z3="-1.12441"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.403273"
                              y3="0.051516"
                              z3="-0.616351"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.632636"
                              y3="-0.178997"
                              z3="0.716933"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.612474"
                              y3="-0.957763"
                              z3="1.341345"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.510877"
                              y3="-1.232944"
                              z3="0.586191"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.722296"
                              y3="-0.272871"
                              z3="-0.7595"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.866502"
                              y3="-0.746947"
                              z3="0.021909"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.849532"
                              y3="1.905331"
                              z3="-0.705884"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.727377"
                              y3="2.590442"
                              z3="0.181167"/>
                        <atom elementType="H"
                              id="a10"
                              x3="1.185602"
                              y3="2.634744"
                              z3="-1.884893"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.349844"
                              y3="2.601693"
                              z3="-0.389938"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.058096"
                              y3="-1.024467"
                              z3="-0.714401"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.471507"
                              y3="0.193316"
                              z3="0.907454"/>
                        <atom elementType="H"
                              id="a14"
                              x3="2.998929"
                              y3="-1.858145"
                              z3="0.9119"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.534823"
                              y3="0.144042"
                              z3="1.240767"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.706142"
                              y3="-1.319297"
                              z3="2.369039"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.163617"
                              y3="0.470383"
                              z3="-1.281156"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.163216"
                              y3="-0.773792"
                              z3="-2.180451"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.249668"
                              y3="-1.89829"
                              z3="1.019079"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1601,-.4178,-1.1244;-2.4033,.0515,-.6164;-2.6326,-.179,.7169;-1.6125,-.9578,1.3413;-.5109,-1.2329,.5862;.7223,-.2729,-.7595;2.8665,-.7469,.0219;.8495,1.9053,-.7059;1.7274,2.5904,.1812;1.1856,2.6347,-1.8849;-.3498,2.6017,-.3899;4.0581,-1.0245,-.7144;3.4715,.1933,.9075;2.9989,-1.8581,.9119;-3.5348,.144,1.2408;-1.7061,-1.3193,2.369;-3.1636,.4704,-1.2812;-1.1632,-.7738,-2.1805;.2497,-1.8983,1.0191;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.155003"
                              y3="-0.43637"
                              z3="-1.130094"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.398165"
                              y3="0.044666"
                              z3="-0.637792"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.631104"
                              y3="-0.154837"
                              z3="0.70093"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.614628"
                              y3="-0.920974"
                              z3="1.343844"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.512253"
                              y3="-1.217864"
                              z3="0.595695"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.728603"
                              y3="-0.291863"
                              z3="-0.763226"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.881099"
                              y3="-0.75603"
                              z3="0.001776"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.830037"
                              y3="1.885074"
                              z3="-0.676808"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.704198"
                              y3="2.560832"
                              z3="0.221035"/>
                        <atom elementType="H"
                              id="a10"
                              x3="1.151089"
                              y3="2.644354"
                              z3="-1.840933"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.377653"
                              y3="2.556181"
                              z3="-0.339002"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.067269"
                              y3="-1.021182"
                              z3="-0.747901"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.486528"
                              y3="0.189775"
                              z3="0.880886"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.03514"
                              y3="-1.866759"
                              z3="0.88864"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.53367"
                              y3="0.182643"
                              z3="1.215076"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.711169"
                              y3="-1.259742"
                              z3="2.379064"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.155108"
                              y3="0.450962"
                              z3="-1.31415"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.147286"
                              y3="-0.801726"
                              z3="-2.182891"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.244537"
                              y3="-1.87702"
                              z3="1.044652"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.155,-.4364,-1.1301;-2.3982,.0447,-.6378;-2.6311,-.1548,.7009;-1.6146,-.921,1.3438;-.5123,-1.2179,.5957;.7286,-.2919,-.7632;2.8811,-.756,.0018;.83,1.8851,-.6768;1.7042,2.5608,.221;1.1511,2.6444,-1.8409;-.3777,2.5562,-.339;4.0673,-1.0212,-.7479;3.4865,.1898,.8809;3.0351,-1.8668,.8886;-3.5337,.1826,1.2151;-1.7112,-1.2597,2.3791;-3.1551,.451,-1.3141;-1.1473,-.8017,-2.1829;.2445,-1.877,1.0447;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.149996"
                              y3="-0.454707"
                              z3="-1.13543"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.392952"
                              y3="0.037733"
                              z3="-0.6584"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.629081"
                              y3="-0.131095"
                              z3="0.684969"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.616353"
                              y3="-0.884892"
                              z3="1.345664"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.513362"
                              y3="-1.203431"
                              z3="0.605093"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.734437"
                              y3="-0.309629"
                              z3="-0.765989"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.894815"
                              y3="-0.764533"
                              z3="-0.017338"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.811101"
                              y3="1.865502"
                              z3="-0.648415"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.682326"
                              y3="2.532454"
                              z3="0.258877"/>
                        <atom elementType="H"
                              id="a10"
                              x3="1.116479"
                              y3="2.652999"
                              z3="-1.797805"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.404129"
                              y3="2.511348"
                              z3="-0.289333"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.075141"
                              y3="-1.016715"
                              z3="-0.780716"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.500811"
                              y3="0.185778"
                              z3="0.856318"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.070203"
                              y3="-1.875512"
                              z3="0.865016"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.531744"
                              y3="0.220603"
                              z3="1.189468"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.715969"
                              y3="-1.201378"
                              z3="2.387687"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.146499"
                              y3="0.431921"
                              z3="-1.3456"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.131943"
                              y3="-0.82943"
                              z3="-2.184773"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.239176"
                              y3="-1.856896"
                              z3="1.069509"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.15,-.4547,-1.1354;-2.393,.0377,-.6584;-2.6291,-.1311,.685;-1.6164,-.8849,1.3457;-.5134,-1.2034,.6051;.7344,-.3096,-.766;2.8948,-.7645,-.0173;.8111,1.8655,-.6484;1.6823,2.5325,.2589;1.1165,2.653,-1.7978;-.4041,2.5113,-.2893;4.0751,-1.0167,-.7807;3.5008,.1858,.8563;3.0702,-1.8755,.865;-3.5317,.2206,1.1895;-1.716,-1.2014,2.3877;-3.1465,.4319,-1.3456;-1.1319,-.8294,-2.1848;.2392,-1.8569,1.0695;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.145125"
                              y3="-0.472512"
                              z3="-1.14022"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.387746"
                              y3="0.030816"
                              z3="-0.67797"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.626871"
                              y3="-0.108231"
                              z3="0.669202"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.617905"
                              y3="-0.850015"
                              z3="1.346892"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.514316"
                              y3="-1.189632"
                              z3="0.614485"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.739809"
                              y3="-0.326019"
                              z3="-0.767572"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.907692"
                              y3="-0.772492"
                              z3="-0.035325"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.792958"
                              y3="1.846874"
                              z3="-0.62095"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.661941"
                              y3="2.505884"
                              z3="0.294336"/>
                        <atom elementType="H"
                              id="a10"
                              x3="1.082344"
                              y3="2.660454"
                              z3="-1.756123"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.428985"
                              y3="2.467905"
                              z3="-0.241595"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.081658"
                              y3="-1.011192"
                              z3="-0.812796"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.514584"
                              y3="0.181211"
                              z3="0.833844"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.104119"
                              y3="-1.88447"
                              z3="0.841104"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.529479"
                              y3="0.257169"
                              z3="1.164095"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.720814"
                              y3="-1.144989"
                              z3="2.394955"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.137894"
                              y3="0.413474"
                              z3="-1.375306"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.117133"
                              y3="-0.85634"
                              z3="-2.1860"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.233625"
                              y3="-1.837775"
                              z3="1.093746"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1451,-.4725,-1.1402;-2.3877,.0308,-.678;-2.6269,-.1082,.6692;-1.6179,-.85,1.3469;-.5143,-1.1896,.6145;.7398,-.326,-.7676;2.9077,-.7725,-.0353;.793,1.8469,-.621;1.6619,2.5059,.2943;1.0823,2.6605,-1.7561;-.429,2.4679,-.2416;4.0817,-1.0112,-.8128;3.5146,.1812,.8338;3.1041,-1.8845,.8411;-3.5295,.2572,1.1641;-1.7208,-1.145,2.395;-3.1379,.4135,-1.3753;-1.1171,-.8563,-2.186;.2336,-1.8378,1.0937;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.140258"
                              y3="-0.489665"
                              z3="-1.144527"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.382304"
                              y3="0.024232"
                              z3="-0.696482"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.624185"
                              y3="-0.085942"
                              z3="0.653739"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.619118"
                              y3="-0.816266"
                              z3="1.347549"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.515089"
                              y3="-1.176467"
                              z3="0.623653"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.744965"
                              y3="-0.341296"
                              z3="-0.768066"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.920012"
                              y3="-0.780162"
                              z3="-0.052142"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.775051"
                              y3="1.828987"
                              z3="-0.594373"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.641873"
                              y3="2.481409"
                              z3="0.327741"/>
                        <atom elementType="H"
                              id="a10"
                              x3="1.048297"
                              y3="2.666468"
                              z3="-1.715988"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.45321"
                              y3="2.425282"
                              z3="-0.196262"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.087233"
                              y3="-1.00491"
                              z3="-0.843842"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.528039"
                              y3="0.175786"
                              z3="0.813624"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.137007"
                              y3="-1.893903"
                              z3="0.816971"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.526484"
                              y3="0.292812"
                              z3="1.139174"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.725413"
                              y3="-1.090502"
                              z3="2.400955"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.129103"
                              y3="0.395999"
                              z3="-1.403219"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.102808"
                              y3="-0.882023"
                              z3="-2.186772"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.227956"
                              y3="-1.81972"
                              z3="1.117068"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1403,-.4897,-1.1445;-2.3823,.0242,-.6965;-2.6242,-.0859,.6537;-1.6191,-.8163,1.3475;-.5151,-1.1765,.6237;.745,-.3413,-.7681;2.92,-.7802,-.0521;.7751,1.829,-.5944;1.6419,2.4814,.3277;1.0483,2.6665,-1.716;-.4532,2.4253,-.1963;4.0872,-1.0049,-.8438;3.528,.1758,.8136;3.137,-1.8939,.817;-3.5265,.2928,1.1392;-1.7254,-1.0905,2.401;-3.1291,.396,-1.4032;-1.1028,-.882,-2.1868;.228,-1.8197,1.1171;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.135397"
                              y3="-0.506255"
                              z3="-1.148536"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.376546"
                              y3="0.018056"
                              z3="-0.714036"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.620778"
                              y3="-0.06397"
                              z3="0.63861"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.619764"
                              y3="-0.783461"
                              z3="1.347663"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.515597"
                              y3="-1.163928"
                              z3="0.632452"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.74996"
                              y3="-0.355643"
                              z3="-0.767726"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.931822"
                              y3="-0.787589"
                              z3="-0.067834"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.757124"
                              y3="1.811695"
                              z3="-0.568608"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.621626"
                              y3="2.458842"
                              z3="0.35947"/>
                        <atom elementType="H"
                              id="a10"
                              x3="1.014162"
                              y3="2.671151"
                              z3="-1.677266"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.477248"
                              y3="2.383092"
                              z3="-0.15326"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.092045"
                              y3="-0.998013"
                              z3="-0.873645"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.54112"
                              y3="0.169544"
                              z3="0.795604"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.168736"
                              y3="-1.903767"
                              z3="0.792734"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.522421"
                              y3="0.327953"
                              z3="1.114811"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.729428"
                              y3="-1.037661"
                              z3="2.4058"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.120114"
                              y3="0.379558"
                              z3="-1.429432"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.089065"
                              y3="-0.906616"
                              z3="-2.187279"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.222224"
                              y3="-1.802866"
                              z3="1.139278"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1354,-.5063,-1.1485;-2.3765,.0181,-.714;-2.6208,-.064,.6386;-1.6198,-.7835,1.3477;-.5156,-1.1639,.6325;.75,-.3556,-.7677;2.9318,-.7876,-.0678;.7571,1.8117,-.5686;1.6216,2.4588,.3595;1.0142,2.6712,-1.6773;-.4772,2.3831,-.1533;4.092,-.998,-.8736;3.5411,.1695,.7956;3.1687,-1.9038,.7927;-3.5224,.328,1.1148;-1.7294,-1.0377,2.4058;-3.1201,.3796,-1.4294;-1.0891,-.9066,-2.1873;.2222,-1.8029,1.1393;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.130801"
                              y3="-0.521759"
                              z3="-1.151819"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.371283"
                              y3="0.011691"
                              z3="-0.730316"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.617908"
                              y3="-0.043917"
                              z3="0.624045"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.620674"
                              y3="-0.75269"
                              z3="1.347518"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.516105"
                              y3="-1.151844"
                              z3="0.641351"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.754421"
                              y3="-0.368253"
                              z3="-0.766144"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.942687"
                              y3="-0.79443"
                              z3="-0.082371"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.740748"
                              y3="1.796079"
                              z3="-0.544173"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.603566"
                              y3="2.438821"
                              z3="0.388608"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.982364"
                              y3="2.674814"
                              z3="-1.641045"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.498821"
                              y3="2.344208"
                              z3="-0.11319"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.095302"
                              y3="-0.990672"
                              z3="-0.902534"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.554069"
                              y3="0.162698"
                              z3="0.77949"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.198665"
                              y3="-1.913728"
                              z3="0.768468"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.519082"
                              y3="0.359959"
                              z3="1.091131"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.733788"
                              y3="-0.988073"
                              z3="2.409695"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.111705"
                              y3="0.363447"
                              z3="-1.45377"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.075712"
                              y3="-0.929653"
                              z3="-2.187093"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.216518"
                              y3="-1.786577"
                              z3="1.16095"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1308,-.5218,-1.1518;-2.3713,.0117,-.7303;-2.6179,-.0439,.624;-1.6207,-.7527,1.3475;-.5161,-1.1518,.6414;.7544,-.3683,-.7661;2.9427,-.7944,-.0824;.7407,1.7961,-.5442;1.6036,2.4388,.3886;.9824,2.6748,-1.641;-.4988,2.3442,-.1132;4.0953,-.9907,-.9025;3.5541,.1627,.7795;3.1987,-1.9137,.7685;-3.5191,.36,1.0911;-1.7338,-.9881,2.4097;-3.1117,.3634,-1.4538;-1.0757,-.9297,-2.1871;.2165,-1.7866,1.1609;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.126892"
                              y3="-0.534629"
                              z3="-1.153188"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.368153"
                              y3="0.004175"
                              z3="-0.744145"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.618392"
                              y3="-0.029699"
                              z3="0.61096"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.623837"
                              y3="-0.72723"
                              z3="1.347751"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.517314"
                              y3="-1.140209"
                              z3="0.651153"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.75759"
                              y3="-0.376998"
                              z3="-0.762117"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.951625"
                              y3="-0.800038"
                              z3="-0.095239"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.729527"
                              y3="1.784973"
                              z3="-0.522841"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.592519"
                              y3="2.423923"
                              z3="0.412473"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.958865"
                              y3="2.677975"
                              z3="-1.610736"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.513017"
                              y3="2.315886"
                              z3="-0.078967"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.09531"
                              y3="-0.983539"
                              z3="-0.930655"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.567464"
                              y3="0.155349"
                              z3="0.765301"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.225029"
                              y3="-1.923342"
                              z3="0.744675"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.520463"
                              y3="0.382445"
                              z3="1.06905"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.740738"
                              y3="-0.946647"
                              z3="2.412986"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.105406"
                              y3="0.34676"
                              z3="-1.475175"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.062418"
                              y3="-0.949211"
                              z3="-2.185197"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.21116"
                              y3="-1.769823"
                              z3="1.182709"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1269,-.5346,-1.1532;-2.3682,.0042,-.7441;-2.6184,-.0297,.611;-1.6238,-.7272,1.3478;-.5173,-1.1402,.6512;.7576,-.377,-.7621;2.9516,-.8,-.0952;.7295,1.785,-.5228;1.5925,2.4239,.4125;.9589,2.678,-1.6107;-.513,2.3159,-.079;4.0953,-.9835,-.9307;3.5675,.1553,.7653;3.225,-1.9233,.7447;-3.5205,.3824,1.0691;-1.7407,-.9466,2.413;-3.1054,.3468,-1.4752;-1.0624,-.9492,-2.1852;.2112,-1.7698,1.1827;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.123096"
                              y3="-0.545374"
                              z3="-1.152985"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.365989"
                              y3="-0.00356"
                              z3="-0.75597"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.620791"
                              y3="-0.019047"
                              z3="0.599209"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.62844"
                              y3="-0.705366"
                              z3="1.348254"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.519171"
                              y3="-1.128718"
                              z3="0.661065"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.760384"
                              y3="-0.383419"
                              z3="-0.75631"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.959886"
                              y3="-0.805453"
                              z3="-0.1069"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.720904"
                              y3="1.776553"
                              z3="-0.50373"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.583657"
                              y3="2.413199"
                              z3="0.433449"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.940627"
                              y3="2.680175"
                              z3="-1.584772"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.523961"
                              y3="2.293966"
                              z3="-0.050439"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.094015"
                              y3="-0.976909"
                              z3="-0.957695"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.581505"
                              y3="0.146763"
                              z3="0.752928"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.249405"
                              y3="-1.933589"
                              z3="0.720916"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.524555"
                              y3="0.399052"
                              z3="1.048527"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.749099"
                              y3="-0.910753"
                              z3="2.415909"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.100185"
                              y3="0.330102"
                              z3="-1.494151"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.04896"
                              y3="-0.9652"
                              z3="-2.182208"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.206324"
                              y3="-1.752302"
                              z3="1.203701"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1231,-.5454,-1.153;-2.366,-.0036,-.756;-2.6208,-.019,.5992;-1.6284,-.7054,1.3483;-.5192,-1.1287,.6611;.7604,-.3834,-.7563;2.9599,-.8055,-.1069;.7209,1.7766,-.5037;1.5837,2.4132,.4334;.9406,2.6802,-1.5848;-.524,2.294,-.0504;4.094,-.9769,-.9577;3.5815,.1468,.7529;3.2494,-1.9336,.7209;-3.5246,.3991,1.0485;-1.7491,-.9108,2.4159;-3.1002,.3301,-1.4942;-1.049,-.9652,-2.1822;.2063,-1.7523,1.2037;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.119688"
                              y3="-0.554551"
                              z3="-1.151746"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.36489"
                              y3="-0.01164"
                              z3="-0.765971"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.624901"
                              y3="-0.012016"
                              z3="0.588789"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.634312"
                              y3="-0.687512"
                              z3="1.349118"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.521578"
                              y3="-1.118167"
                              z3="0.671221"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.762267"
                              y3="-0.387392"
                              z3="-0.749082"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.966738"
                              y3="-0.809948"
                              z3="-0.117108"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.715635"
                              y3="1.771204"
                              z3="-0.487195"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.57881"
                              y3="2.406085"
                              z3="0.450852"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.928098"
                              y3="2.682357"
                              z3="-1.563314"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.530395"
                              y3="2.279266"
                              z3="-0.026521"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.090655"
                              y3="-0.970264"
                              z3="-0.983397"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.595422"
                              y3="0.138058"
                              z3="0.742176"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.270977"
                              y3="-1.943406"
                              z3="0.697929"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.530985"
                              y3="0.409983"
                              z3="1.029743"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.758995"
                              y3="-0.881087"
                              z3="2.418555"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.095952"
                              y3="0.313916"
                              z3="-1.510832"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.036036"
                              y3="-0.979136"
                              z3="-2.178285"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.201591"
                              y3="-1.735631"
                              z3="1.223867"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1197,-.5546,-1.1517;-2.3649,-.0116,-.766;-2.6249,-.012,.5888;-1.6343,-.6875,1.3491;-.5216,-1.1182,.6712;.7623,-.3874,-.7491;2.9667,-.8099,-.1171;.7156,1.7712,-.4872;1.5788,2.4061,.4509;.9281,2.6824,-1.5633;-.5304,2.2793,-.0265;4.0907,-.9703,-.9834;3.5954,.1381,.7422;3.271,-1.9434,.6979;-3.531,.41,1.0297;-1.759,-.8811,2.4186;-3.096,.3139,-1.5108;-1.036,-.9791,-2.1783;.2016,-1.7356,1.2239;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.115795"
                              y3="-0.56302"
                              z3="-1.149833"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.363111"
                              y3="-0.018877"
                              z3="-0.77538"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.628553"
                              y3="-0.004515"
                              z3="0.578702"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.640207"
                              y3="-0.669765"
                              z3="1.349792"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.524287"
                              y3="-1.107518"
                              z3="0.680808"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.764873"
                              y3="-0.391708"
                              z3="-0.741079"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.974468"
                              y3="-0.815137"
                              z3="-0.127025"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.709133"
                              y3="1.765335"
                              z3="-0.470708"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.570753"
                              y3="2.400155"
                              z3="0.468849"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.914916"
                              y3="2.683052"
                              z3="-1.542489"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.53908"
                              y3="2.263432"
                              z3="-0.005045"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.087845"
                              y3="-0.964067"
                              z3="-1.008733"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.610435"
                              y3="0.128262"
                              z3="0.731891"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.293407"
                              y3="-1.954092"
                              z3="0.674517"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.53678"
                              y3="0.421496"
                              z3="1.011355"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.768683"
                              y3="-0.85164"
                              z3="2.420861"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.091125"
                              y3="0.298488"
                              z3="-1.526715"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.022642"
                              y3="-0.991177"
                              z3="-2.17408"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.196892"
                              y3="-1.718585"
                              z3="1.243111"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1158,-.563,-1.1498;-2.3631,-.0189,-.7754;-2.6286,-.0045,.5787;-1.6402,-.6698,1.3498;-.5243,-1.1075,.6808;.7649,-.3917,-.7411;2.9745,-.8151,-.127;.7091,1.7653,-.4707;1.5708,2.4002,.4688;.9149,2.6831,-1.5425;-.5391,2.2634,-.005;4.0878,-.9641,-1.0087;3.6104,.1283,.7319;3.2934,-1.9541,.6745;-3.5368,.4215,1.0114;-1.7687,-.8516,2.4209;-3.0911,.2985,-1.5267;-1.0226,-.9912,-2.1741;.1969,-1.7186,1.2431;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.113204"
                              y3="-0.568438"
                              z3="-1.146489"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.364274"
                              y3="-0.027251"
                              z3="-0.781603"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.63663"
                              y3="-0.005639"
                              z3="0.571255"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.649208"
                              y3="-0.66132"
                              z3="1.35154"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.5280"
                              y3="-1.09954"
                              z3="0.691477"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.764937"
                              y3="-0.390886"
                              z3="-0.731038"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.978397"
                              y3="-0.817199"
                              z3="-0.134093"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.71123"
                              y3="1.766395"
                              z3="-0.459751"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.575129"
                              y3="2.400122"
                              z3="0.478493"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.915021"
                              y3="2.685431"
                              z3="-1.530765"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.535809"
                              y3="2.264182"
                              z3="0.009455"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.079596"
                              y3="-0.959943"
                              z3="-1.031839"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.625136"
                              y3="0.121294"
                              z3="0.722119"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.308692"
                              y3="-1.960784"
                              z3="0.656056"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.548635"
                              y3="0.419688"
                              z3="0.996568"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.782464"
                              y3="-0.836614"
                              z3="2.423149"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.088645"
                              y3="0.284564"
                              z3="-1.538742"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-1.010886"
                              y3="-0.999453"
                              z3="-2.168693"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.192073"
                              y3="-1.704488"
                              z3="1.261701"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1132,-.5684,-1.1465;-2.3643,-.0273,-.7816;-2.6366,-.0056,.5713;-1.6492,-.6613,1.3515;-.528,-1.0995,.6915;.7649,-.3909,-.731;2.9784,-.8172,-.1341;.7112,1.7664,-.4598;1.5751,2.4001,.4785;.915,2.6854,-1.5308;-.5358,2.2642,.0095;4.0796,-.9599,-1.0318;3.6251,.1213,.7221;3.3087,-1.9608,.6561;-3.5486,.4197,.9966;-1.7825,-.8366,2.4231;-3.0886,.2846,-1.5387;-1.0109,-.9995,-2.1687;.1921,-1.7045,1.2617;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.108232"
                              y3="-0.576934"
                              z3="-1.144314"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.360265"
                              y3="-0.032579"
                              z3="-0.790979"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.637498"
                              y3="0.00584"
                              z3="0.560975"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.653609"
                              y3="-0.640582"
                              z3="1.351363"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.530802"
                              y3="-1.088156"
                              z3="0.699198"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.769515"
                              y3="-0.397932"
                              z3="-0.72287"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.988667"
                              y3="-0.824356"
                              z3="-0.144169"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.699559"
                              y3="1.756774"
                              z3="-0.441526"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.557532"
                              y3="2.393349"
                              z3="0.500221"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.895679"
                              y3="2.682839"
                              z3="-1.507824"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.552344"
                              y3="2.240219"
                              z3="0.029698"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.079229"
                              y3="-0.954556"
                              z3="-1.056608"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.64183"
                              y3="0.110046"
                              z3="0.711526"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.334592"
                              y3="-1.972941"
                              z3="0.631873"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.55046"
                              y3="0.437322"
                              z3="0.978032"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.789708"
                              y3="-0.802687"
                              z3="2.424698"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.08202"
                              y3="0.270317"
                              z3="-1.554199"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.996604"
                              y3="-1.009264"
                              z3="-2.16499"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.1874"
                              y3="-1.686599"
                              z3="1.278696"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1082,-.5769,-1.1443;-2.3603,-.0326,-.791;-2.6375,.0058,.561;-1.6536,-.6406,1.3514;-.5308,-1.0882,.6992;.7695,-.3979,-.7229;2.9887,-.8244,-.1442;.6996,1.7568,-.4415;1.5575,2.3933,.5002;.8957,2.6828,-1.5078;-.5523,2.2402,.0297;4.0792,-.9546,-1.0566;3.6418,.11,.7115;3.3346,-1.9729,.6319;-3.5505,.4373,.978;-1.7897,-.8027,2.4247;-3.082,.2703,-1.5542;-.9966,-1.0093,-2.165;.1874,-1.6866,1.2787;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.106997"
                              y3="-0.581352"
                              z3="-1.140547"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.363244"
                              y3="-0.041717"
                              z3="-0.79519"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.647646"
                              y3="-0.000482"
                              z3="0.555411"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.664071"
                              y3="-0.638442"
                              z3="1.354075"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.535149"
                              y3="-1.083254"
                              z3="0.71082"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.767071"
                              y3="-0.393907"
                              z3="-0.711546"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.989112"
                              y3="-0.823678"
                              z3="-0.149201"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.708095"
                              y3="1.762664"
                              z3="-0.434752"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.571351"
                              y3="2.39676"
                              z3="0.503871"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.906362"
                              y3="2.686391"
                              z3="-1.502691"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.540107"
                              y3="2.25329"
                              z3="0.038939"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.067205"
                              y3="-0.947536"
                              z3="-1.077055"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.653162"
                              y3="0.104784"
                              z3="0.704578"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.344584"
                              y3="-1.977368"
                              z3="0.614696"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.564989"
                              y3="0.427857"
                              z3="0.965994"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.805824"
                              y3="-0.797344"
                              z3="2.427183"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.081083"
                              y3="0.257471"
                              z3="-1.563531"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.987106"
                              y3="-1.01696"
                              z3="-2.158876"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.181736"
                              y3="-1.677057"
                              z3="1.296621"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.107,-.5814,-1.1405;-2.3632,-.0417,-.7952;-2.6476,-.0005,.5554;-1.6641,-.6384,1.3541;-.5351,-1.0833,.7108;.7671,-.3939,-.7115;2.9891,-.8237,-.1492;.7081,1.7627,-.4348;1.5714,2.3968,.5039;.9064,2.6864,-1.5027;-.5401,2.2533,.0389;4.0672,-.9475,-1.0771;3.6532,.1048,.7046;3.3446,-1.9774,.6147;-3.565,.4279,.966;-1.8058,-.7973,2.4272;-3.0811,.2575,-1.5635;-.9871,-1.017,-2.1589;.1817,-1.6771,1.2966;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.101679"
                              y3="-0.584743"
                              z3="-1.135225"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.36061"
                              y3="-0.046275"
                              z3="-0.801139"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.652735"
                              y3="0.004374"
                              z3="0.547554"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.672303"
                              y3="-0.625059"
                              z3="1.354241"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.539528"
                              y3="-1.072242"
                              z3="0.718531"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.772033"
                              y3="-0.397861"
                              z3="-0.700205"/>
                        <atom elementType="P"
                              id="a7"
                              x3="2.99912"
                              y3="-0.830385"
                              z3="-0.157158"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.700779"
                              y3="1.757088"
                              z3="-0.420435"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.557799"
                              y3="2.39645"
                              z3="0.520335"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.895155"
                              y3="2.682606"
                              z3="-1.487476"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.551731"
                              y3="2.239021"
                              z3="0.050791"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.063416"
                              y3="-0.947723"
                              z3="-1.101518"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.674211"
                              y3="0.093776"
                              z3="0.6925"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.368138"
                              y3="-1.987394"
                              z3="0.595249"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.572783"
                              y3="0.43436"
                              z3="0.950366"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.817371"
                              y3="-0.775233"
                              z3="2.428162"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.075046"
                              y3="0.245926"
                              z3="-1.575305"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.971652"
                              y3="-1.018676"
                              z3="-2.153121"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.177245"
                              y3="-1.657891"
                              z3="1.312652"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.1017,-.5847,-1.1352;-2.3606,-.0463,-.8011;-2.6527,.0044,.5476;-1.6723,-.6251,1.3542;-.5395,-1.0722,.7185;.772,-.3979,-.7002;2.9991,-.8304,-.1572;.7008,1.7571,-.4204;1.5578,2.3965,.5203;.8952,2.6826,-1.4875;-.5517,2.239,.0508;4.0634,-.9477,-1.1015;3.6742,.0938,.6925;3.3681,-1.9874,.5952;-3.5728,.4344,.9504;-1.8174,-.7752,2.4282;-3.075,.2459,-1.5753;-.9717,-1.0187,-2.1531;.1772,-1.6579,1.3127;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.099745"
                              y3="-0.592638"
                              z3="-1.133271"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.361296"
                              y3="-0.055545"
                              z3="-0.807524"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.658775"
                              y3="0.003939"
                              z3="0.540099"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.679815"
                              y3="-0.616673"
                              z3="1.356155"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.543382"
                              y3="-1.066515"
                              z3="0.728977"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.770475"
                              y3="-0.396923"
                              z3="-0.689981"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.001299"
                              y3="-0.830965"
                              z3="-0.163926"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.703688"
                              y3="1.758602"
                              z3="-0.409229"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.562826"
                              y3="2.395529"
                              z3="0.531234"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.898105"
                              y3="2.685386"
                              z3="-1.475128"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.547249"
                              y3="2.242112"
                              z3="0.064562"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.052825"
                              y3="-0.941545"
                              z3="-1.123159"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.686491"
                              y3="0.08868"
                              z3="0.68252"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.380668"
                              y3="-1.991822"
                              z3="0.577122"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.581441"
                              y3="0.434788"
                              z3="0.935907"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.82968"
                              y3="-0.759802"
                              z3="2.430392"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.072411"
                              y3="0.231088"
                              z3="-1.586798"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.961468"
                              y3="-1.029453"
                              z3="-2.148742"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.171347"
                              y3="-1.648124"
                              z3="1.32959"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0997,-.5926,-1.1333;-2.3613,-.0555,-.8075;-2.6588,.0039,.5401;-1.6798,-.6167,1.3562;-.5434,-1.0665,.729;.7705,-.3969,-.69;3.0013,-.831,-.1639;.7037,1.7586,-.4092;1.5628,2.3955,.5312;.8981,2.6854,-1.4751;-.5472,2.2421,.0646;4.0528,-.9415,-1.1232;3.6865,.0887,.6825;3.3807,-1.9918,.5771;-3.5814,.4348,.9359;-1.8297,-.7598,2.4304;-3.0724,.2311,-1.5868;-.9615,-1.0295,-2.1487;.1713,-1.6481,1.3296;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.095096"
                              y3="-0.593602"
                              z3="-1.126296"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.360187"
                              y3="-0.060016"
                              z3="-0.8114"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.666841"
                              y3="0.003318"
                              z3="0.533897"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.690705"
                              y3="-0.61011"
                              z3="1.35699"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.54873"
                              y3="-1.057886"
                              z3="0.737776"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.773936"
                              y3="-0.397574"
                              z3="-0.676334"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.008775"
                              y3="-0.835587"
                              z3="-0.170032"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.702407"
                              y3="1.757861"
                              z3="-0.398642"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.558133"
                              y3="2.399645"
                              z3="0.541668"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.896336"
                              y3="2.682451"
                              z3="-1.466512"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.550617"
                              y3="2.23942"
                              z3="0.071599"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.044953"
                              y3="-0.942017"
                              z3="-1.14614"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.706867"
                              y3="0.08008"
                              z3="0.67007"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.400189"
                              y3="-1.99941"
                              z3="0.560063"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.593373"
                              y3="0.432529"
                              z3="0.922433"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.845224"
                              y3="-0.748588"
                              z3="2.431179"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.067152"
                              y3="0.221512"
                              z3="-1.596276"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.947023"
                              y3="-1.029699"
                              z3="-2.140802"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.165814"
                              y3="-1.632206"
                              z3="1.345559"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0951,-.5936,-1.1263;-2.3602,-.06,-.8114;-2.6668,.0033,.5339;-1.6907,-.6101,1.357;-.5487,-1.0579,.7378;.7739,-.3976,-.6763;3.0088,-.8356,-.17;.7024,1.7579,-.3986;1.5581,2.3996,.5417;.8963,2.6825,-1.4665;-.5506,2.2394,.0716;4.045,-.942,-1.1461;3.7069,.0801,.6701;3.4002,-1.9994,.5601;-3.5934,.4325,.9224;-1.8452,-.7486,2.4312;-3.0672,.2215,-1.5963;-.947,-1.0297,-2.1408;.1658,-1.6322,1.3456;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.09214"
                              y3="-0.601374"
                              z3="-1.124033"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.35895"
                              y3="-0.067447"
                              z3="-0.818299"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.670927"
                              y3="0.006082"
                              z3="0.525825"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.697564"
                              y3="-0.599665"
                              z3="1.358203"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.552811"
                              y3="-1.051966"
                              z3="0.747213"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.773912"
                              y3="-0.398815"
                              z3="-0.665487"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.012943"
                              y3="-0.83716"
                              z3="-0.17706"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.701341"
                              y3="1.756406"
                              z3="-0.385446"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.55688"
                              y3="2.397683"
                              z3="0.555349"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.89381"
                              y3="2.682749"
                              z3="-1.452003"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.551776"
                              y3="2.236179"
                              z3="0.086339"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.035548"
                              y3="-0.937984"
                              z3="-1.167876"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.721535"
                              y3="0.075844"
                              z3="0.657083"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.415335"
                              y3="-2.004041"
                              z3="0.541967"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.599311"
                              y3="0.437767"
                              z3="0.907131"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.856625"
                              y3="-0.729983"
                              z3="2.432752"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.06253"
                              y3="0.208204"
                              z3="-1.608276"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.935877"
                              y3="-1.04024"
                              z3="-2.136027"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.159665"
                              y3="-1.622117"
                              z3="1.361445"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0921,-.6014,-1.124;-2.359,-.0674,-.8183;-2.6709,.0061,.5258;-1.6976,-.5997,1.3582;-.5528,-1.052,.7472;.7739,-.3988,-.6655;3.0129,-.8372,-.1771;.7013,1.7564,-.3854;1.5569,2.3977,.5553;.8938,2.6827,-1.452;-.5518,2.2362,.0863;4.0355,-.938,-1.1679;3.7215,.0758,.6571;3.4153,-2.004,.542;-3.5993,.4378,.9071;-1.8566,-.73,2.4328;-3.0625,.2082,-1.6083;-.9359,-1.0402,-2.136;.1597,-1.6221,1.3614;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.087885"
                              y3="-0.603353"
                              z3="-1.117721"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.357313"
                              y3="-0.071269"
                              z3="-0.822326"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.677838"
                              y3="0.006174"
                              z3="0.519615"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.708034"
                              y3="-0.594068"
                              z3="1.359124"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.558417"
                              y3="-1.045792"
                              z3="0.756277"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.776392"
                              y3="-0.399927"
                              z3="-0.651423"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.019223"
                              y3="-0.840396"
                              z3="-0.18244"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.700825"
                              y3="1.755597"
                              z3="-0.375097"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.553994"
                              y3="2.400925"
                              z3="0.565112"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.893369"
                              y3="2.67942"
                              z3="-1.443803"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.55372"
                              y3="2.234598"
                              z3="0.093626"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.02586"
                              y3="-0.936564"
                              z3="-1.189797"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.740224"
                              y3="0.070385"
                              z3="0.643379"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.434229"
                              y3="-2.009555"
                              z3="0.525656"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.609369"
                              y3="0.437264"
                              z3="0.893877"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.872347"
                              y3="-0.720118"
                              z3="2.433395"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.056483"
                              y3="0.200254"
                              z3="-1.617621"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.92303"
                              y3="-1.042986"
                              z3="-2.128061"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.152778"
                              y3="-1.61047"
                              z3="1.377028"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0879,-.6034,-1.1177;-2.3573,-.0713,-.8223;-2.6778,.0062,.5196;-1.708,-.5941,1.3591;-.5584,-1.0458,.7563;.7764,-.3999,-.6514;3.0192,-.8404,-.1824;.7008,1.7556,-.3751;1.554,2.4009,.5651;.8934,2.6794,-1.4438;-.5537,2.2346,.0936;4.0259,-.9366,-1.1898;3.7402,.0704,.6434;3.4342,-2.0096,.5257;-3.6094,.4373,.8939;-1.8723,-.7201,2.4334;-3.0565,.2003,-1.6176;-.923,-1.043,-2.1281;.1528,-1.6105,1.377;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.08443"
                              y3="-0.610149"
                              z3="-1.11433"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.35506"
                              y3="-0.076922"
                              z3="-0.828831"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.681526"
                              y3="0.009993"
                              z3="0.511635"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.715434"
                              y3="-0.583906"
                              z3="1.359926"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.563035"
                              y3="-1.040286"
                              z3="0.76536"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.777314"
                              y3="-0.402605"
                              z3="-0.63953"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.024483"
                              y3="-0.842219"
                              z3="-0.189381"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.698503"
                              y3="1.75259"
                              z3="-0.361733"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.550421"
                              y3="2.398768"
                              z3="0.579011"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.88964"
                              y3="2.677418"
                              z3="-1.429768"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.556953"
                              y3="2.228897"
                              z3="0.107235"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.016459"
                              y3="-0.93293"
                              z3="-1.211608"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.755764"
                              y3="0.067154"
                              z3="0.628854"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.451692"
                              y3="-2.013422"
                              z3="0.50793"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.614683"
                              y3="0.443842"
                              z3="0.878593"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.8845"
                              y3="-0.702179"
                              z3="2.434345"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.050399"
                              y3="0.189257"
                              z3="-1.629269"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.911673"
                              y3="-1.052323"
                              z3="-2.122163"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.145875"
                              y3="-1.600859"
                              z3="1.392524"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0844,-.6101,-1.1143;-2.3551,-.0769,-.8288;-2.6815,.01,.5116;-1.7154,-.5839,1.3599;-.563,-1.0403,.7654;.7773,-.4026,-.6395;3.0245,-.8422,-.1894;.6985,1.7526,-.3617;1.5504,2.3988,.579;.8896,2.6774,-1.4298;-.557,2.2289,.1072;4.0165,-.9329,-1.2116;3.7558,.0672,.6289;3.4517,-2.0134,.5079;-3.6147,.4438,.8786;-1.8845,-.7022,2.4343;-3.0504,.1893,-1.6293;-.9117,-1.0523,-2.1222;.1459,-1.6009,1.3925;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.080345"
                              y3="-0.612759"
                              z3="-1.108742"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.35274"
                              y3="-0.07998"
                              z3="-0.832911"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.687155"
                              y3="0.011211"
                              z3="0.505448"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.725253"
                              y3="-0.578361"
                              z3="1.360718"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.56877"
                              y3="-1.035602"
                              z3="0.774176"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.779469"
                              y3="-0.404811"
                              z3="-0.62553"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.030404"
                              y3="-0.844588"
                              z3="-0.194469"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.697674"
                              y3="1.750719"
                              z3="-0.351199"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.547223"
                              y3="2.400563"
                              z3="0.589189"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.889209"
                              y3="2.673177"
                              z3="-1.421181"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.559243"
                              y3="2.22616"
                              z3="0.114649"/>
                        <atom elementType="H"
                              id="a12"
                              x3="4.005722"
                              y3="-0.931376"
                              z3="-1.23281"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.773344"
                              y3="0.064327"
                              z3="0.613628"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.470718"
                              y3="-2.016683"
                              z3="0.493143"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.622754"
                              y3="0.445533"
                              z3="0.865577"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.899705"
                              y3="-0.692367"
                              z3="2.434742"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.043599"
                              y3="0.182827"
                              z3="-1.638325"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.899867"
                              y3="-1.05598"
                              z3="-2.11475"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.138128"
                              y3="-1.591891"
                              z3="1.407447"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0803,-.6128,-1.1087;-2.3527,-.08,-.8329;-2.6872,.0112,.5054;-1.7253,-.5784,1.3607;-.5688,-1.0356,.7742;.7795,-.4048,-.6255;3.0304,-.8446,-.1945;.6977,1.7507,-.3512;1.5472,2.4006,.5892;.8892,2.6732,-1.4212;-.5592,2.2262,.1146;4.0057,-.9314,-1.2328;3.7733,.0643,.6136;3.4707,-2.0167,.4931;-3.6228,.4455,.8656;-1.8997,-.6924,2.4347;-3.0436,.1828,-1.6383;-.8999,-1.056,-2.1147;.1381,-1.5919,1.4074;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.076827"
                              y3="-0.618646"
                              z3="-1.105164"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.350015"
                              y3="-0.084347"
                              z3="-0.838828"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.690551"
                              y3="0.01518"
                              z3="0.497896"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.732857"
                              y3="-0.569183"
                              z3="1.36129"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.573752"
                              y3="-1.030889"
                              z3="0.782828"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.780661"
                              y3="-0.408433"
                              z3="-0.613264"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.035815"
                              y3="-0.846073"
                              z3="-0.20094"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.695305"
                              y3="1.746812"
                              z3="-0.338229"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.543051"
                              y3="2.397794"
                              z3="0.602988"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.886261"
                              y3="2.669796"
                              z3="-1.407811"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.56287"
                              y3="2.21967"
                              z3="0.126773"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.99546"
                              y3="-0.929206"
                              z3="-1.254011"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.788758"
                              y3="0.063595"
                              z3="0.596922"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.489001"
                              y3="-2.018384"
                              z3="0.477853"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.627565"
                              y3="0.452243"
                              z3="0.850966"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.912146"
                              y3="-0.676217"
                              z3="2.435236"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.036852"
                              y3="0.17405"
                              z3="-1.649092"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.889005"
                              y3="-1.064041"
                              z3="-2.108776"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.130586"
                              y3="-1.583602"
                              z3="1.422162"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0768,-.6186,-1.1052;-2.35,-.0843,-.8388;-2.6906,.0152,.4979;-1.7329,-.5692,1.3613;-.5738,-1.0309,.7828;.7807,-.4084,-.6133;3.0358,-.8461,-.2009;.6953,1.7468,-.3382;1.5431,2.3978,.603;.8863,2.6698,-1.4078;-.5629,2.2197,.1268;3.9955,-.9292,-1.254;3.7888,.0636,.5969;3.489,-2.0184,.4779;-3.6276,.4522,.851;-1.9121,-.6762,2.4352;-3.0369,.1741,-1.6491;-.889,-1.064,-2.1088;.1306,-1.5836,1.4222;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.072945"
                              y3="-0.621418"
                              z3="-1.100192"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.347225"
                              y3="-0.086541"
                              z3="-0.842758"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.69522"
                              y3="0.017147"
                              z3="0.491902"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.742136"
                              y3="-0.564002"
                              z3="1.361893"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.579592"
                              y3="-1.027397"
                              z3="0.791173"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.782573"
                              y3="-0.411625"
                              z3="-0.599587"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.041397"
                              y3="-0.847687"
                              z3="-0.205729"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.69439"
                              y3="1.743922"
                              z3="-0.327729"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.539677"
                              y3="2.398037"
                              z3="0.613551"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.886315"
                              y3="2.664774"
                              z3="-1.398943"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.565294"
                              y3="2.215968"
                              z3="0.133912"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.983853"
                              y3="-0.928748"
                              z3="-1.274251"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.805111"
                              y3="0.063881"
                              z3="0.579559"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.508125"
                              y3="-2.018971"
                              z3="0.465649"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.634135"
                              y3="0.455337"
                              z3="0.838469"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.926792"
                              y3="-0.667061"
                              z3="2.435324"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.02958"
                              y3="0.169302"
                              z3="-1.657608"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.878328"
                              y3="-1.067968"
                              z3="-2.101944"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.122266"
                              y3="-1.576829"
                              z3="1.436107"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0729,-.6214,-1.1002;-2.3472,-.0865,-.8428;-2.6952,.0171,.4919;-1.7421,-.564,1.3619;-.5796,-1.0274,.7912;.7826,-.4116,-.5996;3.0414,-.8477,-.2057;.6944,1.7439,-.3277;1.5397,2.398,.6136;.8863,2.6648,-1.3989;-.5653,2.216,.1339;3.9839,-.9287,-1.2743;3.8051,.0639,.5796;3.5081,-2.019,.4656;-3.6341,.4553,.8385;-1.9268,-.6671,2.4353;-3.0296,.1693,-1.6576;-.8783,-1.068,-2.1019;.1223,-1.5768,1.4361;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.069501"
                              y3="-0.626904"
                              z3="-1.096919"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.343964"
                              y3="-0.089664"
                              z3="-0.848323"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.697759"
                              y3="0.021894"
                              z3="0.484664"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.749303"
                              y3="-0.555248"
                              z3="1.362128"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.584677"
                              y3="-1.023621"
                              z3="0.799099"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.783907"
                              y3="-0.416394"
                              z3="-0.587644"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.046828"
                              y3="-0.848741"
                              z3="-0.211842"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.69159"
                              y3="1.738769"
                              z3="-0.314905"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.534686"
                              y3="2.393899"
                              z3="0.627627"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.883306"
                              y3="2.660312"
                              z3="-1.385513"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.569645"
                              y3="2.207836"
                              z3="0.145443"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.973122"
                              y3="-0.928438"
                              z3="-1.294442"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.8196"
                              y3="0.066211"
                              z3="0.560486"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.527044"
                              y3="-2.018061"
                              z3="0.45342"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.637625"
                              y3="0.463272"
                              z3="0.824544"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.938684"
                              y3="-0.651822"
                              z3="2.43534"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.022296"
                              y3="0.162624"
                              z3="-1.66763"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.868412"
                              y3="-1.075487"
                              z3="-2.096368"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.114243"
                              y3="-1.570318"
                              z3="1.449636"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0695,-.6269,-1.0969;-2.344,-.0897,-.8483;-2.6978,.0219,.4847;-1.7493,-.5552,1.3621;-.5847,-1.0236,.7991;.7839,-.4164,-.5876;3.0468,-.8487,-.2118;.6916,1.7388,-.3149;1.5347,2.3939,.6276;.8833,2.6603,-1.3855;-.5696,2.2078,.1454;3.9731,-.9284,-1.2944;3.8196,.0662,.5605;3.527,-2.0181,.4534;-3.6376,.4633,.8245;-1.9387,-.6518,2.4353;-3.0223,.1626,-1.6676;-.8684,-1.0755,-2.0964;.1142,-1.5703,1.4496;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.065926"
                              y3="-0.629163"
                              z3="-1.092432"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.340881"
                              y3="-0.090517"
                              z3="-0.851658"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.701711"
                              y3="0.024163"
                              z3="0.479329"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.758179"
                              y3="-0.551318"
                              z3="1.362593"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.590646"
                              y3="-1.021615"
                              z3="0.806763"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.785599"
                              y3="-0.420425"
                              z3="-0.574464"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.051978"
                              y3="-0.84956"
                              z3="-0.216026"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.69099"
                              y3="1.735121"
                              z3="-0.305165"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.531392"
                              y3="2.392942"
                              z3="0.637924"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.884866"
                              y3="2.654395"
                              z3="-1.377306"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.571845"
                              y3="2.203895"
                              z3="0.150974"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.960883"
                              y3="-0.929668"
                              z3="-1.313118"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.834228"
                              y3="0.070008"
                              z3="0.541072"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.546193"
                              y3="-2.015567"
                              z3="0.44484"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.643039"
                              y3="0.46693"
                              z3="0.813305"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.952866"
                              y3="-0.644876"
                              z3="2.435133"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.014781"
                              y3="0.160428"
                              z3="-1.675034"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.859231"
                              y3="-1.0789"
                              z3="-2.090139"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.105433"
                              y3="-1.566152"
                              z3="1.462207"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0659,-.6292,-1.0924;-2.3409,-.0905,-.8517;-2.7017,.0242,.4793;-1.7582,-.5513,1.3626;-.5906,-1.0216,.8068;.7856,-.4204,-.5745;3.052,-.8496,-.216;.691,1.7351,-.3052;1.5314,2.3929,.6379;.8849,2.6544,-1.3773;-.5718,2.2039,.151;3.9609,-.9297,-1.3131;3.8342,.07,.5411;3.5462,-2.0156,.4448;-3.643,.4669,.8133;-1.9529,-.6449,2.4351;-3.0148,.1604,-1.675;-.8592,-1.0789,-2.0901;.1054,-1.5662,1.4622;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.062994"
                              y3="-0.635717"
                              z3="-1.090859"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.336764"
                              y3="-0.092356"
                              z3="-0.857622"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.701415"
                              y3="0.03213"
                              z3="0.472037"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.762733"
                              y3="-0.540518"
                              z3="1.362075"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.594872"
                              y3="-1.018686"
                              z3="0.812901"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.786968"
                              y3="-0.427583"
                              z3="-0.56514"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.057476"
                              y3="-0.850232"
                              z3="-0.222227"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.685746"
                              y3="1.726866"
                              z3="-0.291715"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.523698"
                              y3="2.384534"
                              z3="0.653643"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.878099"
                              y3="2.649144"
                              z3="-1.361489"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.579117"
                              y3="2.18991"
                              z3="0.164549"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.952043"
                              y3="-0.93095"
                              z3="-1.330958"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.845426"
                              y3="0.076172"
                              z3="0.520446"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.565686"
                              y3="-2.011558"
                              z3="0.436292"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.642357"
                              y3="0.480124"
                              z3="0.800072"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.961187"
                              y3="-0.626678"
                              z3="2.434546"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.007292"
                              y3="0.155482"
                              z3="-1.68469"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.851603"
                              y3="-1.087934"
                              z3="-2.08629"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.097653"
                              y3="-1.562028"
                              z3="1.473228"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.063,-.6357,-1.0909;-2.3368,-.0924,-.8576;-2.7014,.0321,.472;-1.7627,-.5405,1.3621;-.5949,-1.0187,.8129;.787,-.4276,-.5651;3.0575,-.8502,-.2222;.6857,1.7269,-.2917;1.5237,2.3845,.6536;.8781,2.6491,-1.3615;-.5791,2.1899,.1645;3.952,-.931,-1.331;3.8454,.0762,.5204;3.5657,-2.0116,.4363;-3.6424,.4801,.8001;-1.9612,-.6267,2.4345;-3.0073,.1555,-1.6847;-.8516,-1.0879,-2.0863;.0977,-1.562,1.4732;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.062789"
                              y3="-0.632071"
                              z3="-1.088741"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.337442"
                              y3="-0.090425"
                              z3="-0.855407"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.705039"
                              y3="0.027714"
                              z3="0.473751"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.767166"
                              y3="-0.547286"
                              z3="1.363077"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.597368"
                              y3="-1.021075"
                              z3="0.814615"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.786646"
                              y3="-0.426407"
                              z3="-0.561094"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.057118"
                              y3="-0.849018"
                              z3="-0.220694"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.690551"
                              y3="1.729472"
                              z3="-0.294388"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.527985"
                              y3="2.388404"
                              z3="0.650581"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.888656"
                              y3="2.647029"
                              z3="-1.367204"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.574018"
                              y3="2.198517"
                              z3="0.156518"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.947348"
                              y3="-0.933108"
                              z3="-1.332592"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.847872"
                              y3="0.079462"
                              z3="0.516393"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.567652"
                              y3="-2.008244"
                              z3="0.439783"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.647324"
                              y3="0.472861"
                              z3="0.801792"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.967434"
                              y3="-0.637611"
                              z3="2.434876"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.006709"
                              y3="0.160014"
                              z3="-1.682724"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.851209"
                              y3="-1.083539"
                              z3="-2.084511"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.095129"
                              y3="-1.564569"
                              z3="1.47477"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0628,-.6321,-1.0887;-2.3374,-.0904,-.8554;-2.705,.0277,.4738;-1.7672,-.5473,1.3631;-.5974,-1.0211,.8146;.7866,-.4264,-.5611;3.0571,-.849,-.2207;.6906,1.7295,-.2944;1.528,2.3884,.6506;.8887,2.647,-1.3672;-.574,2.1985,.1565;3.9473,-.9331,-1.3326;3.8479,.0795,.5164;3.5677,-2.0082,.4398;-3.6473,.4729,.8018;-1.9674,-.6376,2.4349;-3.0067,.16,-1.6827;-.8512,-1.0835,-2.0845;.0951,-1.5646,1.4748;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.062305"
                              y3="-0.634799"
                              z3="-1.090042"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.335808"
                              y3="-0.090358"
                              z3="-0.857894"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.70266"
                              y3="0.032637"
                              z3="0.471304"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.765913"
                              y3="-0.541889"
                              z3="1.362069"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.597526"
                              y3="-1.020158"
                              z3="0.814224"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.787229"
                              y3="-0.429963"
                              z3="-0.561422"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.059124"
                              y3="-0.848839"
                              z3="-0.223027"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.686131"
                              y3="1.724446"
                              z3="-0.289023"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.520947"
                              y3="2.381001"
                              z3="0.659862"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.883958"
                              y3="2.646608"
                              z3="-1.357911"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.580148"
                              y3="2.188716"
                              z3="0.161981"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.946088"
                              y3="-0.940621"
                              z3="-1.336953"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.851351"
                              y3="0.0857"
                              z3="0.504776"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.572709"
                              y3="-2.002893"
                              z3="0.444141"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.643781"
                              y3="0.480971"
                              z3="0.798356"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.965953"
                              y3="-0.628798"
                              z3="2.434192"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.004765"
                              y3="0.159262"
                              z3="-1.685709"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.850569"
                              y3="-1.087298"
                              z3="-2.085244"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.094351"
                              y3="-1.563607"
                              z3="1.47512"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0623,-.6348,-1.09;-2.3358,-.0904,-.8579;-2.7027,.0326,.4713;-1.7659,-.5419,1.3621;-.5975,-1.0202,.8142;.7872,-.43,-.5614;3.0591,-.8488,-.223;.6861,1.7244,-.289;1.5209,2.381,.6599;.884,2.6466,-1.3579;-.5801,2.1887,.162;3.9461,-.9406,-1.337;3.8514,.0857,.5048;3.5727,-2.0029,.4441;-3.6438,.481,.7984;-1.966,-.6288,2.4342;-3.0048,.1593,-1.6857;-.8506,-1.0873,-2.0852;.0944,-1.5636,1.4751;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.062918"
                              y3="-0.633867"
                              z3="-1.090109"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.336709"
                              y3="-0.090446"
                              z3="-0.856579"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.702696"
                              y3="0.030969"
                              z3="0.472861"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.76484"
                              y3="-0.543725"
                              z3="1.362372"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.596388"
                              y3="-1.020471"
                              z3="0.813424"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.786932"
                              y3="-0.428155"
                              z3="-0.563287"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.057705"
                              y3="-0.849381"
                              z3="-0.22152"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.687469"
                              y3="1.726799"
                              z3="-0.292592"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.524472"
                              y3="2.384692"
                              z3="0.653464"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.883239"
                              y3="2.647335"
                              z3="-1.363266"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.577676"
                              y3="2.192221"
                              z3="0.160439"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.949416"
                              y3="-0.934192"
                              z3="-1.332206"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.846906"
                              y3="0.080625"
                              z3="0.515311"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.568363"
                              y3="-2.007485"
                              z3="0.440822"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.643958"
                              y3="0.478198"
                              z3="0.801013"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.96423"
                              y3="-0.632006"
                              z3="2.434504"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.006494"
                              y3="0.159309"
                              z3="-1.68368"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.851995"
                              y3="-1.08593"
                              z3="-2.085715"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.095862"
                              y3="-1.564367"
                              z3="1.473542"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0629,-.6339,-1.0901;-2.3367,-.0904,-.8566;-2.7027,.031,.4729;-1.7648,-.5437,1.3624;-.5964,-1.0205,.8134;.7869,-.4282,-.5633;3.0577,-.8494,-.2215;.6875,1.7268,-.2926;1.5245,2.3847,.6535;.8832,2.6473,-1.3633;-.5777,2.1922,.1604;3.9494,-.9342,-1.3322;3.8469,.0806,.5153;3.5684,-2.0075,.4408;-3.644,.4782,.801;-1.9642,-.632,2.4345;-3.0065,.1593,-1.6837;-.852,-1.0859,-2.0857;.0959,-1.5644,1.4735;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.063425"
                              y3="-0.633793"
                              z3="-1.090466"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.337088"
                              y3="-0.090332"
                              z3="-0.856217"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.70237"
                              y3="0.030843"
                              z3="0.473447"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.764074"
                              y3="-0.544043"
                              z3="1.362482"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.595899"
                              y3="-1.020767"
                              z3="0.812947"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.786621"
                              y3="-0.428074"
                              z3="-0.56451"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.057119"
                              y3="-0.849286"
                              z3="-0.221134"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.687787"
                              y3="1.726959"
                              z3="-0.293875"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.525505"
                              y3="2.384735"
                              z3="0.651632"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.883165"
                              y3="2.647354"
                              z3="-1.364745"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.576991"
                              y3="2.19272"
                              z3="0.159845"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.9512"
                              y3="-0.931428"
                              z3="-1.330128"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.844357"
                              y3="0.079553"
                              z3="0.519262"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.566924"
                              y3="-2.008529"
                              z3="0.439868"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.643477"
                              y3="0.478002"
                              z3="0.80214"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.962996"
                              y3="-0.632509"
                              z3="2.434686"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.007296"
                              y3="0.15956"
                              z3="-1.682934"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.853101"
                              y3="-1.085922"
                              z3="-2.086176"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.0965"
                              y3="-1.564925"
                              z3="1.472678"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0634,-.6338,-1.0905;-2.3371,-.0903,-.8562;-2.7024,.0308,.4734;-1.7641,-.544,1.3625;-.5959,-1.0208,.8129;.7866,-.4281,-.5645;3.0571,-.8493,-.2211;.6878,1.727,-.2939;1.5255,2.3847,.6516;.8832,2.6474,-1.3647;-.577,2.1927,.1598;3.9512,-.9314,-1.3301;3.8444,.0796,.5193;3.5669,-2.0085,.4399;-3.6435,.478,.8021;-1.963,-.6325,2.4347;-3.0073,.1596,-1.6829;-.8531,-1.0859,-2.0862;.0965,-1.5649,1.4727;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.063521"
                              y3="-0.633824"
                              z3="-1.090639"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.336918"
                              y3="-0.089811"
                              z3="-0.856089"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.701951"
                              y3="0.031428"
                              z3="0.473616"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.763802"
                              y3="-0.543981"
                              z3="1.36244"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.59589"
                              y3="-1.021152"
                              z3="0.81275"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.786654"
                              y3="-0.428665"
                              z3="-0.564828"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.057182"
                              y3="-0.849252"
                              z3="-0.22092"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.687488"
                              y3="1.726339"
                              z3="-0.294197"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.525307"
                              y3="2.384309"
                              z3="0.651093"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.882448"
                              y3="2.646748"
                              z3="-1.365131"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.5773"
                              y3="2.191786"
                              z3="0.159807"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.951771"
                              y3="-0.930361"
                              z3="-1.329579"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.843506"
                              y3="0.079824"
                              z3="0.520145"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.567481"
                              y3="-2.008387"
                              z3="0.439895"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.642804"
                              y3="0.478987"
                              z3="0.802489"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.962676"
                              y3="-0.632526"
                              z3="2.434648"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.00717"
                              y3="0.160428"
                              z3="-1.682668"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.85367"
                              y3="-1.086076"
                              z3="-2.086389"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.096324"
                              y3="-1.565693"
                              z3="1.472357"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0635,-.6338,-1.0906;-2.3369,-.0898,-.8561;-2.702,.0314,.4736;-1.7638,-.544,1.3624;-.5959,-1.0212,.8127;.7867,-.4287,-.5648;3.0572,-.8493,-.2209;.6875,1.7263,-.2942;1.5253,2.3843,.6511;.8824,2.6467,-1.3651;-.5773,2.1918,.1598;3.9518,-.9304,-1.3296;3.8435,.0798,.5201;3.5675,-2.0084,.4399;-3.6428,.479,.8025;-1.9627,-.6325,2.4346;-3.0072,.1604,-1.6827;-.8537,-1.0861,-2.0864;.0963,-1.5657,1.4724;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="C"
                              id="a1"
                              x3="-1.063779"
                              y3="-0.633906"
                              z3="-1.090787"/>
                        <atom elementType="C"
                              id="a2"
                              x3="-2.337053"
                              y3="-0.089707"
                              z3="-0.856029"/>
                        <atom elementType="C"
                              id="a3"
                              x3="-2.701842"
                              y3="0.031556"
                              z3="0.473771"/>
                        <atom elementType="C"
                              id="a4"
                              x3="-1.763616"
                              y3="-0.543964"
                              z3="1.362515"/>
                        <atom elementType="C"
                              id="a5"
                              x3="-0.595856"
                              y3="-1.021325"
                              z3="0.812676"/>
                        <atom elementType="Rh"
                              id="a6"
                              x3="0.786465"
                              y3="-0.428987"
                              z3="-0.565193"/>
                        <atom elementType="P"
                              id="a7"
                              x3="3.057026"
                              y3="-0.849057"
                              z3="-0.220907"/>
                        <atom elementType="P"
                              id="a8"
                              x3="0.687636"
                              y3="1.726027"
                              z3="-0.294528"/>
                        <atom elementType="H"
                              id="a9"
                              x3="1.525575"
                              y3="2.383705"
                              z3="0.650855"/>
                        <atom elementType="H"
                              id="a10"
                              x3="0.882863"
                              y3="2.646472"
                              z3="-1.365384"/>
                        <atom elementType="H"
                              id="a11"
                              x3="-0.577078"
                              y3="2.191702"
                              z3="0.15945"/>
                        <atom elementType="H"
                              id="a12"
                              x3="3.952354"
                              y3="-0.929086"
                              z3="-1.329058"/>
                        <atom elementType="H"
                              id="a13"
                              x3="3.84245"
                              y3="0.079909"
                              z3="0.521249"/>
                        <atom elementType="H"
                              id="a14"
                              x3="3.567442"
                              y3="-2.008402"
                              z3="0.439454"/>
                        <atom elementType="H"
                              id="a15"
                              x3="-3.6426"
                              y3="0.47921"
                              z3="0.802787"/>
                        <atom elementType="H"
                              id="a16"
                              x3="-1.962335"
                              y3="-0.632424"
                              z3="2.43476"/>
                        <atom elementType="H"
                              id="a17"
                              x3="-3.007413"
                              y3="0.160616"
                              z3="-1.682494"/>
                        <atom elementType="H"
                              id="a18"
                              x3="-0.854166"
                              y3="-1.086286"
                              z3="-2.086529"/>
                        <atom elementType="H"
                              id="a19"
                              x3="0.096387"
                              y3="-1.565931"
                              z3="1.472191"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a18" order="S"/>
                        <bond atomRefs2="a1 a2" order="S"/>
                        <bond atomRefs2="a1 a6" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a2 a17" order="S"/>
                        <bond atomRefs2="a3 a4" order="S"/>
                        <bond atomRefs2="a3 a15" order="S"/>
                        <bond atomRefs2="a4 a5" order="S"/>
                        <bond atomRefs2="a4 a16" order="S"/>
                        <bond atomRefs2="a5 a6" order="S"/>
                        <bond atomRefs2="a5 a19" order="S"/>
                        <bond atomRefs2="a6 a8" order="S"/>
                        <bond atomRefs2="a6 a7" order="S"/>
                        <bond atomRefs2="a7 a14" order="S"/>
                        <bond atomRefs2="a7 a12" order="S"/>
                        <bond atomRefs2="a7 a13" order="S"/>
                        <bond atomRefs2="a8 a11" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a9" order="S"/>
                     </bondArray>
                     <formula concise="C5H11P2Rh">
                        <atomArray count="5 11 2 1" elementType="C H P Rh"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">224.906522</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0638,-.6339,-1.0908;-2.3371,-.0897,-.856;-2.7018,.0316,.4738;-1.7636,-.544,1.3625;-.5959,-1.0213,.8127;.7865,-.429,-.5652;3.057,-.8491,-.2209;.6876,1.726,-.2945;1.5256,2.3837,.6509;.8829,2.6465,-1.3654;-.5771,2.1917,.1595;3.9524,-.9291,-1.3291;3.8424,.0799,.5212;3.5674,-2.0084,.4395;-3.6426,.4792,.8028;-1.9623,-.6324,2.4348;-3.0074,.1606,-1.6825;-.8542,-1.0863,-2.0865;.0964,-1.5659,1.4722;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.465891859155</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.466724565741</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.467461047777</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.468173621296</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.468853077451</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.469491197218</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.470080989826</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.470617762541</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.471101109255</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.471532585718</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.471916655140</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.472255852963</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.472546026470</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.472795677842</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.473010172137</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.473203416562</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.473357408456</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.473517491448</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.473632989439</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.473753077253</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.473860998310</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.473951561588</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474042347768</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474115446006</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474184538759</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474238479874</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474285403554</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474319650990</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474345417767</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474360017470</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474364859856</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474365321915</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474364846383</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474365890939</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474366120007</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474366204355</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474366329395</scalar>
               </module>
               <module cmlx:templateRef="loewdin">
                  <array dataType="xsd:integer" dictRef="cc:serial" size="19">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18</array>
                  <array dataType="xsd:string" dictRef="cc:elementType" size="19">C C C C C Rh P P H H H H H H H H H H H</array>
                  <array dataType="xsd:double" dictRef="x:charge" size="19">0.054049 -0.072702 -0.017620 -0.072771 0.009685 -1.131900 0.585102 0.671855 -0.041331 -0.035745 -0.032093 -0.049065 -0.040396 -0.042856 0.027720 0.029698 0.037183 0.065892 0.055297</array>
               </module>
               <module cmlx:templateRef="mayer">
                  <module cmlx:templateRef="mayercharges">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="19">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="19">C C C C C Rh P P H H H H H H H H H H H</array>
                     <array dataType="xsd:double" dictRef="o:na" size="19">6.1274 5.9872 6.0320 5.9977 6.1698 17.2638 14.8847 14.8569 0.9824 0.9749 0.9666 0.9872 0.9836 0.9867 0.9881 0.9833 0.9689 0.9126 0.9464</array>
                     <array dataType="xsd:double" dictRef="o:za" size="19">6.0000 6.0000 6.0000 6.0000 6.0000 17.0000 15.0000 15.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000</array>
                     <array dataType="xsd:double" dictRef="o:qa" size="19">-0.1274 0.0128 -0.0320 0.0023 -0.1698 -0.2638 0.1153 0.1431 0.0176 0.0251 0.0334 0.0128 0.0164 0.0133 0.0119 0.0167 0.0311 0.0874 0.0536</array>
                     <array dataType="xsd:double" dictRef="o:va" size="19">3.8616 3.8112 3.9644 3.8742 3.9161 3.7220 3.6257 3.9180 0.9628 0.9571 0.9638 0.9614 0.9662 0.9676 0.9835 0.9837 0.9858 0.9708 0.9739</array>
                     <array dataType="xsd:double" dictRef="o:bva" size="19">3.8616 3.8112 3.9644 3.8742 3.9161 3.7220 3.6257 3.9180 0.9628 0.9571 0.9638 0.9614 0.9662 0.9676 0.9835 0.9837 0.9858 0.9708 0.9739</array>
                     <array dataType="xsd:double" dictRef="o:fa" size="19">0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000</array>
                  </module>
                  <module cmlx:templateRef="bonds">
                     <array dataType="xsd:double" dictRef="x:distance" size="21">1.1533 0.5468 1.0120 0.1111 0.8823 1.6198 0.9584 1.1726 0.9841 1.6510 0.9660 0.6870 0.8948 0.6876 0.9295 0.9256 0.9426 0.9310 0.9286 0.9178 0.9231</array>
                     <matrix cols="2" dataType="xsd:integer" dictRef="x:serial" rows="21">0 1 0 4 0 5 0 7 0 17 1 2 1 16 2 3 2 14 3 4 3 15 4 5 4 18 5 6 5 7 6 11 6 12 6 13 7 8 7 9 7 10</matrix>
                  </module>
               </module>
               <module cmlx:templateRef="mullikenpopulation">
                  <module cmlx:templateRef="atomiccharges">
                     <scalar dataType="xsd:double" dictRef="x:chargesum">0.0000000</scalar>
                     <array dataType="xsd:integer" dictRef="cc:serial" size="19">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="19">C C C C C Rh P P H H H H H H H H H H H</array>
                     <array dataType="xsd:double" dictRef="x:charge" size="19">-0.127427 0.012843 -0.031982 0.002317 -0.169773 -0.263814 0.115320 0.143139 0.017623 0.025137 0.033395 0.012834 0.016357 0.013323 0.011916 0.016705 0.031060 0.087404 0.053622</array>
                  </module>
               </module>
               <module cmlx:templateRef="orbitalenergies">
                  <list cmlx:templateRef="orbital">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="192">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191</array>
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                  </module>
               </property>
               <property dictRef="cc:irspectrum">
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                             dataType="xsd:double"
                             dictRef="cc:displacement"
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                  </module>
               </property>
            </propertyList>
            <molecule id="molecule">
               <atomArray>
                  <atom elementType="C"
                        id="a1"
                        x3="-1.063847"
                        y3="-0.633977"
                        z3="-1.090918"/>
                  <atom elementType="C"
                        id="a2"
                        x3="-2.336899"
                        y3="-0.089311"
                        z3="-0.85594"/>
                  <atom elementType="C"
                        id="a3"
                        x3="-2.70149"
                        y3="0.032068"
                        z3="0.473889"/>
                  <atom elementType="C"
                        id="a4"
                        x3="-1.763395"
                        y3="-0.543847"
                        z3="1.36249"/>
                  <atom elementType="C"
                        id="a5"
                        x3="-0.595851"
                        y3="-1.021607"
                        z3="0.812546"/>
                  <atom elementType="Rh"
                        id="a6"
                        x3="0.786498"
                        y3="-0.429492"
                        z3="-0.565417"/>
                  <atom elementType="P"
                        id="a7"
                        x3="3.057099"
                        y3="-0.849027"
                        z3="-0.220749"/>
                  <atom elementType="P"
                        id="a8"
                        x3="0.687361"
                        y3="1.725495"
                        z3="-0.294763"/>
                  <atom elementType="H"
                        id="a9"
                        x3="1.52534"
                        y3="2.383343"
                        z3="0.650471"/>
                  <atom elementType="H"
                        id="a10"
                        x3="0.882262"
                        y3="2.645953"
                        z3="-1.365666"/>
                  <atom elementType="H"
                        id="a11"
                        x3="-0.577383"
                        y3="2.190893"
                        z3="0.159407"/>
                  <atom elementType="H"
                        id="a12"
                        x3="3.952816"
                        y3="-0.928055"
                        z3="-1.328655"/>
                  <atom elementType="H"
                        id="a13"
                        x3="3.841782"
                        y3="0.080028"
                        z3="0.522075"/>
                  <atom elementType="H"
                        id="a14"
                        x3="3.56794"
                        y3="-2.008383"
                        z3="0.439271"/>
                  <atom elementType="H"
                        id="a15"
                        x3="-3.642037"
                        y3="0.480074"
                        z3="0.803027"/>
                  <atom elementType="H"
                        id="a16"
                        x3="-1.96208"
                        y3="-0.632328"
                        z3="2.434741"/>
                  <atom elementType="H"
                        id="a17"
                        x3="-3.007288"
                        y3="0.16127"
                        z3="-1.682306"/>
                  <atom elementType="H"
                        id="a18"
                        x3="-0.854604"
                        y3="-1.086466"
                        z3="-2.086684"/>
                  <atom elementType="H"
                        id="a19"
                        x3="0.096234"
                        y3="-1.566512"
                        z3="1.471981"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a18" order="S"/>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a1 a6" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a2 a17" order="S"/>
                  <bond atomRefs2="a3 a4" order="S"/>
                  <bond atomRefs2="a3 a15" order="S"/>
                  <bond atomRefs2="a4 a5" order="S"/>
                  <bond atomRefs2="a4 a16" order="S"/>
                  <bond atomRefs2="a5 a6" order="S"/>
                  <bond atomRefs2="a5 a19" order="S"/>
                  <bond atomRefs2="a6 a8" order="S"/>
                  <bond atomRefs2="a6 a7" order="S"/>
                  <bond atomRefs2="a7 a14" order="S"/>
                  <bond atomRefs2="a7 a12" order="S"/>
                  <bond atomRefs2="a7 a13" order="S"/>
                  <bond atomRefs2="a8 a11" order="S"/>
                  <bond atomRefs2="a8 a10" order="S"/>
                  <bond atomRefs2="a8 a9" order="S"/>
               </bondArray>
               <formula concise="C5H11P2Rh">
                  <atomArray count="5 11 2 1" elementType="C H P Rh"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">224.906522</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1/C5H5.2H3P.Rh/c1-3-5-4-2;;;/h1-5H;2*1H3;/rC5H11P2Rh/c6-8(7)4-2-1-3-5-8/h1-5H,6-7H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1,5,2,4,3;7;8;6/E:(1,2)(3,4);;;/CRV:1.2,2.2,3.3,4.3,5.3;;;/rA:19nC3C3C3C3C3RhP4P4HHHHHHHHHHH/rB:s1;s2;s3;s4;s1s5;s6;s6;s8;s8;s8;s7;s7;s7;s3;s4;s2;s1;s5;/rC:-1.0638,-.634,-1.0909;-2.3369,-.0893,-.8559;-2.7015,.0321,.4739;-1.7634,-.5438,1.3625;-.5959,-1.0216,.8125;.7865,-.4295,-.5654;3.0571,-.849,-.2207;.6874,1.7255,-.2948;1.5253,2.3833,.6505;.8823,2.646,-1.3657;-.5774,2.1909,.1594;3.9528,-.9281,-1.3287;3.8418,.08,.5221;3.5679,-2.0084,.4393;-3.642,.4801,.803;-1.9621,-.6323,2.4347;-3.0073,.1613,-1.6823;-.8546,-1.0865,-2.0867;.0962,-1.5665,1.472;/R:/0/N:3,2,4,1,5,7,8,6/E:(2,3)(4,5)(6,7)/CRV:1.3,2.3,3.3,4.3,5.3,6.4,7.4</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="totalenergy" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="cc:totalener" units="nonsi:hartree">-989.44387890</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:nucrepener" units="nonsi:hartree">631.03750319</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:electener" units="nonsi:hartree">-1620.48138209</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="cc:oneelecener"
                          units="nonsi:hartree">-2658.10535991</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:twoeener" units="nonsi:hartree">1037.62397782</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="cc:potentialEnergy"
                          units="nonsi:hartree">-1904.93572589</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="cc:kineticenergy"
                          units="nonsi:hartree">915.49184700</scalar>
                  <scalar dataType="xsd:double" dictRef="o:vircoeff">2.08077847</scalar>
                  <list id="dftcomponents">
                     <scalar dataType="xsd:double" dictRef="cc:alphae">44.000000094274</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:betae">44.000000094274</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:totale">88.000000188548</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="o:exchangeener"
                             units="nonsi:hartree">-63.904992511435</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="o:correlationener"
                             units="nonsi:hartree">-3.225309725083</scalar>
                     <scalar dataType="xsd:double" dictRef="o:xcener" units="nonsi:hartree">-67.130302236518</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022012963</scalar>
               </module>
               <module cmlx:templateRef="thermochemistry" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="cc:temp" units="si:k">298.15</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:press" units="nonsi:atm">1.00</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:totalmass">236.00</scalar>
               </module>
               <module cmlx:templateRef="innerenergy" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="contributions">
                     <scalar dataType="xsd:double" dictRef="o:electronic" units="nonsi:hartree">-989.46589186</scalar>
                     <scalar dataType="xsd:double" dictRef="o:zeropoint" units="nonsi:hartree">0.13419634</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="o:thermalvibcorrection"
                             units="nonsi:hartree">0.00783881</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="o:thermalrotcorrection"
                             units="nonsi:hartree">0.00141627</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="o:thermaltrasncorrection"
                             units="nonsi:hartree">0.00141627</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="o:thermaltotal"
                             units="nonsi:hartree">-989.32102416</scalar>
                  </module>
                  <module cmlx:templateRef="corrections">
                     <scalar dataType="xsd:double" dictRef="o:thermalcorr" units="nonsi:hartree">0.01067136</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="o:nonthermalcorr"
                             units="nonsi:hartree">0.13419634</scalar>
                     <scalar dataType="xsd:double" dictRef="o:totalcorr" units="nonsi:hartree">0.14486770</scalar>
                  </module>
               </module>
               <module cmlx:templateRef="enthalpy" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:totalfree" units="nonsi:hartree">-989.32102416</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="o:thermalcorrenthalpy"
                          units="nonsi:hartree">0.00094421</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="o:totalenthalpy"
                          units="nonsi:hartree">-989.32007995</scalar>
               </module>
               <module cmlx:templateRef="entropy" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="cc:elect" units="nonsi:hartree">0.00000000</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:vibrat" units="nonsi:hartree">0.01354046</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:rotat" units="nonsi:hartree">0.01444722</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:transl" units="nonsi:hartree">0.02008735</scalar>
                  <scalar dataType="xsd:double" dictRef="o:total" units="nonsi:hartree">0.04807502</scalar>
               </module>
               <module cmlx:templateRef="gibbs" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double"
                          dictRef="o:totalenthalpy"
                          units="nonsi:hartree">-989.32007995</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="o:totalentropycorr"
                          units="nonsi:hartree">-0.04807502</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="o:gibbsenthalpy"
                          units="nonsi:hartree">-989.36815497</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="o:gibbsminuselec"
                          units="nonsi:hartree">0.09773689</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022040806</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022075312</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022115901</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022162996</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022216226</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022274175</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022335572</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022398190</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022461872</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022527281</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022588608</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022630263</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022656136</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022668755</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022678369</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022662819</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022678605</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022651066</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022635568</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022628973</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022594999</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022594785</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022568557</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022567491</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022549651</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022550023</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022538754</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022543953</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022537144</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022559004</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022539959</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022559901</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022553901</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022555158</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022557595</scalar>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022559132</scalar>
               </module>
               <module cmlx:templateRef="orbitalenergies" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="orbital">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="192">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191</array>
                     <array dataType="xsd:double" dictRef="cc:occup" size="192">2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000</array>
                     <array dataType="xsd:double"
                            dictRef="cc:energy"
                            size="192"
                            units="nonsi:electronvolt">-2101.9453 -2101.5219 -278.8743 -278.7127 -278.1088 -277.8783 -277.7654 -181.0232 -180.6411 -130.4100 -130.4005 -130.3619 -130.0232 -130.0180 -129.9666 -88.3773 -54.5472 -54.3191 -53.7769 -22.6760 -19.5467 -18.7462 -18.4514 -18.1764 -15.2701 -13.9042 -13.7765 -11.7825 -11.5215 -11.3109 -11.2192 -11.1514 -10.6870 -10.4098 -10.2944 -10.1179 -9.4932 -9.1243 -7.8070 -7.0159 -6.7323 -6.1132 -5.3340 -5.1121 -1.6395 -0.5602 0.4240 0.8482 1.2709 1.3247 1.4969 1.7669 1.8762 1.9998 2.1823 2.8554 2.9779 3.7871 4.0461 4.4002 4.8496 5.1075 5.2855 5.5409 7.3288 8.1132 8.5730 8.9063 9.1449 9.1910 9.7300 9.9613 10.3788 10.5252 10.8204 11.2647 11.7514 12.0773 12.3221 12.9670 13.0570 13.1783 13.7378 14.1214 14.6696 15.1034 15.2661 15.7161 15.9939 16.3792 16.7440 16.9144 17.2719 17.7063 18.0453 18.3249 18.8847 18.9243 19.1212 19.2737 19.3899 19.8140 20.0676 20.1252 20.4090 21.2508 21.6143 21.9559 22.3951 22.5915 23.3448 23.7123 24.4153 25.0814 25.3827 26.0785 26.7977 27.0728 27.6420 27.7401 29.1302 29.6502 30.9822 32.5112 33.7300 34.0458 35.9851 36.8322 37.6115 37.7983 39.6967 40.6318 40.9393 41.1931 41.2884 43.6186 44.6110 45.5548 45.5744 45.7961 46.3757 46.4743 46.5548 47.1134 47.3838 48.0608 48.5276 48.6377 49.9192 50.0676 50.7391 51.8519 52.1065 52.2943 53.7413 54.7832 55.0911 56.0439 56.5034 56.9496 57.4666 58.4164 58.8018 58.8511 59.3442 59.4085 60.0296 60.3146 60.6145 60.9222 61.1837 61.5719 61.7849 62.7142 63.6626 64.9703 65.6269 66.9467 67.6996 68.8438 69.3293 70.9314 72.1350 74.6994 75.5384 76.3159 77.7124 79.2471 85.3441 86.7931 95.0197 1327.4233</array>
                  </list>
               </module>
               <module cmlx:templateRef="mullikenpopulation" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="atomiccharges">
                     <scalar dataType="xsd:double" dictRef="x:chargesum">0.0000000</scalar>
                     <array dataType="xsd:integer" dictRef="cc:serial" size="19">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="19">C C C C C Rh P P H H H H H H H H H H H</array>
                     <array dataType="xsd:double" dictRef="x:charge" size="19">-0.106841 0.004870 -0.039810 -0.012450 -0.142596 -0.332491 0.082570 0.195514 0.018162 0.023743 0.048350 0.022734 0.018762 0.020226 0.009833 0.016772 0.023426 0.080749 0.068476</array>
                  </module>
               </module>
               <module cmlx:templateRef="loewdin" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:integer" dictRef="cc:serial" size="19">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18</array>
                  <array dataType="xsd:string" dictRef="cc:elementType" size="19">C C C C C Rh P P H H H H H H H H H H H</array>
                  <array dataType="xsd:double" dictRef="x:charge" size="19">0.027770 -0.081189 -0.030519 -0.085542 0.031123 -1.139534 0.566508 0.713981 -0.039528 -0.038682 -0.020356 -0.038592 -0.040939 -0.044946 0.026724 0.029260 0.033283 0.070396 0.060781</array>
               </module>
               <module cmlx:templateRef="mayer" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="mayercharges">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="19">0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="19">C C C C C Rh P P H H H H H H H H H H H</array>
                     <array dataType="xsd:double" dictRef="o:na" size="19">6.1068 5.9951 6.0398 6.0125 6.1426 17.3325 14.9174 14.8045 0.9818 0.9763 0.9516 0.9773 0.9812 0.9798 0.9902 0.9832 0.9766 0.9193 0.9315</array>
                     <array dataType="xsd:double" dictRef="o:za" size="19">6.0000 6.0000 6.0000 6.0000 6.0000 17.0000 15.0000 15.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000</array>
                     <array dataType="xsd:double" dictRef="o:qa" size="19">-0.1068 0.0049 -0.0398 -0.0125 -0.1426 -0.3325 0.0826 0.1955 0.0182 0.0237 0.0484 0.0227 0.0188 0.0202 0.0098 0.0168 0.0234 0.0807 0.0685</array>
                     <array dataType="xsd:double" dictRef="o:va" size="19">3.8894 3.8266 3.9347 3.8581 3.8986 3.8705 3.6363 3.9460 0.9600 0.9546 0.9779 0.9638 0.9642 0.9582 0.9837 0.9831 0.9843 0.9797 0.9698</array>
                     <array dataType="xsd:double" dictRef="o:bva" size="19">3.8894 3.8266 3.9347 3.8581 3.8986 3.8705 3.6363 3.9460 0.9600 0.9546 0.9779 0.9638 0.9642 0.9582 0.9837 0.9831 0.9843 0.9797 0.9698</array>
                     <array dataType="xsd:double" dictRef="o:fa" size="19">0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000</array>
                  </module>
                  <module cmlx:templateRef="bonds">
                     <array dataType="xsd:double" dictRef="x:distance" size="21">1.3015 0.5092 0.9620 0.8783 1.4640 0.9671 1.2799 0.1017 0.9865 1.5202 0.9695 0.8129 0.9049 0.6878 0.9666 0.9378 0.9436 0.9258 0.9245 0.9149 0.9221</array>
                     <matrix cols="2" dataType="xsd:integer" dictRef="x:serial" rows="21">0 1 0 4 0 5 0 17 1 2 1 16 2 3 2 5 2 14 3 4 3 15 4 5 4 18 5 6 5 7 6 11 6 12 6 13 7 8 7 9 7 10</matrix>
                  </module>
               </module>
               <module cmlx:templateRef="dispersion" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispersion" units="nonsi:hartree">-0.022561210</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="cc:energy" units="nonsi:hartree">-989.474366357015</scalar>
               </module>
               <module cmlx:templateRef="electricproperties" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="cc:dipole" size="9">-27.16790 28.26834 1.10043 18.60239 -17.78326 0.81913 21.51466 -21.51980 -0.00514</array>
                  <scalar dataType="xsd:double" dictRef="o:magnitude" units="nonsi2:au">1.37184</scalar>
                  <scalar dataType="xsd:double" dictRef="o:magnitude" units="nonsi2:debye">3.48695</scalar>
               </module>
            </module>
         </module>
      </module>
   </module>
</module>
