<?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">5.0.2</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="6">1 2 3 4 5 6</array>
                     <array dataType="xsd:string" dictRef="o:primitive" size="6">14s9p3d1f 14s9p3d1f 11s6p2d1f 11s6p2d1f 11s6p2d1f 5s2p1d</array>
                     <array dataType="xsd:string" dictRef="o:contraction" size="6">5s5p3d1f 5s5p3d1f 5s3p2d1f 5s3p2d1f 5s3p2d1f 3s2p1d</array>
                  </list>
                  <list dictRef="atombasis">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="31">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</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="31">Cl S O O O N N C C C C C C C C C C H H H H H H H H H H H H H H</array>
                     <array dataType="xsd:integer" dictRef="o:group" size="31">1 2 3 3 3 4 4 5 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 6 6 6 6 6 6 6 6</array>
                  </list>
               </module>
            </parameterList>
            <molecule id="molecule">
               <atomArray>
                  <atom elementType="Cl"
                        id="a1"
                        x3="-5.857893"
                        y3="0.304368"
                        z3="-0.735226"/>
                  <atom elementType="S"
                        id="a2"
                        x3="0.098635"
                        y3="-0.499189"
                        z3="0.61401"/>
                  <atom elementType="O"
                        id="a3"
                        x3="0.577922"
                        y3="-1.820908"
                        z3="0.444705"/>
                  <atom elementType="O"
                        id="a4"
                        x3="0.210443"
                        y3="-0.023818"
                        z3="2.093484"/>
                  <atom elementType="O"
                        id="a5"
                        x3="2.657626"
                        y3="1.980098"
                        z3="-0.377153"/>
                  <atom elementType="N"
                        id="a6"
                        x3="0.895866"
                        y3="0.541255"
                        z3="-0.309022"/>
                  <atom elementType="N"
                        id="a7"
                        x3="3.075332"
                        y3="-0.195534"
                        z3="0.206563"/>
                  <atom elementType="C"
                        id="a8"
                        x3="4.531353"
                        y3="-0.054341"
                        z3="0.304473"/>
                  <atom elementType="C"
                        id="a9"
                        x3="-1.570746"
                        y3="-0.249223"
                        z3="0.286846"/>
                  <atom elementType="C"
                        id="a10"
                        x3="5.237402"
                        y3="-0.214428"
                        z3="-1.034524"/>
                  <atom elementType="C"
                        id="a11"
                        x3="2.326252"
                        y3="0.850707"
                        z3="-0.177715"/>
                  <atom elementType="C"
                        id="a12"
                        x3="-2.202614"
                        y3="-1.211365"
                        z3="-0.496277"/>
                  <atom elementType="C"
                        id="a13"
                        x3="-2.23469"
                        y3="0.881402"
                        z3="0.763233"/>
                  <atom elementType="C"
                        id="a14"
                        x3="6.745833"
                        y3="-0.069605"
                        z3="-0.887943"/>
                  <atom elementType="C"
                        id="a15"
                        x3="-3.534725"
                        y3="-1.035218"
                        z3="-0.809258"/>
                  <atom elementType="C"
                        id="a16"
                        x3="-3.563366"
                        y3="1.045919"
                        z3="0.441058"/>
                  <atom elementType="C"
                        id="a17"
                        x3="-4.207208"
                        y3="0.089824"
                        z3="-0.343564"/>
                  <atom elementType="H"
                        id="a18"
                        x3="4.877025"
                        y3="-0.803392"
                        z3="1.016816"/>
                  <atom elementType="H"
                        id="a19"
                        x3="4.734603"
                        y3="0.927357"
                        z3="0.729141"/>
                  <atom elementType="H"
                        id="a20"
                        x3="4.995051"
                        y3="-1.194035"
                        z3="-1.454427"/>
                  <atom elementType="H"
                        id="a21"
                        x3="4.854207"
                        y3="0.536991"
                        z3="-1.727315"/>
                  <atom elementType="H"
                        id="a22"
                        x3="0.365766"
                        y3="1.354238"
                        z3="-0.599456"/>
                  <atom elementType="H"
                        id="a23"
                        x3="2.716789"
                        y3="-1.120484"
                        z3="0.026496"/>
                  <atom elementType="H"
                        id="a24"
                        x3="-1.668007"
                        y3="-2.08404"
                        z3="-0.844663"/>
                  <atom elementType="H"
                        id="a25"
                        x3="-1.734212"
                        y3="1.610836"
                        z3="1.384939"/>
                  <atom elementType="H"
                        id="a26"
                        x3="7.152633"
                        y3="-0.821061"
                        z3="-0.20964"/>
                  <atom elementType="H"
                        id="a27"
                        x3="7.239961"
                        y3="-0.188992"
                        z3="-1.850309"/>
                  <atom elementType="H"
                        id="a28"
                        x3="7.009864"
                        y3="0.914223"
                        z3="-0.498225"/>
                  <atom elementType="H"
                        id="a29"
                        x3="-4.055202"
                        y3="-1.76671"
                        z3="-1.409699"/>
                  <atom elementType="H"
                        id="a30"
                        x3="-4.109441"
                        y3="1.906515"
                        z3="0.79863"/>
                  <atom elementType="H"
                        id="a31"
                        x3="1.095714"
                        y3="-0.163722"
                        z3="2.46334"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a17" order="S"/>
                  <bond atomRefs2="a2 a9" order="S"/>
                  <bond atomRefs2="a2 a6" order="S"/>
                  <bond atomRefs2="a2 a4" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a4 a31" order="S"/>
                  <bond atomRefs2="a5 a11" order="S"/>
                  <bond atomRefs2="a6 a11" order="S"/>
                  <bond atomRefs2="a6 a22" order="S"/>
                  <bond atomRefs2="a7 a8" order="S"/>
                  <bond atomRefs2="a7 a11" order="S"/>
                  <bond atomRefs2="a7 a23" order="S"/>
                  <bond atomRefs2="a8 a10" order="S"/>
                  <bond atomRefs2="a8 a18" order="S"/>
                  <bond atomRefs2="a8 a19" order="S"/>
                  <bond atomRefs2="a9 a13" order="S"/>
                  <bond atomRefs2="a9 a12" order="S"/>
                  <bond atomRefs2="a10 a14" order="S"/>
                  <bond atomRefs2="a10 a20" order="S"/>
                  <bond atomRefs2="a10 a21" order="S"/>
                  <bond atomRefs2="a12 a15" order="S"/>
                  <bond atomRefs2="a12 a24" order="S"/>
                  <bond atomRefs2="a13 a16" order="S"/>
                  <bond atomRefs2="a13 a25" order="S"/>
                  <bond atomRefs2="a14 a26" order="S"/>
                  <bond atomRefs2="a14 a28" order="S"/>
                  <bond atomRefs2="a14 a27" order="S"/>
                  <bond atomRefs2="a15 a17" order="S"/>
                  <bond atomRefs2="a15 a29" order="S"/>
                  <bond atomRefs2="a16 a17" order="S"/>
                  <bond atomRefs2="a16 a30" order="S"/>
               </bondArray>
               <formula concise="C10H14ClN2O3S">
                  <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">263.6365999999999</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</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">WB97X-D3</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Correlation</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">WB97X-D3</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">0.195728</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ScalDFX</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.000000</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>
                     <scalar dataType="xsd:string" dictRef="o:comment">Long-range corrected/Screened/Range-Separated Hybrid DFT is turned on</scalar>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Amount of maximum screened exact exchange</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.804272</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Range separation parameter mu (erf(mu*r12)/r12)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.250000</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">991</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">CHLORPROPAMIDE_3</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">1</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">144</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Dim</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">745</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ENuc</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1484.0541178000 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">on</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">SOSCFMaxIt</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">150</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">SOSCFStart</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.003300</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">TolG</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-05</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">TolX</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-05</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">8.737e-06</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Time for diagonalization</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.085 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">0.101 sec</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Total time needed</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.188 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">WB97X-D3</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Correlation</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">WB97X-D3</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">0.195728</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ScalDFX</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.000000</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>
                     <scalar dataType="xsd:string" dictRef="o:comment">Long-range corrected/Screened/Range-Separated Hybrid DFT is turned on</scalar>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Amount of maximum screened exact exchange</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.804272</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Range separation parameter mu (erf(mu*r12)/r12)</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.250000</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">991</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">CHLORPROPAMIDE_3</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">1</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">144</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Dim</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">745</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">ENuc</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1483.7727463170 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">on</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">SOSCFMaxIt</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">150</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">SOSCFStart</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.003300</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">TolG</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-05</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">TolX</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">1.000e-05</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">8.758e-06</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Time for diagonalization</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.084 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">0.135 sec</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:string" dictRef="cc:parameter">Total time needed</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:value">0.230 sec</scalar>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="input" id="initialization">
                  <module cmlx:templateRef="job">
                     <scalar dataType="xsd:integer" dictRef="o:charge">1</scalar>
                     <scalar dataType="xsd:integer" dictRef="cc:multiplicity">1</scalar>
                     <array dataType="xsd:string" dictRef="cc:keywords" size="8">wB97X-D3 TightOpt Freq def2-TZVPP def2/J RIJCOSX TightSCF defgrid3</array>
                     <module cmlx:templateRef="block">
                        <scalar dataType="xsd:string" dictRef="o:type">maxcore</scalar>
                        <scalar dataType="xsd:string" dictRef="o:parameters">6144</scalar>
                        <scalar dataType="xsd:string" dictRef="o:parameter"/>
                     </module>
                     <module cmlx:templateRef="block">
                        <scalar dataType="xsd:string" dictRef="o:type">pal</scalar>
                        <scalar dataType="xsd:string" dictRef="o:parameters">nprocs 8</scalar>
                     </module>
                     <module cmlx:templateRef="block">
                        <scalar dataType="xsd:string" dictRef="o:type">chelpg</scalar>
                        <scalar dataType="xsd:string" dictRef="o:parameters"/>
                        <scalar dataType="xsd:string" dictRef="o:parameter">grid 0.1</scalar>
                        <scalar dataType="xsd:string" dictRef="o:parameter">rmax 3.0</scalar>
                     </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="Cl"
                              id="a1"
                              x3="-5.85482"
                              y3="0.297124"
                              z3="-0.737057"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.0989"
                              y3="-0.492775"
                              z3="0.617398"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.578726"
                              y3="-1.815035"
                              z3="0.454543"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.208178"
                              y3="-0.010472"
                              z3="2.094749"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.660415"
                              y3="1.978533"
                              z3="-0.379731"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.895801"
                              y3="0.543147"
                              z3="-0.309776"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.073548"
                              y3="-0.198549"
                              z3="0.203952"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.529927"
                              y3="-0.058763"
                              z3="0.303348"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.569699"
                              y3="-0.245607"
                              z3="0.287638"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.23697"
                              y3="-0.215825"
                              z3="-1.035742"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.326597"
                              y3="0.849536"
                              z3="-0.180277"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.197495"
                              y3="-1.207781"
                              z3="-0.498614"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.237857"
                              y3="0.880979"
                              z3="0.767877"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.745729"
                              y3="-0.071396"
                              z3="-0.888346"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.529878"
                              y3="-1.034849"
                              z3="-0.812804"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.566695"
                              y3="1.042296"
                              z3="0.444491"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.205989"
                              y3="0.086779"
                              z3="-0.344491"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.874317"
                              y3="-0.809583"
                              z3="1.015197"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.732722"
                              y3="0.92225"
                              z3="0.731078"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.994435"
                              y3="-1.194687"
                              z3="-1.458867"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.853695"
                              y3="0.53739"
                              z3="-1.727632"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.366936"
                              y3="1.35579"
                              z3="-0.603325"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.713613"
                              y3="-1.122565"
                              z3="0.022077"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.658985"
                              y3="-2.078287"
                              z3="-0.848796"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.740345"
                              y3="1.609533"
                              z3="1.394381"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.153194"
                              y3="-0.824832"
                              z3="-0.212189"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.240761"
                              y3="-0.187885"
                              z3="-1.850918"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.010446"
                              y3="0.911414"
                              z3="-0.495737"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-4.048163"
                              y3="-1.766368"
                              z3="-1.41631"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.116965"
                              y3="1.899935"
                              z3="0.80473"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.092151"
                              y3="-0.15178"
                              z3="2.468472"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="Cl"
                              id="a1"
                              x3="-5.852691"
                              y3="0.294267"
                              z3="-0.738582"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.099013"
                              y3="-0.489285"
                              z3="0.619773"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.578243"
                              y3="-1.812365"
                              z3="0.4623"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.207839"
                              y3="-0.000959"
                              z3="2.095064"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.661805"
                              y3="1.97525"
                              z3="-0.388393"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.89556"
                              y3="0.54199"
                              z3="-0.311873"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.072946"
                              y3="-0.199925"
                              z3="0.204157"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.529481"
                              y3="-0.059338"
                              z3="0.303246"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.569101"
                              y3="-0.243384"
                              z3="0.289014"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.236592"
                              y3="-0.218381"
                              z3="-1.035483"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.326594"
                              y3="0.847393"
                              z3="-0.183769"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.193568"
                              y3="-1.20325"
                              z3="-0.502731"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.240546"
                              y3="0.879162"
                              z3="0.774304"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.745232"
                              y3="-0.072152"
                              z3="-0.888995"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.525993"
                              y3="-1.032007"
                              z3="-0.817848"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.569356"
                              y3="1.038908"
                              z3="0.44992"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.205317"
                              y3="0.085757"
                              z3="-0.344799"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.873827"
                              y3="-0.808244"
                              z3="1.017274"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.73107"
                              y3="0.922701"
                              z3="0.729516"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.994726"
                              y3="-1.19818"
                              z3="-1.4572"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.852126"
                              y3="0.532873"
                              z3="-1.729089"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.367364"
                              y3="1.353539"
                              z3="-0.609587"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.712472"
                              y3="-1.124196"
                              z3="0.025057"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.652138"
                              y3="-2.070808"
                              z3="-0.856117"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.745422"
                              y3="1.605484"
                              z3="1.405411"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.15452"
                              y3="-0.824203"
                              z3="-0.212279"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.240481"
                              y3="-0.189171"
                              z3="-1.851488"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.009741"
                              y3="0.911367"
                              z3="-0.497812"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-4.042288"
                              y3="-1.761649"
                              z3="-1.425509"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.122684"
                              y3="1.893246"
                              z3="0.813623"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.089648"
                              y3="-0.146771"
                              z3="2.472214"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="Cl"
                              id="a1"
                              x3="-5.85209"
                              y3="0.29295"
                              z3="-0.739823"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.099128"
                              y3="-0.487256"
                              z3="0.62153"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.578288"
                              y3="-1.81079"
                              z3="0.467617"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.208647"
                              y3="0.005104"
                              z3="2.095327"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.662145"
                              y3="1.972974"
                              z3="-0.394985"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.895127"
                              y3="0.541013"
                              z3="-0.313457"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.07264"
                              y3="-0.200566"
                              z3="0.203574"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.529188"
                              y3="-0.059109"
                              z3="0.30276"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.568977"
                              y3="-0.242206"
                              z3="0.29069"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.236723"
                              y3="-0.220277"
                              z3="-1.035305"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.326496"
                              y3="0.845733"
                              z3="-0.187587"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.191268"
                              y3="-1.200093"
                              z3="-0.5053"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.242581"
                              y3="0.877723"
                              z3="0.779107"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.745062"
                              y3="-0.072586"
                              z3="-0.888964"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.523521"
                              y3="-1.029682"
                              z3="-0.821353"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.571255"
                              y3="1.036631"
                              z3="0.45383"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.205124"
                              y3="0.085465"
                              z3="-0.345098"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.87341"
                              y3="-0.806242"
                              z3="1.018654"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.729834"
                              y3="0.923789"
                              z3="0.727425"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.995615"
                              y3="-1.200946"
                              z3="-1.455347"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.851693"
                              y3="0.529095"
                              z3="-1.730561"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.36726"
                              y3="1.351925"
                              z3="-0.613461"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.711989"
                              y3="-1.125271"
                              z3="0.027095"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.648081"
                              y3="-2.065583"
                              z3="-0.860897"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.748997"
                              y3="1.602574"
                              z3="1.412916"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.155303"
                              y3="-0.823253"
                              z3="-0.211298"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.24073"
                              y3="-0.190452"
                              z3="-1.851142"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.009056"
                              y3="0.911631"
                              z3="-0.499199"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-4.038332"
                              y3="-1.757747"
                              z3="-1.432063"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.126453"
                              y3="1.888734"
                              z3="0.81977"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.088516"
                              y3="-0.145614"
                              z3="2.474862"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="Cl"
                              id="a1"
                              x3="-5.850297"
                              y3="0.290816"
                              z3="-0.747307"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.09898"
                              y3="-0.48442"
                              z3="0.626991"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.578926"
                              y3="-1.808291"
                              z3="0.478043"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.207295"
                              y3="0.012706"
                              z3="2.09914"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.663301"
                              y3="1.970983"
                              z3="-0.398798"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.895279"
                              y3="0.540722"
                              z3="-0.31086"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.073295"
                              y3="-0.200841"
                              z3="0.205799"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.530076"
                              y3="-0.059245"
                              z3="0.302307"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.568863"
                              y3="-0.240776"
                              z3="0.29369"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.235445"
                              y3="-0.2221"
                              z3="-1.036498"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.326995"
                              y3="0.844839"
                              z3="-0.186732"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.187382"
                              y3="-1.196739"
                              z3="-0.507753"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.245793"
                              y3="0.876341"
                              z3="0.783937"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.743795"
                              y3="-0.073836"
                              z3="-0.892972"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.518884"
                              y3="-1.027492"
                              z3="-0.827054"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.573803"
                              y3="1.034009"
                              z3="0.455492"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.203996"
                              y3="0.084756"
                              z3="-0.348694"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.875212"
                              y3="-0.8053"
                              z3="1.018812"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.731202"
                              y3="0.924106"
                              z3="0.725563"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.993836"
                              y3="-1.203285"
                              z3="-1.454878"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.849002"
                              y3="0.52603"
                              z3="-1.732187"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.367967"
                              y3="1.350965"
                              z3="-0.613589"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.711776"
                              y3="-1.125785"
                              z3="0.032353"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.641693"
                              y3="-2.060031"
                              z3="-0.864644"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.755003"
                              y3="1.599951"
                              z3="1.421104"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.155742"
                              y3="-0.82382"
                              z3="-0.215616"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.237984"
                              y3="-0.192128"
                              z3="-1.855844"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.008396"
                              y3="0.910672"
                              z3="-0.504391"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-4.030879"
                              y3="-1.754029"
                              z3="-1.441815"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.131696"
                              y3="1.88372"
                              z3="0.822705"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.083955"
                              y3="-0.144829"
                              z3="2.483016"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="Cl"
                              id="a1"
                              x3="-5.849356"
                              y3="0.289489"
                              z3="-0.752357"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.098884"
                              y3="-0.482687"
                              z3="0.63062"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.57973"
                              y3="-1.806603"
                              z3="0.484471"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.206189"
                              y3="0.016893"
                              z3="2.101942"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.663403"
                              y3="1.970729"
                              z3="-0.400306"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.895191"
                              y3="0.541071"
                              z3="-0.308727"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.073808"
                              y3="-0.200291"
                              z3="0.206508"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.530662"
                              y3="-0.058821"
                              z3="0.301536"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.568885"
                              y3="-0.239967"
                              z3="0.2956"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.234919"
                              y3="-0.223262"
                              z3="-1.037624"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.327296"
                              y3="0.844841"
                              z3="-0.186778"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.18509"
                              y3="-1.194907"
                              z3="-0.508977"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.247813"
                              y3="0.875534"
                              z3="0.786617"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.74335"
                              y3="-0.075066"
                              z3="-0.895439"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.516071"
                              y3="-1.026338"
                              z3="-0.830398"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.575391"
                              y3="1.032446"
                              z3="0.456092"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.203265"
                              y3="0.084246"
                              z3="-0.351043"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.876245"
                              y3="-0.804235"
                              z3="1.018467"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.73243"
                              y3="0.924872"
                              z3="0.72363"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.99285"
                              y3="-1.204892"
                              z3="-1.454619"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.848058"
                              y3="0.524129"
                              z3="-1.733819"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.368068"
                              y3="1.351212"
                              z3="-0.612074"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.711755"
                              y3="-1.125447"
                              z3="0.035511"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.638021"
                              y3="-2.057049"
                              z3="-0.866468"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.758799"
                              y3="1.598496"
                              z3="1.425811"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.155742"
                              y3="-0.824589"
                              z3="-0.217861"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.236734"
                              y3="-0.194104"
                              z3="-1.858621"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.008346"
                              y3="0.909689"
                              z3="-0.507781"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-4.026235"
                              y3="-1.752059"
                              z3="-1.447603"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.134828"
                              y3="1.880851"
                              z3="0.823919"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.080266"
                              y3="-0.146513"
                              z3="2.489086"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="Cl"
                              id="a1"
                              x3="-5.846828"
                              y3="0.286377"
                              z3="-0.763143"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.098539"
                              y3="-0.479436"
                              z3="0.638041"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.581383"
                              y3="-1.803196"
                              z3="0.496385"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.202173"
                              y3="0.02347"
                              z3="2.108451"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.664075"
                              y3="1.971523"
                              z3="-0.398008"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.895491"
                              y3="0.542753"
                              z3="-0.302404"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.075072"
                              y3="-0.199345"
                              z3="0.208633"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.532137"
                              y3="-0.05907"
                              z3="0.300224"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.568798"
                              y3="-0.238554"
                              z3="0.298476"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.233303"
                              y3="-0.224413"
                              z3="-1.040525"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.328218"
                              y3="0.845836"
                              z3="-0.183175"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.180872"
                              y3="-1.192897"
                              z3="-0.510059"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.251055"
                              y3="0.874922"
                              z3="0.789193"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.742216"
                              y3="-0.077553"
                              z3="-0.901551"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.510935"
                              y3="-1.025713"
                              z3="-0.835682"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.577785"
                              y3="1.030408"
                              z3="0.454445"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.201413"
                              y3="0.082926"
                              z3="-0.356558"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.878821"
                              y3="-0.804838"
                              z3="1.016262"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.735993"
                              y3="0.924464"
                              z3="0.721675"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.989489"
                              y3="-1.206009"
                              z3="-1.456567"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.845686"
                              y3="0.523253"
                              z3="-1.735994"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.368803"
                              y3="1.353142"
                              z3="-0.605902"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.711657"
                              y3="-1.12446"
                              z3="0.040591"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.631509"
                              y3="-2.053698"
                              z3="-0.867299"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.76529"
                              y3="1.597464"
                              z3="1.431332"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.155231"
                              y3="-0.827568"
                              z3="-0.224906"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.2333"
                              y3="-0.196884"
                              z3="-1.86586"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.008728"
                              y3="0.906936"
                              z3="-0.514265"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-4.017853"
                              y3="-1.750995"
                              z3="-1.456085"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.139707"
                              y3="1.87727"
                              z3="0.822058"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.071902"
                              y3="-0.148449"
                              z3="2.501534"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="Cl"
                              id="a1"
                              x3="-5.84387"
                              y3="0.282841"
                              z3="-0.77413"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.098131"
                              y3="-0.476037"
                              z3="0.645497"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.583159"
                              y3="-1.79947"
                              z3="0.507856"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.197129"
                              y3="0.029439"
                              z3="2.115388"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.664863"
                              y3="1.973117"
                              z3="-0.393265"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.89588"
                              y3="0.545066"
                              z3="-0.295182"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.076424"
                              y3="-0.198347"
                              z3="0.210644"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.533715"
                              y3="-0.059676"
                              z3="0.298798"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.568642"
                              y3="-0.2372"
                              z3="0.300857"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.231576"
                              y3="-0.225293"
                              z3="-1.043777"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.329275"
                              y3="0.847355"
                              z3="-0.178262"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.176657"
                              y3="-1.191474"
                              z3="-0.510799"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.25403"
                              y3="0.874605"
                              z3="0.790769"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.74109"
                              y3="-0.080281"
                              z3="-0.908103"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.505925"
                              y3="-1.02581"
                              z3="-0.840494"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.579956"
                              y3="1.028646"
                              z3="0.451842"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.199425"
                              y3="0.08128"
                              z3="-0.362255"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.881478"
                              y3="-0.806265"
                              z3="1.013477"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.739915"
                              y3="0.923461"
                              z3="0.720077"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.985687"
                              y3="-1.20653"
                              z3="-1.459478"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.843337"
                              y3="0.52322"
                              z3="-1.738012"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.369675"
                              y3="1.356064"
                              z3="-0.597976"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.711367"
                              y3="-1.123254"
                              z3="0.04532"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.625067"
                              y3="-2.051145"
                              z3="-0.867431"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.771484"
                              y3="1.597022"
                              z3="1.435523"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.154518"
                              y3="-0.831156"
                              z3="-0.232663"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.22971"
                              y3="-0.199766"
                              z3="-1.873642"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.009434"
                              y3="0.903748"
                              z3="-0.520907"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-4.009684"
                              y3="-1.751124"
                              z3="-1.463462"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.144132"
                              y3="1.874339"
                              z3="0.818757"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.06268"
                              y3="-0.149705"
                              z3="2.514351"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="Cl"
                              id="a1"
                              x3="-5.840449"
                              y3="0.278549"
                              z3="-0.786121"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.097594"
                              y3="-0.472009"
                              z3="0.653726"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.585027"
                              y3="-1.795051"
                              z3="0.520601"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.191048"
                              y3="0.036295"
                              z3="2.123112"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.666038"
                              y3="1.974819"
                              z3="-0.386948"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.896361"
                              y3="0.547749"
                              z3="-0.287001"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.07795"
                              y3="-0.197681"
                              z3="0.212561"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.535499"
                              y3="-0.06082"
                              z3="0.297129"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.568478"
                              y3="-0.235683"
                              z3="0.303331"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.229718"
                              y3="-0.226258"
                              z3="-1.047466"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.330575"
                              y3="0.848887"
                              z3="-0.172342"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.171907"
                              y3="-1.18995"
                              z3="-0.511652"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.257369"
                              y3="0.874284"
                              z3="0.792352"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.739856"
                              y3="-0.083254"
                              z3="-0.915467"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.500363"
                              y3="-1.02609"
                              z3="-0.845783"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.582408"
                              y3="1.02666"
                              z3="0.448855"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.197259"
                              y3="0.079293"
                              z3="-0.368621"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.884375"
                              y3="-0.808411"
                              z3="1.010234"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.744094"
                              y3="0.921789"
                              z3="0.718514"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.981543"
                              y3="-1.206894"
                              z3="-1.463258"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.840709"
                              y3="0.523376"
                              z3="-1.740094"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.370893"
                              y3="1.359636"
                              z3="-0.588806"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.710824"
                              y3="-1.122254"
                              z3="0.050351"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.617726"
                              y3="-2.048267"
                              z3="-0.867613"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.778453"
                              y3="1.596618"
                              z3="1.439931"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.153877"
                              y3="-0.835129"
                              z3="-0.2415"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.22579"
                              y3="-0.202773"
                              z3="-1.882361"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.010302"
                              y3="0.900213"
                              z3="-0.528298"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-4.000615"
                              y3="-1.751573"
                              z3="-1.471406"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.14909"
                              y3="1.871052"
                              z3="0.814947"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.052216"
                              y3="-0.149457"
                              z3="2.528411"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="Cl"
                              id="a1"
                              x3="-5.837751"
                              y3="0.274786"
                              z3="-0.795699"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.097104"
                              y3="-0.46852"
                              z3="0.660318"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.586489"
                              y3="-1.791226"
                              z3="0.530887"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.185938"
                              y3="0.042117"
                              z3="2.129302"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.667246"
                              y3="1.976086"
                              z3="-0.381357"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.896761"
                              y3="0.550025"
                              z3="-0.280376"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.079204"
                              y3="-0.197444"
                              z3="0.213792"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.536975"
                              y3="-0.062021"
                              z3="0.295681"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.5684"
                              y3="-0.23446"
                              z3="0.305352"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.228329"
                              y3="-0.227193"
                              z3="-1.050448"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.33174"
                              y3="0.849984"
                              z3="-0.167426"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.167978"
                              y3="-1.188578"
                              z3="-0.512533"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.260278"
                              y3="0.873883"
                              z3="0.793823"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.738897"
                              y3="-0.085698"
                              z3="-0.921435"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.495797"
                              y3="-1.02629"
                              z3="-0.850208"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.584582"
                              y3="1.024808"
                              z3="0.446675"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.195656"
                              y3="0.077492"
                              z3="-0.373705"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.886621"
                              y3="-0.810325"
                              z3="1.00766"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.747285"
                              y3="0.920173"
                              z3="0.717208"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.978349"
                              y3="-1.207261"
                              z3="-1.466508"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.838618"
                              y3="0.523319"
                              z3="-1.74175"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.372108"
                              y3="1.362825"
                              z3="-0.581251"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.710115"
                              y3="-1.121699"
                              z3="0.054574"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.611525"
                              y3="-2.045598"
                              z3="-0.868106"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.784405"
                              y3="1.596121"
                              z3="1.443743"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.153545"
                              y3="-0.838239"
                              z3="-0.248593"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.222751"
                              y3="-0.205337"
                              z3="-1.889363"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.011082"
                              y3="0.897366"
                              z3="-0.534458"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-3.993118"
                              y3="-1.751839"
                              z3="-1.478093"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.153411"
                              y3="1.868002"
                              z3="0.812203"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.04392"
                              y3="-0.14759"
                              z3="2.53941"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="Cl"
                              id="a1"
                              x3="-5.835499"
                              y3="0.270921"
                              z3="-0.804392"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.09661"
                              y3="-0.465074"
                              z3="0.666313"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.58783"
                              y3="-1.787444"
                              z3="0.540196"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.181201"
                              y3="0.047715"
                              z3="2.134914"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.66861"
                              y3="1.977205"
                              z3="-0.375968"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.897133"
                              y3="0.55234"
                              z3="-0.274307"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.080359"
                              y3="-0.197413"
                              z3="0.214603"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.538348"
                              y3="-0.063347"
                              z3="0.294243"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.568405"
                              y3="-0.233309"
                              z3="0.307338"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.227179"
                              y3="-0.228261"
                              z3="-1.053173"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.332919"
                              y3="0.850941"
                              z3="-0.162919"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.164264"
                              y3="-1.1871"
                              z3="-0.513558"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.263284"
                              y3="0.873305"
                              z3="0.795524"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.738065"
                              y3="-0.08811"
                              z3="-0.926875"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.491468"
                              y3="-1.026393"
                              z3="-0.85451"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.586884"
                              y3="1.022721"
                              z3="0.445021"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.194356"
                              y3="0.075616"
                              z3="-0.378351"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.888516"
                              y3="-0.812234"
                              z3="1.00534"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.750098"
                              y3="0.91847"
                              z3="0.715937"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.975544"
                              y3="-1.207745"
                              z3="-1.46959"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.836801"
                              y3="0.523023"
                              z3="-1.743269"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.373466"
                              y3="1.366181"
                              z3="-0.574187"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.709156"
                              y3="-1.121323"
                              z3="0.058678"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.605516"
                              y3="-2.042704"
                              z3="-0.868937"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.790364"
                              y3="1.595392"
                              z3="1.447728"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.153369"
                              y3="-0.841117"
                              z3="-0.254956"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.220119"
                              y3="-0.20801"
                              z3="-1.895676"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.011914"
                              y3="0.894634"
                              z3="-0.540258"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-3.985948"
                              y3="-1.75187"
                              z3="-1.484711"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.157916"
                              y3="1.864563"
                              z3="0.81021"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.03684"
                              y3="-0.143906"
                              z3="2.548909"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="geometry">
                  <molecule id="molecule">
                     <atomArray>
                        <atom elementType="Cl"
                              id="a1"
                              x3="-5.83416"
                              y3="0.267834"
                              z3="-0.810427"/>
                        <atom elementType="S"
                              id="a2"
                              x3="0.096245"
                              y3="-0.46248"
                              z3="0.670439"/>
                        <atom elementType="O"
                              id="a3"
                              x3="0.588783"
                              y3="-1.784592"
                              z3="0.546443"/>
                        <atom elementType="O"
                              id="a4"
                              x3="0.177984"
                              y3="0.051784"
                              z3="2.138736"/>
                        <atom elementType="O"
                              id="a5"
                              x3="2.669764"
                              y3="1.977963"
                              z3="-0.372357"/>
                        <atom elementType="N"
                              id="a6"
                              x3="0.89739"
                              y3="0.55421"
                              z3="-0.270137"/>
                        <atom elementType="N"
                              id="a7"
                              x3="3.08114"
                              y3="-0.197433"
                              z3="0.214981"/>
                        <atom elementType="C"
                              id="a8"
                              x3="4.539291"
                              y3="-0.064398"
                              z3="0.293187"/>
                        <atom elementType="C"
                              id="a9"
                              x3="-1.568473"
                              y3="-0.232446"
                              z3="0.308913"/>
                        <atom elementType="C"
                              id="a10"
                              x3="5.226448"
                              y3="-0.229215"
                              z3="-1.05503"/>
                        <atom elementType="C"
                              id="a11"
                              x3="2.333815"
                              y3="0.85163"
                              z3="-0.159938"/>
                        <atom elementType="C"
                              id="a12"
                              x3="-2.16154"
                              y3="-1.185809"
                              z3="-0.514501"/>
                        <atom elementType="C"
                              id="a13"
                              x3="-2.265742"
                              y3="0.872659"
                              z3="0.797167"/>
                        <atom elementType="C"
                              id="a14"
                              x3="6.737509"
                              y3="-0.090036"
                              z3="-0.930583"/>
                        <atom elementType="C"
                              id="a15"
                              x3="-3.488272"
                              y3="-1.026356"
                              z3="-0.857782"/>
                        <atom elementType="C"
                              id="a16"
                              x3="-3.588831"
                              y3="1.020819"
                              z3="0.444302"/>
                        <atom elementType="C"
                              id="a17"
                              x3="-4.193596"
                              y3="0.074064"
                              z3="-0.381516"/>
                        <atom elementType="H"
                              id="a18"
                              x3="4.889646"
                              y3="-0.813673"
                              z3="1.003771"/>
                        <atom elementType="H"
                              id="a19"
                              x3="4.752032"
                              y3="0.917146"
                              z3="0.715009"/>
                        <atom elementType="H"
                              id="a20"
                              x3="4.973622"
                              y3="-1.20827"
                              z3="-1.4717"/>
                        <atom elementType="H"
                              id="a21"
                              x3="4.835638"
                              y3="0.522577"
                              z3="-1.744328"/>
                        <atom elementType="H"
                              id="a22"
                              x3="0.374605"
                              y3="1.368939"
                              z3="-0.569212"/>
                        <atom elementType="H"
                              id="a23"
                              x3="2.70822"
                              y3="-1.121067"
                              z3="0.061822"/>
                        <atom elementType="H"
                              id="a24"
                              x3="-1.600983"
                              y3="-2.040196"
                              z3="-0.869933"/>
                        <atom elementType="H"
                              id="a25"
                              x3="-1.795042"
                              y3="1.594542"
                              z3="1.451156"/>
                        <atom elementType="H"
                              id="a26"
                              x3="7.15327"
                              y3="-0.84327"
                              z3="-0.259196"/>
                        <atom elementType="H"
                              id="a27"
                              x3="7.218392"
                              y3="-0.210265"
                              z3="-1.89993"/>
                        <atom elementType="H"
                              id="a28"
                              x3="7.01259"
                              y3="0.892517"
                              z3="-0.544355"/>
                        <atom elementType="H"
                              id="a29"
                              x3="-3.980595"
                              y3="-1.751597"
                              z3="-1.489931"/>
                        <atom elementType="H"
                              id="a30"
                              x3="-4.161682"
                              y3="1.861428"
                              z3="0.809466"/>
                        <atom elementType="H"
                              id="a31"
                              x3="1.032703"
                              y3="-0.139338"
                              z3="2.554782"/>
                     </atomArray>
                     <bondArray>
                        <bond atomRefs2="a1 a17" order="S"/>
                        <bond atomRefs2="a2 a9" order="S"/>
                        <bond atomRefs2="a2 a6" order="S"/>
                        <bond atomRefs2="a2 a4" order="S"/>
                        <bond atomRefs2="a2 a3" order="S"/>
                        <bond atomRefs2="a4 a31" order="S"/>
                        <bond atomRefs2="a5 a11" order="S"/>
                        <bond atomRefs2="a6 a11" order="S"/>
                        <bond atomRefs2="a6 a22" order="S"/>
                        <bond atomRefs2="a7 a8" order="S"/>
                        <bond atomRefs2="a7 a11" order="S"/>
                        <bond atomRefs2="a7 a23" order="S"/>
                        <bond atomRefs2="a8 a10" order="S"/>
                        <bond atomRefs2="a8 a18" order="S"/>
                        <bond atomRefs2="a8 a19" order="S"/>
                        <bond atomRefs2="a9 a13" order="S"/>
                        <bond atomRefs2="a9 a12" order="S"/>
                        <bond atomRefs2="a10 a14" order="S"/>
                        <bond atomRefs2="a10 a20" order="S"/>
                        <bond atomRefs2="a10 a21" order="S"/>
                        <bond atomRefs2="a12 a15" order="S"/>
                        <bond atomRefs2="a12 a24" order="S"/>
                        <bond atomRefs2="a13 a16" order="S"/>
                        <bond atomRefs2="a13 a25" order="S"/>
                        <bond atomRefs2="a14 a26" order="S"/>
                        <bond atomRefs2="a14 a28" order="S"/>
                        <bond atomRefs2="a14 a27" order="S"/>
                        <bond atomRefs2="a15 a17" order="S"/>
                        <bond atomRefs2="a15 a29" order="S"/>
                        <bond atomRefs2="a16 a17" order="S"/>
                        <bond atomRefs2="a16 a30" order="S"/>
                     </bondArray>
                     <formula concise="C10H14ClN2O3S">
                        <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
                     </formula>
                     <property dictRef="cml:molmass">
                        <scalar units="unit:dalton">263.6365999999999</scalar>
                     </property>
                     <formula convention="iupac:inchi"
                              inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                        <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
                     </formula>
                  </molecule>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911238276320</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911254638571</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911259186747</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911260531260</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911261360726</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911261883251</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911261957502</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911261483780</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911260375040</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911259182783</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911257964374</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911257057698</scalar>
               </module>
               <module cmlx:templateRef="loewdin">
                  <array dataType="xsd:integer" dictRef="cc:serial" size="31">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</array>
                  <array dataType="xsd:string" dictRef="cc:elementType" size="31">Cl S O O O N N C C C C C C C C C C H H H H H H H H H H H H H H</array>
                  <array dataType="xsd:double" dictRef="x:charge" size="31">0.504793 0.859223 -0.171930 0.200374 0.147975 0.125068 0.304685 -0.036662 -0.264813 -0.042815 -0.497996 0.022301 0.005308 0.013774 0.006425 0.005666 -0.362408 0.025119 0.032426 0.017342 0.023359 -0.010854 -0.027141 0.041151 0.036859 0.014586 0.019488 0.016863 0.041075 0.040985 -0.090224</array>
               </module>
               <module cmlx:templateRef="mayer">
                  <module cmlx:templateRef="mayercharges">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="31">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</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="31">Cl S O O O N N C C C C C C C C C C H H H H H H H H H H H H H H</array>
                     <array dataType="xsd:double" dictRef="o:na" size="31">16.9644 15.2169 8.3718 8.1985 8.3023 7.1564 7.2550 6.0460 6.0210 6.1013 5.6678 6.0903 6.1364 6.2413 6.0785 6.0780 5.9480 0.8919 0.8904 0.9372 0.9156 0.8074 0.8220 0.8349 0.8434 0.9211 0.8999 0.9130 0.8457 0.8458 0.7579</array>
                     <array dataType="xsd:double" dictRef="o:za" size="31">17.0000 16.0000 8.0000 8.0000 8.0000 7.0000 7.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 1.0000 1.0000 1.0000 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="31">0.0356 0.7831 -0.3718 -0.1985 -0.3023 -0.1564 -0.2550 -0.0460 -0.0210 -0.1013 0.3322 -0.0903 -0.1364 -0.2413 -0.0785 -0.0780 0.0520 0.1081 0.1096 0.0628 0.0844 0.1926 0.1780 0.1651 0.1566 0.0789 0.1001 0.0870 0.1543 0.1542 0.2421</array>
                     <array dataType="xsd:double" dictRef="o:va" size="31">1.3477 5.6577 2.1180 2.2252 2.2077 3.1168 3.1831 3.8310 3.7241 3.8894 4.3439 3.9937 4.0525 3.9624 3.9707 3.9936 4.1075 1.0007 1.0114 1.0093 1.0136 1.0221 1.0208 1.0028 1.0072 1.0037 1.0059 1.0033 1.0040 1.0043 1.0266</array>
                     <array dataType="xsd:double" dictRef="o:bva" size="31">1.3477 5.6577 2.1180 2.2252 2.2077 3.1168 3.1831 3.8310 3.7241 3.8894 4.3439 3.9937 4.0525 3.9624 3.9707 3.9936 4.1075 1.0007 1.0114 1.0093 1.0136 1.0221 1.0208 1.0028 1.0072 1.0037 1.0059 1.0033 1.0040 1.0043 1.0266</array>
                     <array dataType="xsd:double" dictRef="o:fa" size="31">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>
                  </module>
                  <module cmlx:templateRef="bonds">
                     <array dataType="xsd:double" dictRef="x:distance" size="31">1.1806 1.9666 1.1921 1.1914 0.9744 0.9443 2.0493 0.9222 0.9343 0.8684 1.2609 0.9462 0.9377 0.9871 0.9971 1.3344 1.3223 0.9538 0.9964 1.0007 1.4721 0.9372 1.5143 0.9369 0.9894 0.9917 0.9935 1.3798 0.9548 1.3606 0.9528</array>
                     <matrix cols="2" dataType="xsd:integer" dictRef="x:serial" rows="31">0 16 1 2 1 3 1 5 1 8 3 30 4 10 5 10 5 21 6 7 6 10 6 22 7 9 7 17 7 18 8 11 8 12 9 13 9 19 9 20 11 14 11 23 12 15 12 24 13 25 13 26 13 27 14 16 14 28 15 16 15 29</matrix>
                  </module>
               </module>
               <module cmlx:templateRef="mullikenpopulation">
                  <module cmlx:templateRef="atomiccharges">
                     <scalar dataType="xsd:double" dictRef="x:chargesum">1.0000000</scalar>
                     <array dataType="xsd:integer" dictRef="cc:serial" size="31">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</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="31">Cl S O O O N N C C C C C C C C C C H H H H H H H H H H H H H H</array>
                     <array dataType="xsd:double" dictRef="x:charge" size="31">0.035612 0.783083 -0.371845 -0.198461 -0.302267 -0.156358 -0.254978 -0.045958 -0.020980 -0.101312 0.332181 -0.090318 -0.136390 -0.241315 -0.078494 -0.077976 0.051964 0.108095 0.109597 0.062828 0.084367 0.192574 0.178043 0.165140 0.156563 0.078868 0.100091 0.087042 0.154306 0.154196 0.242104</array>
                  </module>
               </module>
               <module cmlx:templateRef="orbitalenergies">
                  <list cmlx:templateRef="orbital">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="745">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 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 376 377 378 379 380 381 382 383 384 385 386 387 388 389 390 391 392 393 394 395 396 397 398 399 400 401 402 403 404 405 406 407 408 409 410 411 412 413 414 415 416 417 418 419 420 421 422 423 424 425 426 427 428 429 430 431 432 433 434 435 436 437 438 439 440 441 442 443 444 445 446 447 448 449 450 451 452 453 454 455 456 457 458 459 460 461 462 463 464 465 466 467 468 469 470 471 472 473 474 475 476 477 478 479 480 481 482 483 484 485 486 487 488 489 490 491 492 493 494 495 496 497 498 499 500 501 502 503 504 505 506 507 508 509 510 511 512 513 514 515 516 517 518 519 520 521 522 523 524 525 526 527 528 529 530 531 532 533 534 535 536 537 538 539 540 541 542 543 544 545 546 547 548 549 550 551 552 553 554 555 556 557 558 559 560 561 562 563 564 565 566 567 568 569 570 571 572 573 574 575 576 577 578 579 580 581 582 583 584 585 586 587 588 589 590 591 592 593 594 595 596 597 598 599 600 601 602 603 604 605 606 607 608 609 610 611 612 613 614 615 616 617 618 619 620 621 622 623 624 625 626 627 628 629 630 631 632 633 634 635 636 637 638 639 640 641 642 643 644 645 646 647 648 649 650 651 652 653 654 655 656 657 658 659 660 661 662 663 664 665 666 667 668 669 670 671 672 673 674 675 676 677 678 679 680 681 682 683 684 685 686 687 688 689 690 691 692 693 694 695 696 697 698 699 700 701 702 703 704 705 706 707 708 709 710 711 712 713 714 715 716 717 718 719 720 721 722 723 724 725 726 727 728 729 730 731 732 733 734 735 736 737 738 739 740 741 742 743 744</array>
                     <array dataType="xsd:double" dictRef="cc:occup" size="745">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 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 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 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 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 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="745"
                            units="nonsi:electronvolt">-2768.8535 -2431.9166 -530.3660 -528.7913 -526.7745 -398.6654 -397.3081 -287.7455 -285.9155 -285.5745 -284.9588 -284.9108 -284.3627 -284.3153 -283.8858 -282.4352 -281.7990 -264.1144 -229.6338 -202.9599 -202.7172 -202.6931 -173.9924 -173.9206 -173.8651 -39.9235 -37.1466 -36.5166 -33.8575 -32.6749 -32.0684 -30.7365 -28.9141 -28.5253 -27.6479 -26.7579 -25.4231 -24.7632 -24.4686 -24.1228 -23.2820 -22.8556 -22.3614 -22.0358 -21.4934 -20.6531 -20.2641 -20.0306 -19.4926 -19.2278 -19.1355 -18.9948 -18.7662 -18.6200 -18.2148 -18.1784 -17.5544 -17.3962 -16.9986 -16.9016 -16.7876 -16.1457 -16.0460 -15.7208 -15.5030 -14.9466 -14.7097 -14.5213 -14.4300 -14.1224 -13.5709 -13.3846 -4.0323 -2.9261 -2.1041 -1.5644 -1.0740 -0.7375 -0.2651 -0.1364 0.3091 0.4149 0.4854 0.9410 1.1643 1.2850 1.5224 1.6632 1.7016 1.9125 2.1937 2.4196 2.6519 2.7135 2.9580 2.9772 3.1769 3.3942 3.6712 3.7273 3.8747 4.0092 4.1565 4.4380 4.5182 4.6725 4.9155 5.0641 5.0917 5.3318 5.5234 5.5560 5.6968 5.9854 6.0824 6.1422 6.6057 6.6324 6.7792 6.9460 7.0135 7.1973 7.3155 7.3991 7.6266 7.8897 8.0992 8.2577 8.3623 8.4741 8.5426 8.7194 8.8856 9.1155 9.2610 9.4535 9.5486 9.7961 9.8899 10.0272 10.1697 10.3269 10.3969 10.6904 10.7385 10.8501 10.8944 11.2321 11.3217 11.3884 11.6421 11.7904 11.8756 12.0831 12.2504 12.3966 12.4203 12.6618 12.7009 12.7605 13.0578 13.1934 13.2834 13.4992 13.6029 13.6485 13.9066 14.0132 14.3165 14.5257 14.6525 14.8558 15.0128 15.3754 15.5954 15.7931 15.8396 16.0540 16.2159 16.4118 16.4753 16.7742 17.0926 17.3866 17.4919 17.5399 17.9724 18.0434 18.3760 18.5441 18.7053 18.7642 19.0365 19.0414 19.5851 19.8494 20.0664 20.1565 20.1832 20.4614 20.7872 21.0594 21.5697 21.6574 21.8489 22.1866 22.3169 22.3783 22.5410 22.6358 22.8628 23.1027 23.4603 23.8803 24.1576 24.3990 24.5424 24.7855 24.9606 25.3007 25.3101 25.4399 25.7356 25.9716 26.0836 26.2562 26.7678 26.9003 27.1321 27.4994 27.7263 27.8566 28.0050 28.1550 28.3873 28.7946 28.8475 29.2466 29.5534 29.7336 29.9394 30.0088 30.4353 30.7712 30.8492 31.2526 31.6237 31.6868 31.8343 31.9727 32.1782 32.2802 32.3881 32.9347 33.1157 33.3370 33.7004 33.7797 33.9266 33.9985 34.1207 34.1668 34.6999 34.9676 35.0486 35.2443 35.4678 35.6748 35.8531 36.0060 36.1798 36.5391 37.2103 37.3726 37.6664 38.0253 38.0989 38.3351 38.4743 38.8223 38.9866 39.0779 39.1386 39.3944 39.5790 39.6612 39.8863 40.1012 40.1999 40.2943 40.5397 40.8056 40.9890 41.1646 41.5066 41.6169 41.7232 41.9804 42.3628 42.6153 42.9227 43.1688 43.3394 43.5498 43.7087 44.0643 44.3243 44.5043 44.9282 45.0879 45.1723 45.3314 45.6468 46.0796 46.4736 46.9019 47.1372 47.7195 47.8507 48.2566 48.3790 48.5560 48.8838 49.2639 49.4539 49.6362 50.1369 50.2763 50.5714 51.0828 51.4603 51.6516 51.9596 52.5410 52.5902 53.1028 53.3088 53.7078 53.9060 53.9452 54.3171 54.6312 55.0126 55.0262 55.4777 55.7484 56.0235 56.1579 56.2480 56.3995 56.6751 57.0625 57.3654 58.2012 58.3027 58.7695 58.9647 59.2605 59.5134 59.7655 59.9957 60.4398 60.6345 60.8906 61.0961 61.1956 61.5680 61.9439 62.2586 62.3030 62.5041 62.8886 63.3678 63.4152 63.5383 64.0107 64.0910 64.9577 65.8795 66.3367 66.6758 67.4212 67.6295 68.1167 68.2217 68.5807 68.9610 69.3512 69.5514 69.7614 70.1242 70.4892 71.0110 71.4922 71.6772 71.8649 72.4280 72.5384 72.7351 72.9052 73.0729 74.1772 74.2886 74.4410 74.9513 75.1871 75.4773 75.5568 75.7873 75.9459 76.2297 76.8443 76.8882 77.1145 77.4191 77.5688 77.7276 78.0309 78.0651 78.4620 78.5460 78.6298 78.8644 79.1484 79.3815 79.5607 79.8358 80.0983 80.1465 80.3089 80.4473 80.8152 80.9013 81.2406 81.4680 81.7410 82.1082 82.5700 82.8786 83.0950 83.2232 83.3852 83.6805 83.7353 83.8903 84.1937 84.3555 84.4975 84.6290 84.8603 84.9529 84.9862 85.1531 85.4018 85.4717 85.9907 86.1117 86.2869 86.4634 86.7468 86.8320 86.9258 87.1372 87.2876 87.4935 87.6458 87.7536 88.0052 88.2244 88.3790 88.8339 89.0685 89.3287 89.5354 89.6676 89.8745 90.1285 90.4103 90.6516 91.3693 91.6331 91.7390 92.3761 92.4671 92.6283 92.9112 93.1329 93.2133 93.3602 94.1429 94.3121 94.5906 94.8106 95.2842 95.4624 95.6615 95.7776 95.9752 96.2728 96.5293 97.0890 97.3483 97.9193 98.2460 98.4946 98.7844 98.9278 99.0860 99.0971 99.1988 99.5182 100.2924 100.6428 100.9506 101.3150 101.4781 101.6511 101.8637 101.9125 102.1196 102.3471 102.7199 102.9502 103.1502 103.5484 103.8684 104.1062 104.3595 104.5524 104.9115 105.1472 105.5459 105.6537 105.8106 105.9912 106.2769 106.6587 106.7905 107.0064 107.3331 107.4093 107.5797 107.7807 108.1480 108.4287 108.8664 109.3289 109.6256 109.7575 109.8940 110.1952 110.6165 110.8375 110.9959 111.1534 111.6547 111.8527 112.0010 112.2296 112.4887 112.5790 112.9102 113.2671 113.3315 113.8365 114.0077 114.1974 114.4431 114.7808 115.0807 115.3260 115.5735 115.8863 116.4149 116.4233 116.6350 116.7308 116.9936 117.0408 117.3125 117.6724 118.1821 118.3315 118.7562 119.5045 119.5647 120.6283 121.2423 121.5715 121.8402 122.1951 122.3155 123.1584 123.3563 123.6596 124.3569 125.0341 125.3594 125.8636 126.5813 126.9570 127.1087 127.2505 127.3104 127.3825 127.6736 127.9372 128.3514 128.6497 129.1425 129.2358 129.8591 130.8319 131.0592 131.5463 132.1945 132.6823 133.6262 133.6300 134.0019 134.0961 134.2463 134.6148 135.0445 135.2498 135.7364 136.0845 136.9154 137.5141 137.8594 138.3164 138.4411 138.7404 139.0391 139.8351 140.1866 140.7642 140.9222 141.3800 141.8817 142.0685 142.2211 142.9139 143.2594 143.6611 143.6776 143.9157 144.1146 144.2005 144.4144 144.5805 144.7993 145.3686 145.8581 146.1247 146.2611 146.5668 147.2235 147.7533 148.9707 149.2703 149.5952 149.8670 150.1291 150.4408 150.8434 151.0413 151.2272 151.4202 151.5060 151.6296 152.6991 152.7966 152.9366 153.8431 154.6448 154.7747 155.3111 155.4970 155.8802 156.3021 156.4787 157.4285 158.7363 162.5565 164.9080 165.9518 167.7432 169.1537 171.0394 171.4316 171.7714 172.6618 172.7148 173.1819 174.8815 175.2591 176.2393 176.6104 176.9487 178.6988 180.0618 181.5534 182.0023 182.9864 184.8989 186.3455 186.4462 187.7802 188.9919 192.9622 194.4912 195.9047 196.8656 204.5319 208.7390 210.7694 218.1163 219.4577 219.9699 223.9661 226.4274 255.7356 257.3133 267.8312 291.4435 294.1074 309.2605 607.8129 614.0017 621.1824 628.2133 630.1364 631.9239 636.1637 636.3851 637.7092 643.6132 648.6843 711.8935 886.9019 895.4540 1190.0061 1192.5672 1194.6419</array>
                  </list>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:frequencies">
                  <module cmlx:templateRef="vibrations" dictRef="cc:vibrations">
                     <array dataType="xsd:double" dictRef="cc:frequency" size="93">0.00 0.00 0.00 0.00 0.00 0.00 9.53 26.89 36.42 46.52 70.66 85.93 99.71 108.34 145.73 161.56 194.70 233.22 252.29 280.77 289.31 298.11 334.85 360.27 390.44 411.76 452.88 480.58 495.32 505.52 534.75 560.80 586.88 628.13 639.37 699.44 728.29 755.97 775.16 794.13 850.86 860.98 873.70 907.26 916.39 950.04 982.74 1008.00 1026.56 1038.06 1057.34 1086.46 1113.20 1134.40 1142.08 1150.35 1157.68 1193.44 1224.56 1242.14 1296.99 1327.54 1343.30 1345.13 1352.50 1369.46 1400.51 1425.84 1432.40 1458.43 1492.35 1499.62 1507.21 1515.50 1529.00 1564.60 1636.01 1653.90 1891.96 3057.68 3063.85 3093.41 3102.39 3136.14 3153.12 3154.29 3226.52 3228.46 3243.24 3244.52 3591.98 3640.22 3766.56</array>
                     <matrix cols="93"
                             dataType="xsd:double"
                             dictRef="cc:displacement"
                             rows="93">0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.035242 -0.047923 -0.121902 -0.008617 0.051938 0.108548 0.024045 0.062028 0.130294 -0.066068 0.058732 0.107780 0.023590 0.012948 0.056433 -0.003649 0.054107 0.119806 0.011519 -0.004998 -0.010087 0.018569 -0.044206 -0.093713 -0.003180 0.020120 0.057945 -0.065637 -0.058655 -0.134919 0.013644 0.015636 0.057111 0.082632 0.082673 -0.077047 -0.078000 -0.063189 0.137345 -0.054394 -0.102472 -0.224457 0.094929 0.060769 -0.131948 -0.066240 -0.084325 0.081672 0.020334 -0.021189 -0.052330 0.039987 -0.055780 -0.116552 0.069933 -0.051390 -0.103261 -0.118685 -0.049732 -0.123858 -0.085295 -0.044673 -0.108702 0.010770 0.078095 0.158933 -0.029960 0.004545 0.039402 0.137776 0.144093 -0.137740 -0.144779 -0.111323 0.237384 -0.035954 -0.117605 -0.253035 -0.115448 -0.111500 -0.253843 -0.003168 -0.112488 -0.236166 0.161088 0.106784 -0.235845 -0.122781 -0.148815 0.141043 -0.100794 0.020379 0.160302 -0.040589 -0.060659 0.088620 0.009448 0.042056 -0.057779 0.014278 0.045223 -0.071869 0.018437 0.034818 -0.055909 0.019641 0.021207 -0.128928 0.005373 0.046244 -0.057704 -0.009582 0.055033 0.024149 -0.010654 0.045892 0.058642 0.003721 0.031050 -0.036659 0.035160 -0.120999 0.102811 0.006336 0.038462 -0.062401 0.044932 0.107948 -0.157159 -0.048895 -0.068007 0.111152 0.034640 -0.153315 0.146462 0.034392 0.083305 -0.124516 -0.061796 -0.094330 0.146418 -0.021168 -0.019608 0.032390 -0.043895 0.123136 0.156978 -0.013562 0.091745 -0.046889 0.022937 -0.159624 0.200356 0.083169 -0.185825 0.004851 0.005046 0.043322 -0.064800 -0.006760 0.048874 0.051982 0.083906 0.180615 -0.270403 -0.079369 -0.127515 0.197391 -0.015126 -0.092439 0.246092 0.069123 -0.274880 0.178782 0.049679 -0.119472 0.049298 0.066280 0.140196 -0.214302 -0.103095 -0.173694 0.263946 0.037599 0.069694 -0.079136 -0.050407 -0.125881 0.065527 0.004609 0.071807 -0.052233 0.019974 0.087430 -0.155580 -0.061352 -0.061212 -0.000831 0.084632 0.122718 0.242568 0.038071 0.163948 0.078713 0.012321 0.044167 0.006038 0.020511 -0.045172 -0.011289 0.009632 0.062205 -0.079371 -0.017720 -0.084546 -0.026137 0.050461 0.110569 0.120616 -0.008621 -0.024754 0.035690 0.015253 0.104083 -0.164899 -0.000530 -0.252544 -0.050794 -0.025150 -0.077409 0.073152 0.001119 0.054092 -0.130933 -0.022351 -0.043293 -0.004203 -0.013874 -0.072768 -0.023103 0.088171 -0.061623 -0.008451 -0.129160 -0.048056 -0.044936 0.048969 -0.028016 -0.002737 0.062094 0.205812 0.151142 -0.035495 0.075569 -0.066840 -0.010920 -0.052726 0.100340 0.027774 0.171760 -0.247107 -0.070805 -0.319974 -0.082765 -0.032305 -0.274305 -0.063934 0.115010 -0.295676 -0.024560 -0.040614 -0.148564 0.166543 0.004704 0.083864 -0.193770 -0.043354 -0.002937 -0.010451 0.053636 0.069825 -0.058016 0.016483 -0.051245 0.006316 0.052102 -0.029248 -0.092671 0.030022 -0.146751 0.038277 -0.084810 0.075990 -0.100254 -0.035381 0.039806 0.059869 -0.016861 0.141540 0.115356 -0.014910 0.178563 0.030395 0.009047 -0.065145 0.043064 -0.081344 -0.109939 0.031970 -0.050285 0.087875 0.012250 -0.009811 -0.067756 0.060757 0.035613 -0.036088 0.016577 -0.074387 -0.091510 -0.080083 -0.001224 -0.033878 0.041216 0.045965 -0.001298 -0.004485 0.030674 0.004815 -0.001292 0.028282 0.336700 0.176100 -0.012351 0.272775 -0.191480 -0.105985 -0.198924 0.254207 -0.115434 -0.257292 -0.110271 -0.083470 0.002510 0.045793 0.020223 0.119854 0.146097 -0.028095 -0.088422 0.081480 0.050980 -0.037141 0.007310 -0.043771 0.056483 0.067011 -0.127265 -0.312883 -0.078878 -0.047381 -0.006839 -0.315622 -0.015640 -0.031187 0.049292 0.067087 0.024733 -0.031202 0.089274 -0.038019 -0.032296 0.034037 0.037402 -0.062863 0.005733 -0.006400 0.015498 0.029603 0.000729 0.034278 0.068682 0.039109 -0.003375 -0.140248 0.105796 0.107084 -0.069506 -0.013116 -0.058767 -0.029764 0.031995 -0.234911 -0.041079 0.042130 -0.115826 -0.012986 -0.046466 0.075023 0.091639 0.046831 -0.048113 -0.076410 0.056248 -0.053647 -0.011645 -0.048294 0.076757 -0.011938 -0.044228 0.070410 0.097185 -0.184159 0.156992 -0.004202 -0.035332 0.054151 -0.004445 -0.030866 0.047056 0.005342 -0.015836 0.022965 -0.096471 0.037715 -0.091858 -0.082156 0.039489 -0.089069 0.007829 0.111017 -0.147861 0.277554 0.147537 -0.043811 -0.105443 -0.015657 -0.005278 -0.019441 0.039783 -0.300834 -0.013107 -0.052762 0.085077 -0.013850 -0.046726 0.074675 -0.101820 -0.317619 0.131120 0.204244 -0.152405 0.206298 0.194930 -0.266702 0.297218 -0.001160 -0.031049 0.046896 -0.001788 -0.023650 0.034670 0.041777 -0.057007 0.006486 0.015515 -0.003469 -0.017054 0.007026 0.007203 -0.000194 0.010935 0.012681 -0.044316 0.017121 -0.029942 0.011199 0.041102 -0.032786 -0.132135 -0.002709 0.034743 0.019969 -0.028268 0.009224 0.076156 -0.022848 -0.027393 0.047558 0.004034 -0.002242 0.019954 -0.066894 0.176596 0.000696 0.003145 -0.000468 -0.025407 0.007802 -0.008051 0.023681 0.000209 -0.003584 0.017506 -0.043063 -0.102437 0.013880 0.009324 -0.011645 0.018383 0.001361 -0.007092 0.011955 0.007934 -0.008099 0.007679 -0.025550 -0.156303 -0.087491 0.019962 -0.104667 0.207451 -0.229091 0.312074 -0.218449 0.043502 0.396509 0.179558 -0.004573 0.028270 0.007859 -0.041404 0.009266 0.106649 0.011420 -0.007323 0.027989 -0.002604 -0.001586 0.017431 -0.153951 -0.371849 -0.219862 -0.080928 0.110807 -0.031295 0.126670 -0.263512 0.302695 0.012684 -0.014150 0.018691 -0.002023 -0.007274 0.007049 0.069129 0.079491 -0.044309 -0.001238 -0.017629 -0.065688 -0.017934 0.048260 0.037357 0.011046 0.075936 -0.150836 -0.050171 -0.161990 0.112130 0.112825 -0.046131 -0.187316 -0.030471 0.172476 0.167927 -0.021486 -0.053610 -0.144098 -0.020536 -0.114737 -0.084823 -0.028937 0.031802 0.072913 0.100500 -0.093713 -0.023962 0.025798 0.000029 -0.078446 -0.014071 -0.001722 0.101964 -0.051331 0.029662 0.047438 0.070045 0.131509 0.129867 -0.012181 -0.029357 0.085027 -0.048395 0.008039 0.021862 -0.024125 -0.012989 0.025705 -0.087306 -0.136892 -0.074595 -0.012920 -0.130207 -0.050754 0.272626 -0.145816 -0.003718 0.067334 -0.173795 -0.091619 -0.001202 0.228432 0.272773 -0.100333 -0.036591 -0.041814 0.000643 -0.002764 0.129084 -0.069881 0.048849 0.040767 0.105433 0.253466 0.245454 0.198766 0.114740 0.196021 -0.119525 0.207262 0.073731 0.004047 -0.054279 0.101089 -0.061800 0.012883 -0.009991 0.008808 -0.040522 0.046628 0.054189 -0.008442 -0.079209 0.033000 0.052821 -0.060509 -0.000013 0.046784 -0.107836 0.183544 0.095495 -0.086332 0.048196 0.003972 0.129693 -0.011357 0.034458 -0.134190 -0.104151 -0.056023 0.032108 -0.102557 -0.135439 0.065004 0.008493 0.010277 0.073655 -0.128548 -0.091245 0.048310 -0.022570 0.002792 0.007880 0.022252 -0.015968 0.091972 -0.017346 -0.015255 0.093475 -0.142167 0.079897 -0.014061 0.024749 -0.042314 0.084347 -0.020647 -0.044925 0.089980 0.014318 -0.036073 0.052186 -0.142081 -0.191602 0.024663 -0.056257 -0.167694 0.115963 -0.044317 -0.123303 0.071851 -0.230207 -0.140277 0.051713 0.002718 0.068449 -0.068057 -0.122982 -0.025396 -0.113858 0.041406 -0.004483 0.096226 -0.029735 -0.008555 0.094999 -0.031490 0.163800 0.011146 -0.163768 0.082261 -0.024946 -0.242162 0.132527 -0.076800 0.041029 -0.049655 0.080397 -0.041953 -0.059280 0.089593 0.328966 0.353214 -0.263598 -0.054034 0.088336 -0.078326 -0.018572 0.012630 -0.051371 0.002330 0.020623 -0.029817 -0.101964 0.062336 -0.060947 0.088442 -0.018027 0.028238 0.076678 -0.011056 -0.014483 0.133154 0.016102 0.073744 0.146151 0.063525 0.018643 -0.051405 -0.040746 -0.017627 0.107832 0.032569 -0.002824 0.100548 -0.019610 0.039578 -0.100947 -0.072670 0.047981 -0.079696 -0.088645 0.058348 0.122662 -0.022264 -0.079581 -0.124397 -0.092974 0.110023 -0.099989 -0.109111 0.122024 -0.107615 -0.065801 0.079279 0.185731 0.096068 0.032989 0.130597 0.083636 -0.020912 0.060972 0.036661 0.016261 0.106082 0.036091 0.002034 0.132961 0.039016 0.018319 0.149383 -0.002587 0.142539 -0.113518 -0.073037 0.028041 -0.074891 -0.089083 0.053605 0.132007 -0.038932 -0.104361 0.060059 -0.042490 -0.108517 0.185420 -0.032849 -0.097878 -0.136581 -0.102847 0.130259 -0.093214 -0.120890 0.159912 0.062948 0.555586 -0.173055 0.038637 0.117269 0.089222 0.022896 0.014587 -0.006293 0.251990 0.092722 0.084460 -0.231894 0.087220 -0.013333 0.023633 0.030621 -0.010805 -0.038331 0.097234 0.033356 -0.083255 -0.003050 -0.048471 -0.088061 -0.112818 -0.009799 0.030958 -0.166446 -0.092083 -0.065481 -0.045918 -0.001841 -0.024079 0.043081 -0.015934 -0.005811 -0.142926 -0.094179 0.083711 -0.151216 -0.064489 -0.080636 0.036248 0.060042 -0.017786 -0.085586 -0.053601 0.094193 -0.089439 -0.028589 0.042045 -0.054492 -0.018610 -0.155854 -0.193782 -0.061666 -0.021254 -0.161846 0.072156 -0.009243 -0.043616 -0.039934 -0.082534 -0.038532 0.016083 -0.047988 0.118234 0.107676 -0.161304 0.019959 0.020052 -0.036966 -0.154350 -0.119637 0.124168 -0.180447 -0.064125 -0.063424 0.041435 0.055385 -0.028661 0.097758 0.078533 -0.160373 0.041263 0.105018 -0.067946 -0.057580 -0.047642 0.134627 -0.071169 -0.009295 -0.146220 0.512644 0.004194 -0.005866 0.023915 -0.019497 0.014504 0.023925 -0.020113 0.030380 0.020381 0.035841 0.024054 0.012630 -0.014608 0.024430 0.010555 -0.015147 0.008496 0.012605 -0.014988 -0.003401 0.009345 0.006783 -0.004410 -0.019162 0.021125 0.007899 0.011293 -0.045363 -0.013413 -0.007934 0.015854 0.015886 0.017915 0.000707 -0.009526 -0.012444 -0.005035 -0.003789 -0.014159 -0.006770 -0.013781 0.003291 -0.007875 -0.028105 -0.039017 0.043174 -0.018486 -0.038161 0.036163 -0.023299 -0.031340 0.033037 -0.020841 -0.038869 0.008611 0.013152 -0.031227 0.040313 -0.013589 -0.006562 0.012368 -0.027693 -0.006043 0.025966 0.000965 -0.020932 -0.091428 -0.017020 0.016205 0.005145 -0.010490 -0.008715 -0.016080 -0.000654 -0.007668 -0.015435 0.005957 -0.001821 -0.025893 -0.029918 0.021750 -0.018244 -0.016784 0.000695 0.000845 -0.035434 -0.052162 0.063645 -0.019001 -0.046008 0.053422 -0.321540 -0.871513 0.286580 -0.005638 -0.001361 -0.000691 0.001122 -0.002707 0.001624 0.001269 -0.002719 0.000539 0.006243 -0.002814 0.001484 -0.023638 0.022551 -0.006276 -0.001291 -0.002083 -0.000412 0.006599 0.021210 -0.001121 0.009644 0.003216 0.005733 -0.002051 -0.001648 0.004708 0.017774 -0.087717 0.019667 -0.001942 0.016982 -0.001613 -0.002834 0.001341 0.001462 -0.002649 0.000223 0.000786 0.011406 0.020233 -0.012806 -0.001624 0.004432 -0.003239 -0.001888 0.003073 -0.003491 -0.003135 0.003685 -0.003648 -0.005164 0.060154 0.073575 0.013595 0.037080 -0.075531 0.069735 -0.128391 0.084173 -0.031033 -0.154503 -0.026357 -0.007734 -0.007825 -0.004826 -0.000256 0.021925 0.010427 -0.004173 0.000336 0.001668 -0.003731 0.000284 0.001556 0.153632 -0.278036 -0.438735 -0.047362 0.593034 -0.113071 -0.079896 -0.145535 0.478476 -0.000114 0.005128 -0.005231 -0.000499 0.004478 -0.004427 0.017309 0.021060 -0.010299 -0.257722 0.040207 0.010372 0.103831 -0.015232 0.077310 0.260410 0.041293 0.043541 0.352506 0.006789 0.056445 0.052745 0.013089 -0.003492 -0.006907 0.036142 0.021661 0.015239 0.013032 0.019634 0.027826 -0.058356 0.030595 -0.053626 -0.147797 0.141468 0.023343 0.001323 0.017909 0.029234 0.025048 0.006871 -0.100961 -0.046241 0.024447 -0.104537 -0.098227 -0.018832 0.028865 0.002214 -0.024547 -0.075277 0.060886 -0.155552 -0.065845 0.011425 -0.203223 -0.140853 0.051990 -0.198946 -0.020336 -0.135146 -0.026310 0.081211 -0.104049 0.110837 0.016909 0.017796 -0.016662 0.009130 0.026468 0.053586 -0.018925 0.053707 0.091118 -0.010049 0.023890 0.019758 -0.157235 -0.087293 0.027966 -0.175177 -0.088120 0.024176 0.043196 0.061596 0.033608 0.000216 -0.093901 -0.027120 0.046490 0.036538 -0.125669 -0.003694 0.063451 -0.217143 -0.002135 0.073850 -0.243835 0.416898 -0.076524 -0.107707 0.003139 -0.000041 -0.003339 -0.003246 -0.023336 0.005074 -0.083315 -0.057677 0.037522 -0.005568 -0.018109 0.004362 -0.092821 0.149674 -0.068205 0.016202 -0.018850 0.010218 0.008431 0.113884 -0.020634 0.041473 -0.204452 0.084983 0.004618 0.006074 -0.013935 0.058135 -0.030496 0.062118 0.017586 0.128220 -0.020472 -0.000253 0.000837 -0.005339 0.005195 0.002194 -0.007039 0.070811 0.013449 -0.071194 -0.001523 -0.001880 0.001346 -0.001862 -0.009308 0.013997 -0.001339 -0.005665 0.009594 -0.186125 -0.475550 -0.087707 0.253511 -0.366987 0.361965 0.059113 0.015080 -0.044992 0.002876 0.036823 0.166321 -0.059046 -0.112587 -0.110771 -0.106181 0.157087 -0.008015 -0.002004 -0.000559 -0.004148 0.010633 0.004533 -0.013740 0.164481 0.107007 -0.024144 -0.033975 -0.101059 -0.109913 0.088388 0.070069 -0.230342 -0.002915 -0.000013 0.000337 -0.004265 -0.015510 0.024392 0.052225 0.135776 -0.044795 -0.013356 -0.103574 -0.062884 0.025760 -0.021951 -0.031455 0.275490 0.067056 -0.016611 -0.156079 -0.056275 -0.009562 -0.075533 -0.041652 0.021688 -0.046618 -0.039520 -0.089418 -0.009606 -0.061643 -0.107093 -0.019566 0.004605 0.147649 -0.005543 0.000150 0.046655 0.034383 0.034263 0.168574 -0.033458 -0.072377 -0.068384 -0.052913 0.061734 0.034747 0.035898 0.035776 0.067846 0.062561 -0.016767 -0.128670 -0.042593 0.144059 0.075572 0.032502 0.146625 0.063394 -0.011255 0.155371 0.069571 -0.097308 -0.004359 0.177013 -0.123320 0.007917 0.192891 -0.032970 0.048232 0.172962 -0.029116 0.035653 0.204236 -0.005710 0.044681 0.062497 0.026250 -0.076075 -0.091279 -0.106598 0.041485 -0.003814 0.077111 -0.001591 0.079224 0.198508 -0.007066 -0.203485 -0.192804 -0.089177 -0.248316 0.209031 -0.009400 -0.255014 -0.094495 0.174742 0.082468 0.097703 0.187956 0.074841 -0.191195 0.004091 0.086586 -0.048755 -0.062906 -0.074329 0.056742 -0.057376 -0.018153 0.102733 -0.053088 0.074224 -0.031887 -0.034343 -0.023825 -0.002155 0.056228 -0.011004 0.064885 -0.053472 -0.007919 0.019490 0.071460 0.116682 0.022266 -0.055498 -0.133496 0.037637 0.027937 -0.052250 -0.067457 -0.044574 -0.171561 0.036051 0.056330 0.043669 -0.045195 0.058956 -0.020019 0.048873 0.028798 -0.006768 -0.104199 0.019869 0.145412 -0.063773 0.095328 0.079082 0.007121 0.064429 0.091237 -0.054815 0.088851 0.094398 0.071368 -0.107211 -0.212762 0.185403 -0.094893 -0.123354 -0.000926 -0.046882 -0.202019 -0.014009 -0.023616 -0.177287 0.006403 -0.132845 -0.119130 -0.034797 0.086694 0.153204 -0.104944 0.040623 -0.072258 0.089864 0.019353 -0.025510 -0.251785 0.034585 0.255328 0.181641 0.069391 0.283501 -0.273280 0.026035 0.253542 -0.104889 0.109910 0.095031 0.066612 0.081272 0.149642 0.017096 0.163880 -0.033456 -0.063845 0.041650 -0.037654 0.078585 -0.027969 0.045870 -0.016254 -0.069211 0.111819 0.029582 -0.101954 0.071241 0.087712 0.019790 0.008465 0.061478 0.003612 0.047142 -0.031300 -0.039972 -0.176195 -0.085055 0.077851 0.060408 0.091815 0.109808 -0.135031 -0.062920 0.029313 0.100278 0.021027 0.019393 -0.079302 0.051627 0.079375 -0.075248 0.029236 0.065085 -0.119650 -0.066853 -0.011795 -0.020517 -0.010273 -0.041019 0.054442 -0.045463 -0.086090 0.057109 -0.077416 -0.091473 0.083857 -0.091128 0.161464 0.151558 -0.232197 0.136560 -0.003011 -0.106922 0.017092 0.150883 -0.089424 0.000551 0.082471 -0.037181 -0.111040 -0.085936 0.030388 -0.030159 -0.389661 0.058036 0.101529 -0.119701 0.015164 0.135400 -0.185883 -0.026309 -0.033722 -0.071216 -0.164998 -0.014782 -0.069095 0.001193 -0.024581 -0.037349 0.026436 -0.082836 0.072789 -0.055241 -0.116619 0.112899 0.233543 0.401001 -0.112278 -0.016355 0.087187 0.026225 0.026237 0.034471 0.006300 0.188344 0.100138 -0.062978 -0.042163 -0.114145 0.056727 -0.263811 -0.044581 0.008980 -0.015547 -0.122254 -0.118893 0.027163 -0.018539 0.117385 0.054170 -0.070282 -0.022746 0.034393 0.189142 0.004183 0.020753 -0.019591 -0.056919 -0.059834 -0.103149 0.018547 0.137458 0.137340 0.015681 -0.089733 0.146982 -0.035800 0.020042 0.005971 0.017332 0.090991 -0.119671 0.023963 -0.105510 -0.093026 -0.052784 -0.026873 -0.178742 -0.012098 0.068438 -0.129206 -0.091980 0.139778 -0.109473 0.027473 0.042702 -0.004930 -0.101634 0.029341 0.010950 -0.028047 0.083740 -0.006281 0.014615 0.021235 -0.038074 0.248172 0.266068 0.215806 0.027491 -0.203623 0.254753 -0.072622 -0.009319 0.025250 0.057838 0.086876 -0.000124 0.051685 -0.024851 0.016841 0.022095 0.226029 -0.221896 0.035725 -0.225523 -0.143956 -0.124790 0.041613 0.105246 -0.011955 0.023173 -0.022051 -0.041040 -0.032848 0.024709 0.035222 0.009734 0.051082 -0.022455 0.185812 0.084270 0.008248 -0.165928 -0.084207 -0.014240 -0.093395 0.095230 0.148021 -0.049484 -0.055029 0.082147 -0.008188 -0.026049 -0.019699 0.020765 -0.032450 -0.162636 0.083218 0.003248 -0.009626 -0.121673 -0.079082 0.087069 -0.038921 -0.015557 -0.169039 0.110560 0.003554 -0.164278 0.113445 0.001181 -0.039743 -0.078794 0.022939 0.028126 0.035933 -0.008259 0.105436 -0.039589 -0.007216 0.165256 0.010794 -0.016450 -0.018565 -0.028504 -0.025361 -0.010285 0.109025 0.010830 -0.041813 0.104000 0.008264 -0.015534 -0.010273 0.202303 0.299217 -0.054247 -0.077799 0.234119 -0.084553 -0.000055 -0.277268 0.231610 0.024836 -0.272185 0.146941 0.003144 -0.058693 0.051962 -0.018526 -0.069295 0.149491 0.004443 -0.074876 -0.164033 0.099530 0.006358 0.109655 0.014516 0.168111 0.258592 0.030252 -0.158502 0.004251 -0.000953 0.004730 -0.005003 0.006142 -0.008618 0.020278 0.013742 0.006034 -0.015514 -0.020798 0.001859 0.008328 -0.002542 0.003675 -0.004043 -0.004357 -0.016860 -0.001037 0.000230 0.004712 0.001190 0.000534 -0.002122 -0.009596 -0.000142 0.012167 0.002640 -0.000260 -0.003063 0.000941 -0.000224 0.000395 -0.058274 -0.112538 0.181401 0.043669 0.107297 -0.147786 0.003493 0.000195 -0.000516 0.060673 0.111908 -0.174467 -0.060427 -0.103693 0.160880 0.006552 0.005934 -0.014381 0.002995 0.001043 -0.002568 0.002569 0.000622 -0.003240 0.004068 -0.000549 -0.003072 0.004311 -0.000647 -0.004409 -0.005375 -0.033989 -0.093315 -0.002836 0.000031 0.011393 -0.127475 -0.255079 0.414174 0.113697 0.249509 -0.353416 0.002723 0.000009 -0.000263 0.004759 0.000554 0.000038 0.002868 0.000108 0.000147 0.121769 0.227072 -0.353524 -0.124255 -0.219704 0.327093 -0.018572 -0.028545 0.004856 -0.101285 0.014660 -0.023675 0.090789 -0.059527 0.031812 -0.049588 -0.091901 -0.219035 -0.071259 0.249220 -0.057495 -0.142926 0.003171 -0.038863 0.076974 -0.001514 0.144039 0.065709 -0.032800 -0.065196 0.028043 -0.009359 0.031214 0.104733 0.000863 0.042726 -0.051459 0.000217 0.025779 0.018724 -0.040415 0.012623 0.071352 0.016514 0.074335 0.066382 -0.007772 -0.001361 -0.077526 -0.002585 0.021252 0.071421 0.028957 0.016540 0.044128 -0.046927 0.009625 -0.016285 -0.004275 -0.015040 0.031624 -0.008944 0.031067 0.005827 -0.004259 0.033049 -0.081227 0.005131 0.030639 -0.085576 0.011784 0.057689 0.121251 0.174706 0.540532 0.104478 -0.033355 -0.156901 0.042274 -0.008800 0.091419 0.023165 0.034268 -0.017660 -0.093829 0.002528 0.037764 -0.048140 -0.001515 0.036917 -0.093896 -0.001500 0.030927 0.143840 -0.000421 -0.006446 0.072597 -0.043225 0.047424 -0.355980 -0.047258 0.380833 0.000892 0.018800 0.007509 0.006000 -0.165392 -0.079332 0.114353 -0.159228 0.078204 -0.022601 0.094388 -0.209366 0.140224 -0.022008 -0.004686 -0.094447 0.115680 0.147562 -0.183172 0.012199 0.098535 -0.138567 0.006100 -0.062467 -0.005164 0.095973 0.082572 0.098505 0.009465 -0.014657 -0.112372 0.072018 0.082886 0.054206 0.125183 0.070446 -0.053782 0.132989 0.045952 0.162175 0.003732 -0.049991 0.055639 -0.024246 0.004157 -0.052269 -0.012700 -0.027634 -0.008426 -0.078903 -0.007090 -0.133869 0.044848 -0.024752 -0.167013 0.015027 -0.072217 0.169053 0.003988 -0.045361 0.171148 -0.014902 -0.082543 -0.268762 -0.058047 -0.001047 -0.214021 0.023824 0.118168 0.134322 0.171930 0.081584 -0.128629 0.207316 0.016625 0.225845 -0.008380 -0.104497 0.041514 -0.014751 -0.110979 0.234569 0.001858 -0.099197 0.166986 -0.069929 -0.028209 -0.136193 -0.032220 -0.111575 -0.140666 0.002529 -0.020093 0.156342 -0.008745 0.037302 -0.071061 -0.078326 -0.032574 0.136938 -0.018618 0.033662 0.093790 0.056104 -0.096597 -0.041245 0.023332 -0.028885 0.048070 -0.003106 0.169070 0.177543 0.010645 -0.178755 0.112859 0.001398 0.064362 -0.164027 0.021911 0.034829 -0.094275 -0.004724 0.043170 0.094699 -0.016826 0.010358 -0.112825 0.046250 -0.048760 -0.146190 0.112233 -0.028858 -0.159743 -0.004881 0.041437 -0.095597 -0.026958 -0.062918 -0.137435 0.048382 -0.019577 -0.021813 -0.065406 0.055508 0.065380 -0.046556 0.039478 0.133333 -0.012400 0.089919 -0.173998 0.000782 0.079162 -0.174627 0.013913 0.109798 0.126050 0.109332 0.345062 0.149181 -0.006931 0.031806 -0.039792 0.113711 -0.098406 -0.123089 0.177678 -0.116756 -0.200824 0.005943 0.080653 -0.074999 0.010986 0.084526 -0.213375 -0.003400 0.078328 -0.108059 0.050756 -0.140851 -0.217399 0.054715 -0.159862 0.102092 -0.066981 -0.173919 0.002123 0.012347 -0.021193 -0.016217 -0.019093 0.060022 -0.009721 -0.003267 -0.090940 -0.038091 0.041022 0.055836 0.110894 0.020083 0.017069 -0.042893 -0.063038 -0.123593 -0.010861 0.048767 0.019983 0.000769 0.005296 -0.004699 -0.062399 -0.141538 0.199138 0.006308 -0.003782 -0.008868 0.014963 0.039755 -0.039851 0.028206 0.041684 -0.080197 0.035167 0.042551 -0.087770 0.010121 0.000822 -0.001521 0.011742 0.023616 -0.030167 0.015906 0.018112 -0.024409 -0.075424 -0.141201 0.224939 -0.024629 -0.024633 -0.023806 0.046406 -0.013881 0.015437 0.011683 -0.007538 -0.002912 0.013698 -0.009551 -0.019214 -0.061996 -0.010809 0.040680 -0.017115 0.053757 0.006113 0.114032 0.217435 -0.365818 0.134575 0.241754 -0.376987 0.011800 0.000581 -0.002888 0.013669 0.006397 -0.000602 0.004227 0.000955 0.002402 0.104073 0.211779 -0.317140 0.122859 0.212098 -0.302536 -0.111997 -0.058519 0.162820 -0.016322 0.002266 -0.004153 0.001693 -0.004204 -0.028285 -0.037112 -0.027713 0.091034 0.002274 -0.045062 -0.019311 0.007653 0.003871 0.008289 -0.036872 0.039791 -0.089208 0.012189 0.022341 0.000816 0.016962 0.003121 0.005654 0.011091 0.000600 0.007106 -0.004750 -0.001677 0.001134 0.009773 -0.008070 -0.041666 0.017210 0.001975 0.013002 0.019576 0.004603 -0.002602 -0.009186 -0.000049 0.002968 0.018421 0.002355 0.004529 0.014331 -0.008895 0.003545 0.003430 -0.003012 -0.000346 -0.004384 -0.017724 -0.005931 0.042430 -0.008260 0.019805 -0.014166 -0.000580 0.006128 -0.009550 0.000058 0.005986 0.078311 0.466517 0.827568 -0.016325 -0.001819 0.226044 0.018602 0.002463 0.014676 0.009683 0.004996 0.005131 -0.011224 0.001302 0.005929 -0.001756 0.002531 0.006662 -0.015441 0.000561 0.006177 0.032258 -0.002244 -0.000837 0.015997 -0.012271 0.013914 0.016161 -0.043434 -0.047681 -0.091550 0.013935 -0.028718 -0.053011 0.052980 -0.106381 -0.033760 0.046994 0.112316 0.003640 -0.082243 -0.102366 -0.069556 -0.026952 -0.000333 0.007112 0.075720 0.120068 0.071030 -0.024159 -0.100470 0.048762 0.002103 0.019620 0.016050 -0.070904 0.130485 -0.022467 0.001259 0.015470 0.009211 -0.040255 0.058945 0.095825 -0.002064 0.031024 0.096862 -0.004801 0.046158 -0.047773 -0.001761 0.009549 0.100065 0.010876 0.001345 0.108271 -0.004674 -0.014123 0.000780 -0.061495 0.081947 0.039374 0.006970 0.029631 0.026332 0.013072 0.008559 -0.060794 0.009258 0.023726 -0.054590 0.015592 0.049916 0.031491 -0.156261 -0.524868 -0.035516 -0.067425 0.463949 0.162030 0.086630 -0.077803 0.154664 0.067479 -0.075461 -0.061593 0.002267 0.023296 -0.022692 -0.000656 0.022968 -0.060941 -0.001218 0.018552 0.194876 0.078901 -0.149835 0.186754 0.110397 -0.154955 0.069998 -0.023277 -0.222031 -0.006391 -0.000359 -0.000038 -0.017491 -0.017631 0.028664 0.014544 -0.006941 -0.057545 0.017441 0.031195 0.027523 0.060065 -0.011493 0.026337 -0.030503 -0.059074 -0.015829 0.013142 0.057649 -0.101510 -0.015588 0.011939 -0.003637 0.016094 0.029124 -0.044452 -0.003428 0.000374 0.013399 -0.020280 0.003635 0.012414 0.008386 0.001697 -0.007323 0.008750 0.006265 -0.005123 -0.009922 -0.000101 0.000225 0.001105 -0.009710 0.015292 0.001479 -0.009979 0.015530 0.012677 0.021508 -0.032747 -0.085213 -0.025389 -0.008550 0.023285 -0.006480 0.022667 -0.025482 0.006240 0.019544 -0.006782 0.002602 0.018559 -0.054956 -0.093040 -0.062791 -0.202289 -0.011080 0.929709 -0.005948 -0.027510 0.040169 -0.005053 -0.026899 0.041069 0.004178 0.001291 -0.006436 -0.024964 -0.000035 -0.007316 -0.004132 0.001209 -0.006478 -0.019822 -0.054961 0.083231 -0.019684 -0.054703 0.085115 -0.003144 0.026986 0.064140 -0.070865 0.002220 -0.020226 -0.172161 -0.059544 0.042362 0.081251 0.051392 -0.030015 0.033035 0.039287 -0.000543 0.091706 -0.009883 0.003505 -0.134776 -0.039340 -0.009983 0.059074 0.058310 0.014265 0.100002 0.008957 0.028832 0.002843 0.064597 -0.045627 -0.011141 -0.010068 -0.006095 -0.017261 0.022431 -0.036199 0.033081 0.035420 -0.013964 0.143693 0.081965 0.051464 -0.033876 -0.002992 0.006340 0.017881 -0.072176 0.002899 0.130628 -0.059627 0.050028 0.068056 0.001484 -0.057239 0.037750 -0.112247 -0.065326 0.210805 -0.058105 0.124219 -0.030179 -0.030688 0.049804 -0.046165 -0.031563 -0.008226 -0.136511 -0.019214 0.051432 0.246046 0.083573 -0.630029 0.085054 0.015696 0.115105 0.144227 0.011467 0.128962 -0.061458 0.002028 0.029726 0.030458 0.019283 0.036828 -0.081011 -0.003287 0.041594 0.009458 -0.180062 0.132115 0.064426 -0.156675 0.168208 0.107366 -0.104422 -0.207427 -0.030373 0.026851 0.008004 -0.067620 -0.036173 0.006215 0.039023 0.002870 -0.003939 0.014069 0.005561 -0.041178 0.038681 -0.007265 0.000759 -0.057810 -0.014331 0.012693 0.023495 0.025831 0.000273 0.039284 0.004690 0.011201 0.002192 -0.073442 -0.075576 -0.004160 -0.003741 -0.001447 -0.012515 0.009856 -0.007244 0.305461 -0.206157 -0.051582 -0.213735 -0.117761 -0.168600 -0.013617 -0.001343 0.002251 0.286412 0.114609 0.187927 -0.242779 0.188167 0.057338 0.023788 0.108709 0.051396 0.009353 -0.048981 -0.029322 0.086568 -0.025140 0.054803 -0.012093 -0.013204 0.023960 -0.018976 -0.014513 -0.004098 -0.073836 -0.022143 0.022039 0.094421 0.032943 -0.225369 0.229689 -0.253199 -0.061804 -0.099907 -0.211542 -0.148392 -0.024217 0.000430 0.011105 0.011230 0.007606 0.013997 -0.031807 -0.001638 0.016323 0.176902 0.143333 0.244043 -0.168890 0.198447 0.157191 0.031106 -0.045635 -0.097247 -0.032309 0.003979 -0.008943 -0.095140 -0.001445 0.002144 0.046215 0.059965 -0.010233 0.023515 -0.001723 -0.000820 -0.008807 0.085946 -0.084780 0.197933 -0.168410 -0.008586 -0.063370 -0.059828 -0.014463 -0.165298 -0.036538 -0.045977 -0.040882 0.006657 -0.015909 0.005484 0.007080 0.021833 0.110688 0.076538 0.173218 0.027700 -0.054224 -0.009410 0.023926 0.028293 0.040322 0.036140 0.004812 -0.001269 0.033500 -0.028048 -0.018695 0.030995 0.031161 0.020758 0.034604 -0.012050 0.023276 -0.042552 0.218330 0.158280 -0.353445 0.101074 -0.265493 0.033059 0.068141 -0.137282 0.074003 0.088597 0.068199 0.338837 0.079631 0.408769 -0.283070 0.034437 -0.040380 0.078106 -0.034057 0.018504 0.076795 0.001241 0.033652 0.104775 0.009448 -0.040284 -0.077139 -0.021616 -0.056440 0.093923 0.014263 -0.067550 0.016443 0.002638 -0.041818 0.020287 0.040880 -0.016599 0.091416 -0.096134 -0.175764 0.004316 -0.006276 0.010146 0.011509 0.010363 -0.011101 -0.014600 -0.000208 0.011566 -0.010521 -0.012517 -0.014773 -0.016593 0.015969 -0.012311 0.019196 0.013520 -0.004846 -0.002107 -0.027769 0.000585 -0.007733 -0.014826 -0.000755 -0.063951 -0.155657 0.237448 0.000546 -0.005644 0.002367 0.028647 0.007514 0.025586 0.038986 0.099038 -0.128071 0.041147 0.081068 -0.146791 0.001679 0.000004 0.000323 -0.047750 -0.069351 0.129354 -0.046874 -0.091613 0.117348 0.063263 0.146666 -0.225400 0.032304 0.076626 0.074891 -0.062826 0.038878 -0.096064 -0.021562 0.034067 -0.075179 0.019987 0.056968 0.058265 0.038759 0.007950 -0.053629 -0.043132 -0.013735 0.011715 0.066882 0.177889 -0.272178 0.064253 0.173344 -0.264734 0.024392 0.015699 0.003298 -0.006183 0.004586 -0.004234 -0.014893 0.010433 -0.013716 -0.126536 -0.241697 0.388021 -0.130495 -0.266315 0.386843 -0.029034 -0.003658 0.022465 0.001457 -0.000586 0.000815 0.002160 0.008557 -0.004538 -0.002708 0.010720 0.002960 -0.000712 -0.007049 -0.006423 0.001647 -0.020964 -0.015196 0.034781 -0.025883 -0.000298 -0.004573 0.010761 -0.016906 -0.033050 0.047047 -0.018536 -0.000344 -0.010092 0.015612 -0.005197 0.065302 -0.003373 -0.012068 0.000232 0.061750 -0.001056 0.005018 -0.002553 0.001067 -0.001263 -0.006470 0.001204 0.012133 -0.000721 -0.003858 -0.000532 0.006303 -0.001250 -0.006898 0.003130 -0.000546 0.006954 -0.010519 -0.065933 -0.238314 -0.301972 0.026247 -0.126068 0.349910 0.225546 -0.188260 0.437655 -0.158427 -0.342378 -0.354119 0.066363 0.015761 0.055323 0.014388 0.009056 -0.045729 -0.000243 0.013461 -0.021176 0.001046 0.012012 -0.021133 -0.189875 -0.139168 -0.048378 -0.017668 -0.093455 0.002656 0.240000 -0.083160 0.063336 -0.002073 -0.003170 0.008026 0.001893 -0.006835 0.007536 0.003719 -0.001271 -0.012798 0.057765 -0.006276 0.014295 -0.005440 0.008063 0.000152 -0.016215 0.024490 0.009052 -0.010020 -0.024089 -0.018658 0.053743 -0.080289 -0.129976 -0.108489 -0.028476 -0.127286 0.047680 0.022574 -0.135543 0.080655 -0.009915 0.017277 0.151571 0.002122 0.009405 0.003661 -0.033250 0.017808 -0.120852 0.092846 0.459260 -0.034554 0.145955 0.094130 -0.019117 -0.148028 -0.094624 -0.028465 -0.011886 0.001777 -0.005912 0.148730 0.082092 0.009945 -0.135639 -0.101757 -0.140324 0.004749 -0.017967 0.020365 0.048893 0.111334 0.085379 0.033768 -0.089204 -0.145668 0.080779 -0.152674 0.047293 0.152625 0.196412 -0.083057 0.069175 0.065916 0.048984 0.063696 -0.367779 -0.197012 0.075792 0.026023 -0.197122 -0.078926 -0.052694 0.071623 0.073357 0.033768 -0.000992 0.060035 0.007852 -0.178500 0.040290 -0.018755 0.147099 0.062963 0.070633 0.152207 -0.083860 -0.012536 0.011108 0.052197 -0.027622 -0.065141 0.007538 -0.016888 0.129533 0.006459 -0.021402 -0.021656 -0.085935 0.005076 -0.011922 0.009456 0.084300 0.007953 -0.077560 -0.081325 -0.074529 0.088444 -0.130474 0.032361 -0.002899 -0.093466 0.086722 0.003336 0.021876 -0.172240 0.011185 -0.033317 0.003537 -0.014070 0.003474 -0.114335 0.045306 0.314031 0.027874 -0.187404 -0.117392 0.008164 0.197966 0.124279 -0.021976 -0.007423 -0.001881 -0.017039 -0.200582 -0.128458 -0.035604 0.202671 0.122372 0.180556 -0.019333 0.039511 0.042432 -0.012668 0.028990 0.098205 0.003368 0.013328 -0.077505 0.022554 -0.030020 -0.005210 0.050312 0.080817 -0.118840 0.081505 -0.098756 0.070837 -0.003557 -0.168971 0.231621 -0.101633 -0.030460 0.203089 0.071633 0.138935 -0.000852 0.030824 0.027750 0.027714 0.031814 0.019346 -0.107642 0.013242 0.009458 -0.228271 -0.069105 -0.128832 -0.254097 0.109665 0.016651 -0.070028 0.180517 0.275616 0.002846 0.001211 -0.001091 -0.015181 -0.022289 -0.010569 0.011407 -0.036063 -0.004492 0.001965 0.026082 0.057110 -0.017913 0.080561 -0.022853 -0.078339 0.058110 -0.047565 0.001294 -0.118278 0.007852 0.067272 -0.078031 0.038962 0.001207 0.002123 -0.004967 -0.001491 0.048923 -0.019009 0.079244 0.042185 0.012290 0.005007 0.014815 0.004578 0.005989 0.007286 -0.024306 -0.009227 0.043448 -0.015104 0.011501 0.019422 0.000942 0.008940 0.004288 -0.029005 -0.015802 -0.017087 0.022364 0.265366 0.192809 0.224749 -0.167141 0.089450 -0.224282 0.277942 -0.066523 0.081119 -0.318465 -0.124211 -0.025428 -0.129812 0.002151 -0.115173 -0.153477 -0.078271 0.127924 -0.019768 -0.022564 0.057490 -0.054773 -0.110345 0.147239 -0.384237 -0.164849 -0.008580 0.076585 -0.172147 0.055207 0.320455 -0.098557 0.099736 0.012731 -0.020296 0.046849 -0.034392 -0.092543 0.124406 0.015610 0.006980 0.020637 0.000722 0.000912 -0.001299 0.001451 0.003078 -0.002680 -0.001303 0.005167 0.000570 -0.000690 -0.001856 -0.003946 0.000907 -0.008295 0.003369 0.010941 -0.008750 0.008506 0.000199 0.012598 0.000536 -0.010715 0.010422 -0.006382 -0.004690 -0.010042 0.013886 0.000040 -0.005294 0.002944 -0.004647 -0.005501 -0.004046 -0.016647 -0.033177 0.052625 0.024548 0.051012 -0.074076 0.001111 -0.005818 0.002530 -0.013526 -0.023437 0.037373 0.021677 0.042866 -0.063950 -0.007340 -0.014081 0.018624 -0.032278 -0.025353 -0.033292 0.016619 -0.012022 0.031021 -0.034495 0.007370 -0.005874 0.043326 0.013309 -0.001660 0.012772 -0.010200 0.001178 0.017563 0.008385 -0.014767 0.104067 0.201813 -0.319750 -0.158852 -0.325673 0.471884 0.051854 0.020767 -0.000180 -0.013993 0.021968 -0.008576 -0.039590 0.012712 -0.014189 0.103045 0.197975 -0.306245 -0.153121 -0.298164 0.445869 -0.004577 -0.000070 0.003877 0.002444 0.004332 -0.006766 0.006231 0.007273 0.001024 -0.005503 0.006593 0.001717 -0.002004 -0.008715 -0.019093 -0.001396 -0.008412 0.002153 0.015299 -0.004244 0.005378 0.001743 0.011277 0.000396 -0.014664 0.013921 -0.010819 -0.018991 -0.039381 0.060437 0.000113 -0.005166 0.005477 -0.000337 -0.006421 0.000475 0.021681 0.041805 -0.070358 0.012415 0.025959 -0.035925 0.000192 -0.008038 0.004733 0.023786 0.049403 -0.084540 0.015356 0.036631 -0.049219 -0.029915 -0.057584 0.089082 -0.035645 -0.033548 -0.050366 0.015221 -0.016155 0.042839 -0.043302 0.008143 0.000517 0.059841 0.013175 -0.008665 0.028871 0.001241 -0.002886 0.016671 0.007187 -0.009782 -0.156028 -0.304839 0.478872 -0.088526 -0.181412 0.264861 0.071651 0.026193 -0.002686 -0.028209 0.027941 -0.014065 -0.049116 0.016714 -0.021314 -0.171619 -0.314721 0.482785 -0.094740 -0.176406 0.268355 -0.019548 0.002983 0.018552 0.005243 0.000224 0.001821 -0.053921 -0.051435 -0.143305 0.038834 -0.097984 0.007354 0.000658 0.120392 0.322319 -0.033216 0.005893 -0.003631 0.041966 0.107753 -0.048463 0.017646 -0.039115 0.016627 -0.033295 0.059562 -0.076166 -0.013587 -0.004800 -0.000452 0.008289 -0.001158 0.044585 0.055054 -0.017586 0.012513 0.013152 0.022606 0.011559 -0.002218 -0.007150 -0.001922 -0.026614 -0.043820 0.041946 0.032501 0.044105 0.035632 0.006164 -0.037929 -0.019220 -0.031447 -0.000630 -0.011547 -0.001341 -0.144789 -0.307904 0.006716 -0.072797 0.205859 -0.168029 0.021532 0.096643 0.329289 0.023201 -0.110248 0.121900 0.108667 -0.196620 0.050920 -0.054141 0.028918 -0.024048 0.000581 0.012007 0.003145 0.003464 -0.021749 0.374759 0.111106 -0.042469 -0.273729 0.120862 -0.102269 -0.212422 0.080981 -0.136867 0.080458 -0.002905 0.057347 0.036552 -0.014586 -0.029114 0.183146 -0.113379 -0.132265 0.000856 0.000091 0.000109 -0.009962 -0.005228 -0.018950 0.006318 -0.007514 0.000902 -0.000149 0.014715 0.039031 -0.001158 0.004594 -0.003777 0.037210 -0.000100 0.002295 -0.040087 -0.015333 -0.023103 -0.020919 0.046448 0.150085 -0.002644 -0.003581 0.004677 -0.033568 -0.021456 -0.116071 -0.007307 0.001392 0.002895 0.001897 0.002380 -0.000020 0.000208 0.000329 -0.001084 0.105720 -0.021064 -0.090363 0.004822 0.007512 0.003014 0.002022 -0.004410 -0.004717 -0.006330 -0.001062 0.000069 -0.085608 -0.025752 0.107948 -0.093978 0.015930 0.261611 -0.285877 -0.018307 0.024769 -0.141678 -0.019379 -0.054667 0.054134 0.014667 0.012765 -0.039753 -0.021114 0.019225 -0.006731 -0.005579 0.006143 -0.003679 -0.002718 0.004539 -0.126208 0.094078 0.188491 0.702299 0.133807 0.188619 -0.287528 -0.009158 0.176859 0.007098 -0.007300 0.018841 0.002499 -0.010023 0.008358 0.029055 -0.026113 -0.035559 0.001453 0.000195 0.000129 -0.003616 -0.001913 -0.056927 0.003379 -0.006290 0.007712 -0.004305 0.029631 0.090269 0.014328 -0.092831 0.026846 0.083469 -0.009809 0.026759 0.009367 0.159483 -0.017157 -0.032452 -0.060376 0.014118 -0.004562 -0.012231 0.017824 -0.006560 -0.022951 -0.006129 -0.109313 -0.039997 -0.022059 0.002737 -0.002539 -0.003144 -0.000167 0.005462 0.002112 0.009183 0.062844 -0.013593 0.006922 0.011787 0.000355 0.001536 -0.003201 -0.008975 -0.012303 -0.002076 0.000292 -0.247791 0.097996 0.287098 0.149344 0.033864 -0.297737 0.278083 0.003295 -0.237847 -0.286184 0.031565 0.208530 0.156709 0.036852 0.026172 0.120337 0.138125 -0.130966 -0.014561 -0.013040 -0.005644 -0.005764 0.006238 0.005233 -0.322628 -0.144806 -0.032708 0.047473 -0.177499 0.034576 0.353759 -0.075185 0.077820 0.001417 -0.021021 0.042754 -0.006536 -0.023130 0.024088 0.065000 -0.062194 -0.081223 0.002257 -0.000295 0.000633 -0.081918 -0.073231 0.149086 0.026640 -0.050197 -0.008449 -0.001654 -0.028453 -0.095633 -0.035697 -0.003813 -0.000215 0.234794 0.281872 -0.186944 0.014003 -0.011780 -0.013841 0.004876 -0.006135 -0.004139 -0.000764 0.008400 -0.014954 0.005341 -0.001347 0.008289 -0.116375 -0.029002 0.001573 0.003757 -0.014143 -0.004173 0.000397 0.010569 0.014377 -0.006845 0.001125 -0.001249 0.005472 0.015082 0.019810 0.011552 -0.015748 -0.015116 -0.022119 0.001746 -0.005113 0.020539 -0.018330 -0.021048 0.039949 -0.012023 -0.007853 0.016171 -0.000365 -0.001698 -0.021047 0.000529 0.026622 0.555430 0.377903 -0.507671 0.092902 -0.063670 0.145700 -0.017796 -0.020807 -0.022205 -0.027275 0.038327 0.002602 -0.017677 -0.005226 0.000017 -0.002170 -0.007623 0.001869 0.005809 -0.004860 0.005067 0.024852 0.032212 -0.013433 0.004036 -0.042328 0.032178 -0.068065 -0.027531 0.049588 0.000056 0.001294 -0.002054 -0.000319 -0.000905 0.001549 0.000427 -0.000102 -0.000284 -0.000846 0.001166 0.001326 0.001119 0.002824 -0.000675 -0.003904 -0.002562 0.000746 -0.003159 -0.004579 0.000178 0.005885 0.000360 0.000238 0.010409 0.010728 -0.015945 0.002199 0.001220 0.000408 -0.001555 0.002225 -0.000422 -0.021882 -0.041536 0.063097 -0.024416 -0.046120 0.068733 -0.002559 -0.001309 0.000347 0.020190 0.036960 -0.061526 0.023332 0.048275 -0.068156 -0.004060 -0.012794 0.020119 0.013644 0.000083 -0.003839 -0.001456 0.000744 0.003169 -0.001316 -0.000292 0.006241 0.006428 -0.000724 -0.003872 -0.009369 -0.002094 0.012203 -0.006423 -0.003890 0.002480 0.125982 0.251147 -0.404425 0.134217 0.297079 -0.422930 0.002793 0.001765 0.000266 -0.004659 0.002426 -0.001067 -0.007809 0.001030 -0.001747 -0.118920 -0.227482 0.348647 -0.136367 -0.267424 0.406986 0.008570 -0.007855 -0.019937 0.000373 0.000053 0.000045 -0.001144 -0.001137 0.002073 0.000306 0.000261 0.000047 0.000899 -0.001096 -0.002480 -0.000290 0.000406 0.000025 0.003255 0.002733 -0.001634 -0.000092 -0.000805 0.000031 0.000569 -0.000102 0.000001 -0.002393 0.001801 -0.003421 0.000464 0.000159 0.000183 -0.001877 -0.000008 -0.000464 -0.023765 -0.050444 0.073327 0.022598 0.046911 -0.060694 -0.000450 -0.000193 -0.000086 0.027707 0.055001 -0.074823 -0.023558 -0.051218 0.069134 -0.002187 -0.001392 -0.000772 0.002165 -0.000190 -0.000803 0.000184 -0.000098 0.000211 0.000271 -0.000063 0.000773 0.000648 -0.000067 -0.000129 0.002882 -0.000238 -0.009751 0.001195 -0.001431 0.001082 0.127647 0.255123 -0.418864 -0.111180 -0.233468 0.344504 -0.000129 0.000208 0.000167 -0.000207 0.000269 -0.000016 -0.001242 0.000019 -0.000037 -0.143287 -0.273705 0.434107 0.125939 0.254948 -0.400236 -0.005649 0.006847 0.013504 0.010419 -0.001384 0.002567 0.019052 0.012125 -0.000423 -0.002519 -0.000202 0.000105 0.008256 -0.010979 -0.014965 0.003097 0.001429 -0.000593 -0.013154 -0.021342 0.013165 -0.006996 -0.003288 0.001140 0.009678 0.000565 0.001815 -0.105238 0.012595 -0.024822 0.006596 0.001840 0.000006 -0.000161 0.003705 -0.000152 0.053939 -0.184222 -0.107061 0.032039 0.170272 0.130103 -0.006187 -0.001791 -0.000648 0.027657 0.185386 0.134021 0.055627 -0.197426 -0.118088 -0.067969 0.010105 -0.013977 0.016776 0.001858 -0.000261 0.000093 0.002334 0.002977 0.004448 -0.000070 0.006309 0.011779 -0.000392 -0.004982 -0.057017 -0.038565 0.047075 -0.017234 0.002612 -0.016082 -0.162673 -0.290609 -0.215362 -0.201344 0.340564 0.120992 -0.003390 0.001387 0.000870 -0.005954 0.002383 -0.000842 -0.013656 0.000549 -0.001244 -0.236153 0.373189 0.137452 -0.193302 -0.322809 -0.246880 -0.046308 0.075383 0.125398 0.001038 -0.000117 0.000295 0.002510 0.003353 -0.010491 0.000272 0.011759 -0.000665 -0.017066 0.011451 0.016125 0.020348 0.009882 0.002002 0.080080 -0.037086 0.022812 -0.141856 -0.024667 -0.007914 0.129003 0.020533 0.090947 0.020150 -0.010890 0.016448 0.280684 0.025733 -0.035791 -0.109651 0.024112 -0.025995 0.001484 -0.002170 -0.005290 0.000530 0.007427 -0.000524 -0.230977 -0.036890 -0.059319 -0.005291 -0.008512 -0.006196 -0.006688 0.009439 0.005780 -0.008221 0.000169 -0.002342 0.089411 0.031103 0.128510 -0.027947 0.034848 0.150311 0.375535 0.007857 -0.039250 0.414918 0.014860 -0.115440 0.022080 -0.046117 0.105186 -0.210244 -0.005409 0.027946 -0.021791 -0.024794 0.009184 -0.025159 0.001486 0.026642 -0.331331 -0.009576 0.025962 -0.118866 0.011377 -0.002792 -0.403207 -0.019936 0.010630 0.003683 -0.008326 -0.015118 0.000759 0.018641 -0.000312 0.071549 -0.120600 -0.206796 0.002792 -0.000309 0.000761 0.010408 0.004751 -0.001654 -0.003479 0.010512 -0.004401 -0.040611 0.020588 0.014636 0.024507 0.017331 0.001081 0.076450 -0.035240 0.019754 -0.131674 -0.038362 -0.025013 0.200209 -0.008040 -0.055767 0.066861 -0.019205 0.027488 -0.131938 0.012762 0.048165 -0.131935 0.031150 -0.030446 0.006605 -0.021809 -0.014753 0.002871 0.028606 0.013724 0.088164 0.003171 0.047697 -0.015740 -0.011575 -0.012804 -0.017649 0.016942 0.007017 -0.018447 0.000153 -0.005556 0.382057 -0.012399 -0.153615 0.184269 0.028783 -0.139706 -0.279965 -0.013406 0.204448 -0.241353 -0.007062 0.093180 -0.029950 -0.070961 0.113670 -0.206061 -0.023087 0.033711 -0.066732 -0.065330 -0.036811 -0.084002 0.060047 0.049015 0.217434 0.023706 -0.006936 -0.021895 0.021508 -0.010237 0.129586 0.024181 -0.027069 -0.032102 0.000324 -0.018120 -0.036990 0.016923 -0.014839 0.150774 -0.252600 -0.462480 -0.004630 0.000503 -0.001276 -0.009073 -0.000614 -0.028220 0.009364 0.010943 0.011212 0.059887 -0.023786 0.007104 0.010668 -0.001065 0.002985 0.050722 -0.023417 0.018668 -0.086404 -0.000381 -0.008800 0.098834 0.000728 -0.016023 -0.204131 0.029117 -0.043796 -0.020800 0.008196 0.019459 -0.052403 0.004883 -0.018230 -0.015898 0.056778 0.030676 -0.006882 -0.064725 -0.040385 0.011375 -0.002104 0.008754 0.044800 0.027575 0.032526 0.047968 -0.041954 -0.014553 0.023818 0.001313 0.008894 0.146434 -0.002848 -0.044693 0.089155 0.018716 -0.053958 -0.074193 -0.003440 0.083500 -0.063067 0.002292 0.039859 0.078747 0.004183 0.048727 -0.149681 0.029604 -0.048817 0.188192 0.151160 0.154063 0.225978 -0.195532 -0.082290 0.036734 0.008295 0.005127 -0.004955 0.009336 -0.000098 0.005127 0.005013 -0.002340 0.133805 -0.026079 0.036044 0.144752 -0.015848 0.056266 -0.204590 0.332412 0.665187 -0.026852 0.003045 -0.007113 0.050993 0.019390 0.043006 0.006201 -0.046530 -0.016790 -0.061029 0.022667 -0.014004 -0.005142 -0.006943 -0.000637 -0.004175 0.009482 -0.007714 0.011468 -0.001182 -0.010138 -0.015557 0.011891 0.034093 -0.178472 0.012423 -0.041691 -0.010026 -0.014512 -0.039536 0.009604 0.001185 0.011362 -0.046333 0.075987 0.035007 -0.036727 -0.061935 -0.055930 0.002588 0.008529 0.021658 0.039647 0.057844 0.049229 0.045486 -0.069689 -0.030571 0.187308 -0.018232 0.052812 -0.050247 -0.005327 0.033367 0.011154 0.002819 0.042127 0.041250 -0.007418 -0.087995 0.034671 0.002635 -0.047760 -0.059874 -0.023523 -0.008599 0.041419 -0.022179 0.047359 0.093708 0.145177 0.125910 0.043737 -0.129628 -0.057950 0.043339 -0.021673 -0.038686 -0.081495 -0.019856 -0.018707 0.073649 0.009351 -0.034975 -0.121331 0.165054 0.073203 -0.092436 -0.140981 -0.122290 0.225097 -0.346250 -0.709903 -0.006940 0.000816 -0.001822 0.007678 0.002554 0.004448 -0.000384 -0.006036 -0.001924 -0.009290 0.003686 0.000212 -0.002712 -0.006576 0.003414 -0.008387 0.002358 -0.003624 0.021140 0.009176 0.036712 -0.018917 -0.031274 -0.190169 -0.013027 0.000227 -0.003239 0.071546 0.036101 0.208010 0.008543 0.001035 -0.000687 -0.012010 0.014042 0.005126 -0.009537 -0.010271 -0.010464 -0.019194 -0.019793 -0.132380 0.004928 0.009707 0.007812 0.004826 -0.010859 -0.005411 0.049002 -0.005395 0.013305 -0.065984 -0.007094 -0.144547 -0.049657 -0.046806 -0.144178 -0.161183 0.056481 0.307099 -0.152795 0.023101 0.324668 -0.018091 -0.005944 -0.011498 -0.012778 0.026749 0.000002 -0.016381 0.013962 0.004404 -0.017784 -0.008355 -0.009465 -0.357802 0.077292 0.193961 0.462855 0.049898 0.110762 -0.321511 -0.070006 0.223298 -0.046046 0.043379 0.013070 -0.046580 -0.034516 -0.039049 0.034659 -0.050302 -0.104666 -0.035863 0.004728 -0.009085 -0.036228 -0.019840 -0.026515 -0.004130 0.036899 0.010835 0.036308 -0.009807 0.015250 0.003224 0.002604 0.000710 0.012369 -0.002177 0.003706 -0.021776 0.003290 -0.003532 0.021188 -0.000460 0.014161 0.147841 -0.016399 0.033066 -0.007225 0.002563 -0.014255 -0.008058 -0.002439 -0.007415 -0.072965 0.041975 0.000501 -0.040334 -0.020915 -0.028603 0.001953 -0.001500 0.011871 0.003682 0.018211 0.014530 -0.026112 -0.008410 -0.013391 0.256594 -0.035111 0.064875 0.044238 0.004052 0.007524 0.010712 0.009421 -0.002832 0.002756 -0.006371 0.000692 0.003941 -0.004852 -0.028166 0.090688 0.038285 -0.018727 -0.045171 0.016751 -0.024874 -0.419068 -0.099288 -0.191853 -0.213328 0.076682 -0.014072 0.039892 -0.001494 -0.012435 -0.037976 0.002826 -0.009351 0.014954 0.007553 -0.020483 -0.261845 0.195744 0.032498 -0.425905 -0.178530 -0.268107 -0.116930 0.185061 0.387638 -0.003769 -0.001966 -0.002576 -0.008618 -0.002112 -0.008320 0.005070 -0.006390 0.001813 0.005120 0.000124 0.005442 0.000244 -0.000025 0.000188 0.002049 0.001435 0.000792 -0.003136 0.000584 -0.000237 0.002933 -0.000072 0.000805 0.022913 0.032653 0.028148 -0.000636 0.000399 -0.000760 -0.000832 -0.000463 -0.000965 0.064026 -0.028372 0.004190 -0.071768 -0.019608 -0.039416 0.000170 -0.000226 0.000895 -0.068364 -0.019015 -0.036057 0.062615 -0.034608 0.000061 0.027122 0.030291 0.028966 0.005008 0.000350 0.000191 0.002041 0.000951 -0.001103 -0.000313 -0.000545 0.001289 -0.000456 -0.000330 -0.001581 0.008543 0.003465 -0.004773 -0.005780 0.002483 -0.004283 0.391304 0.100353 0.185695 -0.473408 0.203029 -0.009562 0.003204 0.000083 -0.000699 -0.002705 0.000444 -0.000666 0.000646 0.000588 -0.001477 -0.500430 0.238891 -0.009515 0.389497 0.095898 0.188002 -0.015886 0.027437 0.056255 -0.000062 0.000007 -0.000016 -0.005189 -0.002183 -0.000993 0.000096 0.007113 0.000211 0.003967 -0.001470 -0.000719 0.001922 0.047088 -0.013285 0.007067 -0.005356 -0.002466 -0.049575 -0.098914 0.005525 0.014946 0.149806 -0.026674 0.007042 -0.000174 0.001719 0.012779 -0.153893 0.029275 0.018207 0.011004 0.013040 -0.000079 -0.001009 -0.000826 -0.000148 0.000682 0.000467 -0.008891 0.100908 -0.015733 -0.000664 -0.001048 -0.000819 -0.000817 0.001099 0.000443 0.000417 -0.000070 0.000089 -0.248176 -0.155521 -0.216022 0.341748 -0.034241 0.229143 -0.098790 0.039053 -0.342521 0.065199 0.152584 0.328790 -0.059581 -0.036899 0.030157 0.161276 -0.198978 0.070679 -0.010340 -0.005518 -0.006670 -0.007574 0.005740 0.000542 -0.310478 -0.130043 -0.076546 0.014302 -0.204085 0.033881 0.322387 -0.048178 0.107653 -0.002034 -0.000291 -0.000864 -0.002074 0.000654 -0.000131 -0.012863 0.018275 0.038772 -0.007031 0.000781 -0.001876 0.008043 0.003663 0.001603 0.000621 -0.003080 -0.000453 -0.000874 -0.001146 -0.001315 0.001507 0.003406 -0.000822 0.001495 -0.001278 0.000551 0.008305 -0.004533 0.001589 -0.005757 -0.002648 0.000778 -0.043453 0.006143 -0.008557 -0.000326 0.001302 -0.000120 -0.008911 0.002990 -0.000556 -0.055391 -0.006402 -0.023768 -0.055248 0.017938 -0.008866 0.000097 -0.001307 -0.000185 0.057308 -0.015499 0.009292 0.055650 -0.000868 0.018904 0.041879 -0.002329 0.012565 0.005735 0.001696 0.000201 -0.004378 -0.002149 -0.001162 0.006409 -0.000017 -0.001846 -0.000810 -0.002362 -0.003951 -0.040369 -0.023586 0.015089 0.034297 -0.016293 0.007875 -0.404073 -0.148026 -0.220953 -0.442414 0.237184 0.021598 0.003881 0.001896 0.001100 0.001334 0.002309 -0.000122 -0.003371 0.000081 -0.000932 0.423079 -0.236560 -0.012373 0.421500 0.146920 0.237663 0.003224 -0.003204 -0.009729 -0.001132 0.000146 -0.000292 0.006929 -0.025375 -0.022922 -0.021842 0.077070 0.009306 0.004013 0.000701 0.018282 0.041792 0.087872 -0.017871 0.057506 -0.014519 0.002423 0.106998 -0.090037 0.022865 -0.079525 -0.044538 0.010370 -0.018098 -0.000638 0.006161 -0.006877 0.028357 0.004717 -0.198196 0.059382 -0.022295 0.001114 0.005945 0.003076 -0.001039 -0.007249 -0.004840 0.002155 -0.029751 -0.004836 0.000016 0.004347 0.002226 0.000656 -0.005370 -0.004170 0.005241 -0.000467 0.001671 0.122683 0.023401 -0.008253 -0.018549 -0.036239 -0.043003 0.149809 -0.000670 -0.034550 -0.053743 -0.041090 -0.045742 -0.299659 -0.180374 0.177116 0.704166 -0.359288 0.199089 0.049674 0.022716 0.040328 0.060342 -0.042940 -0.010897 0.076217 0.041758 0.029957 0.031132 0.052979 -0.001722 -0.082127 0.001137 -0.017109 -0.044424 0.031548 0.006317 -0.022771 -0.016704 -0.017320 -0.009748 0.010125 0.053861 0.000238 -0.000043 0.000055 -0.003634 0.005214 0.003901 0.004699 -0.012597 -0.002009 0.000533 -0.000712 -0.003588 -0.005882 0.012312 -0.004050 -0.007367 -0.000777 -0.001460 -0.050383 -0.035587 -0.001342 0.017999 0.052174 -0.013061 0.004435 0.000513 -0.000240 -0.006261 0.064844 -0.007708 0.048865 -0.009394 0.013214 0.000099 -0.001191 -0.000641 0.001457 0.000351 0.000676 0.007368 -0.089613 0.013374 -0.000527 -0.000923 -0.000656 -0.000920 0.000689 0.000264 -0.001189 0.001013 0.000238 -0.395600 -0.032950 0.093770 0.409483 0.004784 -0.094951 0.471697 -0.013107 -0.104319 -0.463056 -0.029445 0.143920 0.019243 0.010840 -0.015608 0.073054 -0.092446 0.023210 -0.004467 -0.002726 -0.004491 -0.007222 0.005557 0.001468 0.205256 0.090816 0.085670 -0.012234 0.172428 -0.028394 -0.225263 0.024107 -0.097491 0.003929 -0.003758 -0.001171 -0.002880 0.000116 -0.000954 -0.001831 0.002638 0.000334 -0.000863 0.003207 0.001807 0.011879 -0.015938 0.004013 -0.023943 0.045252 0.002245 0.005568 -0.000416 0.004057 -0.000597 0.000441 0.000437 -0.006829 -0.003770 0.000303 -0.003345 0.000883 0.000101 0.003207 0.002710 -0.001732 -0.004243 -0.196562 -0.133029 0.001903 0.000168 -0.002152 0.006709 -0.002165 -0.001578 0.139804 0.102389 0.109766 -0.162112 0.128899 0.035271 0.000189 -0.001200 0.001768 -0.108776 0.139265 0.053847 0.106384 0.104577 0.105121 0.023841 -0.327659 -0.206402 -0.018367 -0.001052 0.004662 -0.003532 0.000687 0.006897 0.000704 -0.000568 0.000658 -0.019998 0.000873 0.010865 0.067728 0.036233 -0.026315 -0.017643 0.007096 -0.000887 -0.316124 -0.083172 -0.143800 0.318671 -0.140722 -0.004920 0.003253 -0.001060 -0.000395 -0.005934 0.002122 -0.001647 -0.003521 0.002018 -0.004226 -0.314754 0.276472 0.076549 0.316939 0.202812 0.237193 0.005289 0.004624 0.007751 -0.000094 -0.001596 -0.001083 0.001251 -0.000324 -0.000125 -0.007500 0.009894 0.000623 0.005760 -0.001156 0.003626 0.001390 0.002406 -0.000114 -0.004661 -0.005381 0.002950 -0.001951 -0.000077 -0.002071 -0.004567 0.000426 0.005836 0.007300 -0.135947 -0.087945 -0.009642 0.000038 0.008444 -0.001602 0.000193 -0.001925 0.001956 0.013480 0.009663 -0.005817 0.013323 0.007003 -0.000275 -0.000953 -0.006079 -0.064917 0.046917 0.008035 0.061176 0.030661 0.041633 0.000801 0.022095 0.014871 0.044828 -0.005615 -0.025256 0.032180 0.003722 -0.021365 0.045149 -0.000410 -0.023164 0.042564 0.001303 -0.019226 0.054752 0.025464 -0.018929 0.006577 -0.003832 -0.000480 0.392728 0.174135 0.240712 -0.422998 0.261688 0.034864 0.000364 0.010333 0.007609 0.023194 0.002156 0.005124 0.001616 -0.007345 0.010922 0.411643 -0.246539 -0.019118 -0.382296 -0.149402 -0.231871 -0.003619 0.016105 0.029938 -0.000104 -0.000156 -0.000140 0.000956 -0.013352 -0.001025 -0.008320 0.026565 0.002079 0.001065 0.000596 0.002487 -0.001024 -0.000033 0.000468 0.020821 0.012830 -0.008981 0.017974 -0.003003 0.023810 0.042534 -0.002677 -0.055675 -0.001723 -0.011353 -0.007190 0.097845 -0.006100 -0.083321 -0.009649 -0.000786 -0.000655 -0.001381 0.000754 0.000020 0.000053 0.000216 0.000193 0.002679 0.007409 0.060985 -0.004316 0.003429 0.000677 0.005189 0.001235 0.002616 0.000221 0.005159 0.003448 -0.360732 0.050765 0.204385 -0.365093 -0.036027 0.237204 -0.416771 0.003391 0.199290 -0.460641 -0.008141 0.225572 -0.146064 -0.075544 0.045442 -0.006977 0.010056 0.003809 0.044801 0.019476 0.027790 -0.040636 0.024980 0.002212 0.002863 -0.103171 -0.076485 -0.230743 -0.023022 -0.050608 -0.023689 0.073339 -0.110077 0.040321 -0.024176 -0.001730 -0.035836 -0.015736 -0.022599 -0.001576 -0.000825 0.007535 0.000018 -0.000012 -0.000002 -0.002607 -0.003082 0.001504 -0.000931 0.005714 -0.000131 0.000990 -0.000184 -0.000678 -0.004986 0.003908 -0.002028 0.010837 0.007855 -0.006138 -0.022155 -0.025467 -0.000063 0.010842 -0.040639 0.004281 0.001185 -0.002077 -0.001248 -0.001441 0.044881 -0.006456 0.019107 -0.001084 0.007860 0.000431 0.000275 0.000306 -0.000326 0.000499 0.000239 -0.001570 0.026659 -0.003473 -0.001033 0.000768 0.000172 0.000900 0.000682 0.000792 -0.000120 -0.000493 -0.000376 -0.422781 0.031482 0.294846 0.429783 -0.005764 -0.293358 -0.354018 0.005792 0.298028 0.337004 -0.043140 -0.294080 -0.090061 -0.045674 0.026982 0.100025 -0.080436 0.018822 0.003385 0.001467 0.002107 -0.004668 0.003599 0.000131 -0.078454 -0.016646 -0.010320 -0.005504 -0.008040 -0.000821 0.072581 0.002733 0.013197 0.003594 -0.002115 -0.000033 -0.003995 -0.001299 -0.002105 -0.002439 0.000271 0.005053 -0.000380 0.000039 -0.000112 -0.007605 -0.039259 0.004602 -0.020218 0.072121 0.004066 0.003393 0.001227 0.002097 -0.039407 -0.070498 0.011465 0.094900 0.079546 -0.048797 -0.002095 0.025475 -0.011177 0.002463 0.017915 0.006762 -0.001479 -0.004682 -0.002692 -0.030679 -0.004632 0.018905 0.071260 -0.008105 0.010334 -0.001507 0.001706 0.000622 -0.001753 0.000098 -0.000289 -0.000970 -0.006859 -0.012989 0.000700 0.001548 0.001187 0.002367 -0.000555 0.000578 0.001009 0.000662 0.000652 0.040998 -0.017534 -0.054023 0.017198 0.014476 0.009355 0.171184 -0.006084 -0.094164 0.067496 0.014962 -0.013760 -0.788420 -0.387884 0.241426 -0.237229 0.127814 -0.030255 0.023521 0.011537 0.016631 -0.004049 0.006068 -0.004499 0.020979 0.032822 0.021711 0.056891 0.012505 0.012964 0.004345 -0.020151 0.021977 0.003526 -0.000229 0.001629 -0.007815 -0.005307 -0.005023 -0.003934 -0.005678 0.012294 0.001593 0.000232 0.000577 0.103572 -0.218273 -0.014616 -0.141441 0.359085 0.031733 -0.020451 0.026383 0.026299 -0.000852 0.011366 -0.001571 -0.086915 -0.000919 0.008391 -0.033907 0.009174 -0.007570 0.032344 0.011283 -0.010801 -0.053184 0.026730 -0.009213 -0.031819 0.001035 0.013769 0.059507 -0.016484 0.009341 -0.022487 -0.006468 -0.011680 0.025604 0.003214 0.010461 0.003248 -0.001861 -0.009584 0.043956 -0.022511 0.000788 -0.041663 -0.024076 -0.029664 -0.006456 0.037258 0.022086 -0.121142 -0.006569 0.043376 -0.019617 0.008228 0.023309 0.101550 -0.011734 -0.031220 0.098852 0.017526 -0.039834 0.628117 0.340157 -0.314180 -0.117267 0.045772 0.032193 0.079040 0.034785 0.049317 -0.039537 0.039212 0.017392 -0.003278 0.023155 0.023394 0.025462 0.007478 0.000891 0.003056 -0.014006 0.024081 -0.016648 0.014639 0.005705 0.123878 0.043847 0.071252 0.061526 -0.118414 -0.195947 -0.000054 -0.000060 -0.000051 -0.005245 0.012590 0.000047 0.008324 -0.020031 -0.001728 0.001338 -0.001634 -0.001218 0.008124 0.015428 -0.002363 0.003924 -0.005980 0.002447 0.012124 -0.007994 0.016526 0.118714 -0.006617 -0.077399 0.002492 -0.000094 0.001650 -0.124464 -0.004021 0.038913 -0.029160 -0.001225 -0.002191 0.002372 -0.000440 0.000458 -0.002621 -0.000373 -0.001146 0.015722 -0.001616 -0.025631 -0.003791 0.001235 -0.000522 0.003625 0.000839 0.001723 0.000267 -0.000926 -0.000485 -0.455027 0.101663 0.326589 -0.456784 -0.060682 0.352980 0.331182 -0.045609 -0.124442 0.342310 0.056718 -0.150743 0.012717 0.000604 0.004119 0.028795 -0.016242 0.018169 -0.006433 -0.004351 -0.004644 0.004070 -0.004949 -0.001335 0.006558 0.077623 0.072287 0.046589 -0.002620 -0.009054 0.019059 -0.049326 0.097951 0.004740 -0.004201 -0.001197 -0.008103 -0.004185 -0.005547 -0.005520 0.008174 0.015899 -0.000016 0.000001 -0.000002 0.000376 0.000428 -0.000356 0.000071 -0.000565 0.000066 -0.000141 0.000030 0.000241 0.001097 0.001838 -0.000048 -0.001136 -0.001418 0.000638 0.003954 -0.002804 0.005801 0.005334 -0.000088 -0.009738 -0.000172 0.000039 0.000083 0.026121 0.000842 -0.008409 -0.004035 0.000775 -0.000991 -0.000058 0.000034 0.000006 -0.000051 -0.000056 -0.000052 -0.143608 -0.011980 -0.001483 0.000055 -0.000026 -0.000004 0.000025 -0.000051 -0.000033 0.000053 0.000070 0.000067 -0.065026 -0.006602 0.014595 -0.045097 0.001290 0.007915 -0.047788 -0.004244 0.056574 -0.046741 0.012724 0.049642 0.010032 0.004587 -0.003033 -0.014660 0.005676 -0.004590 0.000201 0.000155 0.000134 0.000302 -0.000321 -0.000038 0.504176 0.198770 -0.146330 0.485655 0.090578 0.282491 0.538114 -0.153597 -0.093984 -0.000134 0.000094 0.000007 -0.000105 -0.000112 -0.000133 0.000407 -0.000227 -0.000537 -0.000198 0.005259 0.003371 -0.007579 0.019300 0.003237 0.004422 -0.018693 -0.002459 0.006273 -0.003590 -0.000019 0.000821 0.000661 0.000037 0.006229 -0.002799 0.000380 0.002303 -0.000955 0.001171 0.001327 -0.001034 -0.001555 0.011017 -0.116498 -0.072315 -0.001620 -0.000062 0.000423 -0.006089 0.000799 -0.001746 -0.182220 0.046786 -0.029947 0.179320 0.002957 0.061848 0.000202 0.000053 -0.000225 0.184932 -0.002490 0.060692 -0.179475 0.045247 -0.031003 0.000667 -0.105704 -0.069092 -0.003965 0.004459 0.007323 -0.009835 -0.002894 0.008872 0.003316 -0.000230 -0.002045 0.003843 0.000019 -0.002512 -0.027849 -0.018832 0.017304 0.010972 -0.004987 -0.003260 0.279643 0.259828 0.255514 -0.327860 0.322926 0.112159 0.000782 0.001008 0.000564 0.000127 -0.000886 -0.000147 0.000127 -0.000678 0.001729 -0.305824 0.321479 0.105594 0.236713 0.240173 0.239157 -0.009564 0.023562 0.043489 -0.000006 -0.000006 -0.000004 0.000824 -0.001112 -0.000149 -0.000793 0.001522 0.000271 -0.000161 0.000132 0.000208 -0.001941 -0.010999 0.002721 -0.000385 -0.000234 0.000744 -0.000996 -0.004762 -0.006551 -0.035892 -0.006635 -0.053790 -0.000395 0.000218 -0.000089 0.015698 0.006300 0.034107 -0.000366 0.011624 -0.004804 0.000193 0.000058 0.000121 -0.000135 -0.000024 -0.000056 -0.003188 -0.003096 0.000691 -0.000017 -0.000149 -0.000097 0.000077 -0.000134 -0.000060 -0.000013 0.000305 0.000193 0.250779 0.459765 0.318827 0.335646 -0.289171 0.443555 -0.129995 0.157429 -0.256437 -0.114186 -0.247399 -0.183199 0.014171 0.007230 -0.004529 -0.076768 0.025654 -0.014047 -0.000003 0.000012 -0.000172 0.000274 -0.000295 -0.000137 0.006712 0.018122 0.018236 0.007540 0.029708 0.003678 0.030936 -0.008509 -0.005893 -0.000122 -0.000086 -0.000147 -0.000099 -0.000228 -0.000205 0.000680 0.000214 -0.001353 0.000004 0.000000 -0.000001 -0.000201 0.000135 0.000051 0.000162 -0.000203 -0.000040 0.000064 -0.000031 -0.000048 0.000351 0.001683 -0.000583 0.000477 0.000119 -0.000107 -0.001838 0.001649 0.002383 0.020811 0.004434 0.022824 0.000056 -0.000047 -0.000007 0.032447 0.004596 0.018200 0.000278 -0.002048 0.000877 0.000019 0.000003 0.000015 0.000018 -0.000007 -0.000002 -0.004474 -0.009512 -0.034440 0.000009 -0.000001 0.000004 0.000044 0.000045 0.000044 -0.000032 -0.000038 -0.000040 -0.095644 -0.157808 -0.096629 -0.127146 0.101499 -0.133759 -0.194208 0.179091 -0.285791 -0.162889 -0.288658 -0.207509 -0.002389 -0.001539 0.000489 0.015495 -0.004989 0.001956 -0.000106 0.000012 -0.000180 -0.000199 0.000109 0.000032 0.084784 0.372978 0.351569 -0.262179 0.000528 -0.146731 0.174936 -0.222517 0.404486 -0.000035 0.000037 -0.000008 -0.000143 -0.000026 -0.000063 -0.000253 0.000113 0.000531 0.000027 -0.000003 0.000006 -0.000195 -0.000301 0.000371 -0.000030 0.000293 -0.000105 0.000055 -0.000021 -0.000238 -0.001260 -0.000897 -0.000069 -0.000024 0.000562 -0.000448 -0.009315 0.002783 -0.001607 0.002740 -0.003078 -0.000896 0.000015 0.000078 -0.000114 0.001944 0.023275 0.000716 0.007518 -0.001245 0.001988 0.000280 0.000012 0.000099 0.000177 -0.000054 0.000022 -0.005260 0.044695 -0.008979 -0.000085 -0.000082 -0.000073 0.000005 0.000085 0.000070 -0.000151 0.000025 -0.000037 -0.016918 0.010601 0.020353 0.019267 0.000190 -0.012066 0.024451 0.028732 -0.022014 -0.064971 -0.040881 -0.037722 -0.003013 -0.001401 -0.000242 0.037930 -0.017353 0.006925 -0.000819 -0.000417 -0.000609 -0.000694 0.000469 0.000065 0.369828 -0.054878 -0.325578 0.048280 -0.683987 0.108856 -0.343890 -0.027203 0.371496 -0.000128 -0.000089 -0.000085 -0.000246 -0.000002 -0.000058 -0.000052 0.000145 -0.000403 -0.000008 -0.000001 -0.000003 0.000320 -0.000258 -0.000073 -0.000290 0.000395 0.000083 -0.000090 0.000046 0.000059 -0.000576 -0.002344 0.000721 -0.000713 -0.000014 0.000202 0.002865 -0.002144 -0.003740 -0.035722 -0.003131 -0.011637 -0.000163 0.000067 -0.000028 -0.006645 -0.012839 -0.074234 0.000270 0.002525 -0.001274 0.000003 0.000049 0.000031 -0.000034 -0.000032 -0.000028 -0.000209 -0.002973 -0.030677 0.000064 -0.000063 -0.000022 0.000028 -0.000034 -0.000012 -0.000016 0.000081 0.000051 0.136769 0.180485 0.105302 0.171535 -0.114109 0.150002 0.121281 -0.235860 0.401217 0.084860 0.366685 0.302259 0.002261 0.001833 -0.000146 -0.021266 0.007650 -0.006219 0.000036 0.000023 0.000143 0.000139 -0.000127 -0.000070 0.091147 0.293914 0.257729 -0.220046 -0.056901 -0.122793 0.114157 -0.180264 0.355357 -0.000230 0.000101 0.000006 -0.000086 -0.000092 -0.000083 0.000341 -0.000081 -0.000813 -0.006931 0.000845 -0.001801 -0.004564 0.002104 -0.000331 0.000140 -0.002409 -0.000154 -0.001150 -0.000112 -0.000858 0.000390 0.000753 -0.000127 -0.002445 -0.000397 -0.000389 0.002096 -0.001225 0.000474 -0.000677 0.000690 0.000191 0.113573 -0.017645 0.026050 0.000014 0.000100 -0.000024 -0.000814 -0.000474 -0.000216 -0.086438 -0.073522 -0.076657 -0.090896 0.098238 0.034269 0.000051 0.000093 -0.000052 -0.080153 0.093922 0.033923 -0.079268 -0.078837 -0.079190 0.119000 -0.012510 0.032291 -0.003087 -0.000505 -0.000010 0.004178 0.000185 -0.000926 0.000235 0.000322 -0.000612 -0.000520 -0.000355 -0.000336 0.002147 0.003648 0.003629 -0.011263 0.004443 -0.002682 0.419552 0.123435 0.215083 0.442378 -0.206579 0.006742 0.001031 0.000055 -0.000641 -0.000208 -0.001990 0.000102 -0.001177 -0.000157 0.001386 0.405335 -0.193330 0.011369 0.404948 0.108183 0.209708 -0.001506 -0.003238 -0.001544 -0.000259 0.000005 -0.000076 0.004974 0.001342 -0.006132 -0.001940 0.000465 0.002262 -0.001266 0.000801 0.004211 0.022691 0.030468 -0.001927 0.000129 -0.008236 0.006554 0.163757 -0.099711 0.036849 -0.031935 0.046641 0.015713 -0.003120 -0.000940 0.000828 -0.007226 0.002772 -0.002286 -0.124239 0.008658 -0.032521 -0.002677 0.001952 0.000422 -0.003260 -0.000569 -0.001433 0.005088 0.001131 0.000333 0.004985 -0.002479 -0.000098 0.004131 0.000028 0.001277 -0.001758 0.001632 0.000505 -0.240919 -0.073608 -0.017236 0.215334 0.039377 -0.080298 0.037079 0.006647 -0.028360 -0.003620 -0.001488 -0.014292 0.039908 0.018668 0.004289 -0.831535 0.317493 -0.138790 0.001975 0.003934 0.004132 0.003203 -0.005008 -0.001830 0.018814 -0.009282 -0.018926 -0.010454 -0.046950 -0.001950 -0.043376 0.005844 0.023940 -0.010133 0.006976 0.000844 -0.007800 -0.005172 -0.006293 0.002500 -0.004887 0.002859 0.000453 -0.003681 -0.002251 -0.006323 0.018523 0.005562 -0.001827 -0.011685 -0.003591 0.008422 -0.004468 0.000625 0.000227 0.000059 0.000139 0.005623 -0.003787 -0.000584 -0.000560 0.000932 0.000308 0.000449 -0.001105 -0.000265 0.018692 -0.327528 -0.208673 -0.000156 -0.000025 0.000026 -0.002518 -0.000224 -0.001419 0.104075 0.188369 0.157391 -0.126116 0.207567 0.095140 0.000003 -0.000035 -0.000011 0.112717 -0.208689 -0.097438 -0.077990 -0.175175 -0.142337 -0.023900 0.305170 0.191690 0.003072 0.001208 0.001224 -0.005509 -0.000698 0.001893 0.000236 -0.000125 0.000159 0.000523 0.000092 -0.000140 -0.018897 -0.012641 0.018528 0.017964 -0.007861 -0.002776 -0.349771 0.030069 -0.093379 0.334430 -0.038868 0.079255 -0.000143 0.000090 0.000219 0.000023 0.000416 -0.000069 0.000229 -0.000012 -0.000156 -0.321163 0.033644 -0.087059 0.286962 -0.050316 0.065082 -0.004033 0.019557 0.038421 -0.000065 -0.000015 -0.000086 0.008172 -0.002717 0.001592 -0.002966 0.003678 0.000862 -0.002460 -0.000272 -0.001129 -0.000874 0.000824 -0.000293 -0.010372 -0.000833 -0.000268 -0.007482 0.004590 -0.001609 0.001438 -0.001152 -0.000560 0.120512 -0.005441 0.035511 0.000162 -0.000002 0.000062 0.009586 -0.004467 0.002579 -0.274345 -0.033133 -0.113782 -0.283524 0.089882 -0.037763 -0.000114 0.000038 0.000032 0.291247 -0.091433 0.038919 0.293668 0.025830 0.116885 -0.158373 0.018411 -0.041370 0.006139 0.002416 0.001233 -0.004735 -0.001341 0.002574 -0.001010 -0.000066 0.000645 0.000396 -0.000280 -0.000099 0.019391 0.014163 -0.006380 0.026171 -0.009189 0.003017 0.255197 0.196680 0.208664 0.273811 -0.256088 -0.080197 -0.000358 -0.000089 0.000096 0.000104 0.000597 0.000006 0.000694 -0.000003 -0.000469 -0.249689 0.259428 0.082377 -0.237039 -0.210957 -0.221471 -0.001672 -0.010192 -0.008720 0.000296 -0.000032 0.000065 -0.006855 -0.000678 0.001398 0.004944 -0.003972 -0.000345 0.002145 -0.000939 -0.002062 -0.113654 -0.398387 0.075944 0.008028 -0.034955 0.013730 0.051802 -0.127327 0.019488 0.017766 0.015938 0.006451 0.004282 0.000966 0.000911 -0.010032 -0.002462 -0.007444 0.057180 0.714140 -0.150810 -0.002191 -0.001280 -0.001883 -0.001936 0.001904 0.000881 0.001308 -0.000726 0.004973 0.002600 -0.001364 0.000080 0.001332 0.000087 0.000408 -0.002006 0.000986 -0.000082 -0.149019 -0.089168 -0.019348 -0.061004 0.072044 -0.043169 0.029683 -0.012654 0.001877 -0.010227 0.031823 0.016342 0.349471 0.158737 -0.055756 0.122219 -0.175681 0.150644 -0.001486 -0.000952 -0.001816 0.001018 0.000555 -0.000881 0.009453 -0.002469 -0.002992 -0.018992 -0.005631 -0.006425 -0.007100 0.006494 -0.001503 -0.000357 0.000547 0.000175 0.001307 0.000316 -0.000397 -0.011212 0.018075 0.033556 0.000002 -0.000001 -0.000003 -0.000015 -0.000026 -0.000005 0.000005 0.000026 0.000011 -0.000004 0.000013 0.000005 -0.000103 -0.000078 0.000065 0.000077 0.000006 0.000052 0.000505 -0.000122 -0.000000 0.001390 0.003010 0.005860 0.000005 0.000007 0.000003 -0.030929 -0.030878 -0.053703 0.000038 0.000371 -0.000211 0.000012 -0.000015 -0.000007 -0.000003 0.000002 -0.000000 0.005943 0.004168 0.007175 -0.000001 0.000002 -0.000000 0.000004 0.000000 0.000002 0.000002 -0.000003 -0.000003 -0.014003 0.034919 -0.031025 -0.015560 -0.072070 -0.028994 0.181479 0.746455 0.304530 0.181830 -0.379347 0.325545 0.000256 0.000002 -0.000014 0.003439 0.001097 -0.001461 -0.000039 0.000105 0.000011 -0.000009 0.000008 0.000005 -0.029700 0.057141 -0.046791 -0.004845 0.001301 0.003948 -0.028511 -0.108385 -0.040431 0.000025 0.000002 -0.000002 -0.000009 0.000010 0.000003 0.000071 -0.000075 0.000111 -0.000000 0.000000 0.000003 -0.000030 -0.000008 0.000018 0.000013 -0.000000 -0.000010 0.000015 -0.000002 -0.000015 0.000024 -0.000053 -0.000011 0.000044 0.000027 -0.000014 0.000095 -0.000091 -0.000129 -0.001298 -0.000479 -0.002016 0.000012 -0.000001 -0.000002 0.002216 0.005213 0.006379 -0.000140 0.000104 -0.000016 -0.000008 -0.000003 -0.000005 -0.000003 0.000010 0.000006 0.048523 0.003350 0.016225 0.000003 -0.000006 -0.000000 0.000003 0.000004 0.000005 -0.000017 0.000002 -0.000001 0.009627 -0.018225 0.015124 0.006859 0.024588 0.008775 -0.023286 -0.100888 -0.041446 -0.016461 0.037960 -0.031498 0.000076 -0.000111 0.000087 -0.000879 -0.000062 0.000504 -0.000019 -0.000034 -0.000008 -0.000035 -0.000015 -0.000013 -0.235888 0.452328 -0.396610 -0.188777 0.050915 0.409954 -0.140228 -0.542133 -0.208231 0.000002 0.000007 0.000016 0.000015 -0.000017 -0.000001 -0.000151 0.000030 0.000085 0.000001 -0.000000 0.000003 -0.000066 -0.000005 0.000050 0.000044 0.000000 -0.000025 0.000089 -0.000021 -0.000017 -0.000195 -0.000306 0.000039 0.000115 -0.000025 0.000074 0.000292 -0.000429 -0.000236 0.028702 -0.010366 0.057488 0.000019 -0.000009 -0.000010 -0.002762 0.035074 -0.006711 -0.000548 0.001225 -0.000370 -0.000005 -0.000009 -0.000009 -0.000001 0.000020 0.000009 0.001396 -0.008917 0.001172 0.000005 -0.000008 -0.000000 0.000005 0.000005 0.000004 -0.000017 0.000002 -0.000003 -0.251086 0.550685 -0.504477 -0.088168 -0.426226 -0.169438 -0.060472 -0.234212 -0.103036 0.099155 -0.189363 0.174966 0.000701 -0.000124 0.000191 0.001005 0.000375 0.001527 -0.000058 0.000012 0.000012 -0.000062 -0.000064 -0.000050 -0.029791 0.052434 -0.047501 -0.006238 -0.001426 0.010083 0.014082 0.056588 0.024026 0.000001 0.000000 0.000014 0.000020 -0.000018 0.000001 -0.000995 0.000270 -0.000176 0.000000 0.000000 -0.000003 0.000034 0.000028 -0.000036 -0.000010 -0.000023 0.000019 -0.000047 0.000008 0.000014 -0.000020 -0.000006 0.000151 -0.000114 -0.000050 -0.000028 0.000118 0.000152 0.000171 -0.012530 -0.014744 -0.024423 -0.000014 -0.000003 0.000010 -0.014198 0.072592 -0.025875 0.000382 -0.000137 -0.000040 -0.000003 0.000012 0.000013 0.000003 -0.000012 -0.000008 -0.000038 -0.025383 0.007129 -0.000002 0.000002 0.000003 -0.000003 -0.000002 -0.000007 0.000013 -0.000000 0.000002 0.069894 -0.159496 0.145362 0.075174 0.343085 0.140232 -0.095083 -0.360724 -0.160015 0.261941 -0.510735 0.470536 -0.000118 0.000062 -0.000101 -0.002400 -0.003690 -0.000689 0.000070 -0.000076 -0.000030 0.000047 0.000049 0.000027 -0.068704 0.129614 -0.118525 0.022112 -0.012944 -0.043628 0.051075 0.187811 0.077784 -0.000008 -0.000004 -0.000009 -0.000003 0.000011 -0.000011 0.000535 -0.000124 0.000110 0.000001 0.000005 -0.000003 0.000002 0.000012 -0.000007 0.000002 -0.000015 0.000011 -0.000009 0.000002 0.000004 0.000018 -0.000042 0.000051 -0.000046 -0.000027 -0.000005 0.000085 0.000087 0.000058 -0.000491 -0.021160 -0.000582 -0.000003 -0.000004 0.000004 -0.003313 0.023406 -0.006185 0.000006 0.000062 -0.000011 -0.000008 0.000007 0.000009 0.000004 0.000002 -0.000003 -0.004868 0.085451 -0.017751 -0.000000 -0.000000 0.000004 0.000001 0.000005 -0.000006 0.000002 0.000004 -0.000001 -0.036460 0.073804 -0.068314 0.041248 0.179188 0.074657 -0.038177 -0.134631 -0.056874 0.076816 -0.142611 0.130101 0.000084 -0.000068 0.000003 -0.000828 -0.003355 -0.000588 0.000046 -0.000079 -0.000025 0.000005 0.000005 -0.000016 0.249326 -0.450699 0.410720 -0.024282 0.024679 0.043593 -0.165408 -0.592655 -0.242505 -0.000010 -0.000003 -0.000001 0.000010 0.000007 -0.000014 0.000099 -0.000003 0.000039 -0.000001 -0.000005 0.000003 0.000001 -0.000022 0.000001 0.000008 0.000046 -0.000009 0.000015 0.000018 -0.000001 0.000384 0.000385 -0.000051 -0.000040 0.000108 -0.000052 -0.000129 0.001241 -0.000086 0.002042 -0.088748 0.004947 0.000002 0.000011 -0.000000 0.002880 -0.023334 0.005632 -0.000549 -0.000952 0.000384 0.000014 -0.000013 -0.000007 -0.000004 -0.000001 -0.000003 -0.002184 -0.010669 0.019207 -0.000001 0.000001 -0.000000 0.000001 -0.000001 0.000003 -0.000001 -0.000004 0.000000 -0.171626 0.373655 -0.357612 0.147987 0.682372 0.294926 0.033368 0.138809 0.062163 -0.067704 0.133792 -0.124471 -0.000432 -0.000166 0.000021 0.003362 -0.010086 -0.002123 -0.000078 0.000135 0.000060 0.000000 0.000017 0.000027 -0.063645 0.111762 -0.096990 0.075047 -0.020223 -0.152044 0.013559 0.039206 0.019429 0.000017 0.000004 0.000012 -0.000014 0.000001 0.000009 -0.000172 -0.000176 -0.000049 0.000002 -0.000003 -0.000008 -0.000014 -0.000007 0.000002 0.000009 0.000012 0.000007 -0.000012 0.000010 0.000003 0.000080 0.000063 0.000024 0.000017 0.000030 -0.000005 0.000009 0.000214 0.000073 -0.000516 -0.016467 0.000415 0.000006 0.000003 0.000003 -0.001989 -0.005073 -0.003647 -0.000133 -0.000129 0.000050 0.000006 -0.000010 -0.000006 -0.000008 0.000001 -0.000001 0.016490 -0.020517 -0.086739 0.000003 -0.000002 -0.000003 0.000002 -0.000000 -0.000000 -0.000006 -0.000002 -0.000007 -0.029345 0.061462 -0.058425 0.027954 0.135123 0.058933 0.018031 0.066697 0.028776 0.005855 -0.008905 0.007759 0.000024 -0.000146 -0.000005 0.001120 -0.001712 -0.000580 -0.000045 0.000064 0.000014 0.000000 0.000034 0.000028 0.097659 -0.183027 0.141550 -0.381381 0.095549 0.777451 0.093681 0.333306 0.114767 0.000017 0.000004 0.000000 -0.000011 0.000008 -0.000000 0.000113 -0.000092 0.000121 0.000043 -0.000001 0.000014 -0.000017 -0.000179 -0.000121 0.000098 -0.000042 0.000009 -0.000084 0.000144 0.000039 -0.000001 -0.000005 -0.000000 0.000162 -0.000083 0.000077 -0.000024 -0.000026 -0.000004 0.000012 0.000004 0.000009 -0.001818 0.001979 0.000631 0.000001 -0.000005 -0.000001 0.000035 0.000031 -0.000014 -0.008441 0.014610 0.006498 -0.032613 -0.052831 -0.047060 0.000003 0.000001 0.000002 -0.003748 -0.006453 -0.005429 -0.015073 0.026753 0.012677 -0.000665 -0.000506 -0.000595 -0.000045 0.000066 -0.000063 -0.000011 -0.000063 -0.000021 0.000008 0.000025 0.000011 -0.000004 0.000023 -0.000019 -0.000443 0.001830 -0.001456 0.000090 0.000275 0.000065 0.104912 -0.161214 -0.067707 0.382937 0.592105 0.537548 -0.000009 0.000016 -0.000015 -0.000003 -0.000003 -0.000002 -0.000003 -0.000019 -0.000007 0.048065 0.072670 0.063271 0.204778 -0.305328 -0.133705 -0.000912 0.000930 0.000254 0.000031 -0.000013 0.000002 -0.000042 0.000281 0.000146 -0.000223 -0.000136 -0.000152 0.000155 -0.000055 0.000052 0.000004 0.000006 0.000003 0.000060 -0.000002 -0.000045 -0.000004 -0.000003 0.000003 0.000005 -0.000014 0.000006 -0.000754 -0.002575 -0.001961 -0.000001 -0.000015 -0.000004 -0.000015 -0.000013 -0.000014 -0.039375 0.061669 0.026319 0.008625 0.012510 0.011428 0.000002 -0.000007 -0.000002 -0.012262 -0.024078 -0.019717 0.002494 -0.005159 -0.002571 -0.000506 0.001120 0.000545 -0.000032 0.000075 -0.000077 0.000005 0.000056 0.000028 0.000033 0.000143 0.000060 -0.000013 0.000030 -0.000028 0.000000 -0.000290 0.000527 0.000114 0.000011 -0.000079 0.456453 -0.700226 -0.293864 -0.094466 -0.146130 -0.132604 -0.000014 0.000022 -0.000025 -0.000014 -0.000000 0.000025 0.000025 0.000074 0.000030 0.175071 0.265031 0.230407 -0.038981 0.058200 0.025532 0.000217 -0.000046 0.000350 0.000061 0.000025 0.000037 -0.000000 0.000090 0.000051 -0.000068 -0.000012 -0.000029 0.000050 -0.000053 -0.000003 0.000002 0.000003 -0.000000 -0.000057 0.000046 -0.000035 0.000006 0.000002 0.000001 -0.000003 -0.000006 -0.000003 0.000601 -0.002045 -0.001118 0.000001 -0.000004 -0.000002 -0.000014 -0.000014 0.000002 -0.008662 0.010858 0.004061 0.016793 0.020124 0.019426 0.000000 -0.000002 -0.000001 0.016655 0.023316 0.020678 -0.040455 0.057248 0.024417 -0.000756 -0.003334 -0.002431 0.000007 -0.000008 0.000003 0.000012 0.000056 0.000021 0.000013 0.000053 0.000022 -0.000001 -0.000003 -0.000000 0.000303 -0.000844 0.000597 0.000007 -0.000038 -0.000034 0.082339 -0.123547 -0.051274 -0.154941 -0.232995 -0.212898 0.000003 -0.000002 0.000002 -0.000003 0.000002 0.000011 0.000013 0.000045 0.000018 -0.179423 -0.266367 -0.232491 0.438862 -0.644210 -0.280800 0.000356 -0.000326 0.000032 -0.000171 0.000031 -0.000037 -0.000033 0.000028 0.000009 -0.000049 -0.000043 -0.000050 0.000020 0.000026 0.000026 -0.000001 0.000005 -0.000001 0.000091 -0.000043 0.000016 -0.000015 -0.000010 -0.000003 0.000006 -0.000005 0.000007 -0.001206 -0.000528 -0.000784 -0.000002 -0.000008 -0.000001 0.000001 0.000001 -0.000007 -0.020350 0.026269 0.010001 -0.008623 -0.010633 -0.010175 0.000001 -0.000002 0.000001 0.034342 0.048794 0.043100 0.018785 -0.026906 -0.011550 0.002737 -0.001572 -0.000112 -0.000036 0.000065 -0.000064 -0.000006 -0.000006 0.000001 0.000015 0.000060 0.000026 -0.000009 0.000025 -0.000021 -0.000230 0.000660 -0.000352 0.000076 0.000109 0.000003 0.195311 -0.294006 -0.122212 0.080060 0.120649 0.110169 -0.000018 0.000027 -0.000027 -0.000016 0.000001 0.000025 0.000003 0.000009 0.000004 -0.370699 -0.550309 -0.480272 -0.204007 0.299440 0.130527 -0.000086 0.000264 0.000208 0.000017 -0.000004 0.000003 -0.000183 -0.000051 -0.000173 0.000186 0.000674 -0.000292 0.000893 -0.000061 -0.000100 -0.000091 -0.000234 0.000146 0.037572 -0.057873 0.023232 -0.000800 -0.000477 -0.000114 0.000073 0.000027 0.000035 0.000215 0.000067 0.000110 -0.000016 0.000009 -0.000026 0.000213 -0.000056 -0.000548 -0.000122 -0.000101 -0.000200 0.000082 0.000247 0.000207 0.000010 0.000007 0.000006 0.000145 -0.000096 -0.000014 0.000010 -0.000015 -0.000001 -0.000043 0.000099 0.000036 -0.000261 0.000266 -0.000197 0.000019 -0.000017 -0.000007 -0.000002 -0.000039 -0.000012 0.000044 -0.000050 0.000024 -0.520295 0.795399 -0.301900 0.002848 0.007622 0.000999 -0.000350 0.000048 -0.000072 -0.001058 -0.001127 -0.001880 0.000001 -0.000002 -0.000026 -0.000159 0.000023 0.000150 -0.000030 -0.000083 -0.000070 0.000122 0.000018 0.000137 0.000327 -0.000137 -0.000114 -0.009406 0.002419 -0.004261 0.000001 -0.000000 -0.000000 -0.000031 -0.000614 0.000061 0.000082 0.000759 0.000006 -0.000285 0.000260 -0.000144 0.000059 -0.001124 0.000255 0.000616 -0.000097 -0.000005 0.026269 0.067811 0.008974 -0.000721 0.000389 0.000503 -0.000004 0.000216 0.000019 -0.000105 -0.000251 -0.000123 0.000665 -0.000285 0.000818 0.000029 -0.000017 -0.000007 -0.000041 -0.000028 -0.000053 0.000001 -0.000027 0.000020 -0.000010 0.000016 0.000015 0.000001 0.000017 0.000021 0.000011 -0.000009 -0.000003 0.002375 -0.002520 0.001525 -0.005931 -0.008656 -0.003079 0.001094 0.001763 0.000199 -0.000021 0.000654 -0.000624 -0.004230 0.006774 -0.003296 -0.365836 -0.916901 -0.140843 0.000246 -0.000090 -0.000001 0.000060 0.000160 0.000142 -0.000238 0.000221 -0.000266 -0.000280 0.000049 0.000183 0.000076 0.000374 0.000167 0.000016 -0.000052 -0.000005 -0.000042 -0.000049 -0.000010 0.004429 -0.001699 0.003033 -0.000027 0.000004 -0.000009 0.000498 -0.000031 0.000651 0.000075 -0.000364 -0.000425 0.053972 -0.011405 0.028339 0.000184 0.000010 0.000020 0.000161 0.000783 -0.000782 0.000449 0.000139 0.000390 -0.000065 0.000009 -0.000124 -0.000224 -0.000089 -0.000470 0.000030 0.000002 0.000004 -0.001089 0.000162 -0.000187 -0.000090 0.000080 0.000074 0.000009 0.000012 -0.000027 -0.000005 0.000002 -0.000017 -0.000053 0.000010 0.000011 -0.000080 -0.000049 -0.000028 0.000114 0.000003 0.000045 0.000678 -0.000770 0.000291 0.000260 0.000553 -0.000077 -0.000050 0.000155 0.000103 -0.000035 -0.000148 0.000263 0.005783 -0.008105 0.003229 -0.002785 -0.004765 -0.001928 0.000235 0.000271 0.000071 -0.000118 -0.000414 -0.000821 0.000098 -0.000130 0.000059 -0.000002 0.000012 0.000093 0.000039 0.000089 -0.000012 -0.000136 0.000054 -0.000128 -0.000078 -0.000017 -0.000051 -0.870667 0.186223 -0.450847</matrix>
                  </module>
               </property>
               <property dictRef="cc:irspectrum">
                  <module cmlx:templateRef="irspectrum">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="87">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</array>
                     <array dataType="xsd:double" dictRef="cc:frequency" size="87">9.53 26.89 36.42 46.52 70.66 85.93 99.71 108.34 145.73 161.56 194.70 233.22 252.29 280.77 289.31 298.11 334.85 360.27 390.44 411.76 452.88 480.58 495.32 505.52 534.75 560.80 586.88 628.13 639.37 699.44 728.29 755.97 775.16 794.13 850.86 860.98 873.70 907.26 916.39 950.04 982.74 1008.00 1026.56 1038.06 1057.34 1086.46 1113.20 1134.40 1142.08 1150.35 1157.68 1193.44 1224.56 1242.14 1296.99 1327.54 1343.30 1345.13 1352.50 1369.46 1400.51 1425.84 1432.40 1458.43 1492.35 1499.62 1507.21 1515.50 1529.00 1564.60 1636.01 1653.90 1891.96 3057.68 3063.85 3093.41 3102.39 3136.14 3153.12 3154.29 3226.52 3228.46 3243.24 3244.52 3591.98 3640.22 3766.56</array>
                     <array dataType="xsd:double" dictRef="o:t2" size="87">0.005215 0.000955 0.000805 0.000473 0.001388 0.001650 0.003515 0.003051 0.002355 0.001214 0.022295 0.000134 0.000117 0.002189 0.000554 0.000445 0.002156 0.001036 0.000993 0.000063 0.009451 0.003744 0.002361 0.000374 0.006182 0.003005 0.017463 0.003363 0.000291 0.004735 0.000111 0.000314 0.001093 0.004567 0.001060 0.000146 0.003242 0.011712 0.000713 0.007905 0.032874 0.000001 0.000030 0.000126 0.002025 0.003759 0.002487 0.016843 0.000140 0.000429 0.000186 0.000126 0.000128 0.016515 0.001821 0.000591 0.000009 0.000359 0.000158 0.002721 0.013246 0.000010 0.000072 0.001863 0.000312 0.000032 0.000584 0.000519 0.000957 0.014543 0.000252 0.005791 0.012219 0.000279 0.000411 0.000247 0.000174 0.000387 0.000199 0.000268 0.000029 0.000055 0.000163 0.000031 0.001622 0.000894 0.004304</array>
                     <matrix cols="3"
                             dataType="xsd:double"
                             dictRef="cc:displacement"
                             rows="87">-0.027401 -0.004240 0.066676 -0.004686 0.029573 0.007640 -0.007396 0.010984 -0.025085 -0.000970 0.007832 0.020275 0.020113 -0.028790 -0.012433 -0.020988 0.029293 0.018749 -0.025779 0.013884 0.051555 -0.006020 0.038061 -0.039577 0.020485 0.042994 -0.009335 -0.033114 0.010235 -0.003526 -0.039853 -0.135138 0.049445 0.011481 0.001541 -0.000255 0.003222 -0.005053 -0.009028 0.046294 0.001620 -0.006543 0.001281 0.004044 0.023146 0.012882 0.010820 -0.012736 0.026452 0.028054 -0.025865 0.030009 0.008423 0.008038 -0.030897 -0.006078 -0.001357 -0.002833 0.000039 -0.007439 0.042180 -0.034884 0.080342 -0.058052 -0.016400 -0.010256 -0.045580 -0.016821 -0.000173 0.006941 0.018038 -0.000100 0.043333 0.009097 0.064971 0.002367 0.007063 -0.054312 -0.072859 -0.045220 0.100545 -0.052337 -0.017813 -0.017493 -0.016827 0.002260 0.001683 -0.066511 0.000218 0.017635 0.007105 0.007007 -0.003311 -0.011293 -0.011603 0.007210 -0.021084 0.016690 0.019238 0.063109 0.008198 0.022747 0.031380 -0.008619 -0.000774 -0.007985 -0.007263 0.005417 -0.014983 -0.025525 0.048640 -0.035662 -0.013322 -0.101304 -0.025925 -0.006209 0.001554 -0.072880 -0.018574 -0.047423 -0.159020 -0.049429 0.071716 0.000507 -0.001013 0.000152 -0.005064 -0.001375 0.001541 -0.005057 0.009053 0.004331 -0.040592 -0.010758 -0.016172 -0.050065 -0.015925 -0.031612 0.024930 0.006202 0.042741 0.129289 -0.010898 -0.002864 0.008582 0.007365 -0.003418 0.007351 -0.009079 0.017110 -0.004056 0.011323 0.006445 0.009720 -0.005094 0.002369 -0.011134 0.001345 0.001438 -0.125623 -0.026611 0.005110 0.042617 -0.000987 0.002028 0.010505 -0.020103 -0.008763 0.002711 0.001260 0.000648 -0.013557 -0.013245 -0.000334 0.012523 0.001160 0.000561 -0.038106 -0.032730 0.014059 0.098816 -0.058500 -0.007670 -0.002607 0.000658 0.001582 0.007625 0.003453 0.001540 -0.013215 0.035823 0.020126 -0.006419 0.014647 0.007522 -0.005199 -0.001377 0.001856 0.009111 -0.022082 0.003714 -0.001114 0.006278 0.021880 0.029629 -0.002167 0.008628 -0.118959 0.019573 -0.003007 -0.006864 0.012630 0.006739 -0.073321 0.007216 -0.019055 0.011617 0.107545 -0.022775 -0.009286 -0.009445 -0.010170 0.019024 0.001961 0.006747 0.010084 0.000177 0.012046 -0.007893 0.007439 -0.007483 -0.002282 0.019000 -0.004543 0.000355 -0.013243 0.004818 0.003280 -0.005652 -0.015014 0.004422 0.000700 0.002951 0.005204 -0.005127 -0.001446 0.002164 -0.010697 -0.006631 -0.001549 -0.004448 -0.003003 -0.013991 0.032797 -0.018730 -0.010267 -0.028071 0.000569 -0.047350 0.003426 -0.045278</matrix>
                  </module>
               </property>
            </propertyList>
            <molecule id="molecule">
               <atomArray>
                  <atom elementType="Cl"
                        id="a1"
                        x3="-5.833418"
                        y3="0.265502"
                        z3="-0.814369"/>
                  <atom elementType="S"
                        id="a2"
                        x3="0.096011"
                        y3="-0.460715"
                        z3="0.673096"/>
                  <atom elementType="O"
                        id="a3"
                        x3="0.589414"
                        y3="-1.782637"
                        z3="0.550241"/>
                  <atom elementType="O"
                        id="a4"
                        x3="0.175996"
                        y3="0.054433"
                        z3="2.141162"/>
                  <atom elementType="O"
                        id="a5"
                        x3="2.670676"
                        y3="1.978436"
                        z3="-0.370244"/>
                  <atom elementType="N"
                        id="a6"
                        x3="0.897596"
                        y3="0.555633"
                        z3="-0.26745"/>
                  <atom elementType="N"
                        id="a7"
                        x3="3.081599"
                        y3="-0.197419"
                        z3="0.215302"/>
                  <atom elementType="C"
                        id="a8"
                        x3="4.539858"
                        y3="-0.065204"
                        z3="0.292562"/>
                  <atom elementType="C"
                        id="a9"
                        x3="-1.568531"
                        y3="-0.231805"
                        z3="0.310072"/>
                  <atom elementType="C"
                        id="a10"
                        x3="5.225911"
                        y3="-0.229863"
                        z3="-1.056201"/>
                  <atom elementType="C"
                        id="a11"
                        x3="2.334445"
                        y3="0.852125"
                        z3="-0.158117"/>
                  <atom elementType="C"
                        id="a12"
                        x3="-2.159656"
                        y3="-1.184834"
                        z3="-0.51519"/>
                  <atom elementType="C"
                        id="a13"
                        x3="-2.267552"
                        y3="0.872129"
                        z3="0.798473"/>
                  <atom elementType="C"
                        id="a14"
                        x3="6.73709"
                        y3="-0.091479"
                        z3="-0.932947"/>
                  <atom elementType="C"
                        id="a15"
                        x3="-3.486041"
                        y3="-1.026327"
                        z3="-0.860043"/>
                  <atom elementType="C"
                        id="a16"
                        x3="-3.590302"
                        y3="1.019315"
                        z3="0.444031"/>
                  <atom elementType="C"
                        id="a17"
                        x3="-4.193132"
                        y3="0.072882"
                        z3="-0.383559"/>
                  <atom elementType="H"
                        id="a18"
                        x3="4.890247"
                        y3="-0.814904"
                        z3="1.002674"/>
                  <atom elementType="H"
                        id="a19"
                        x3="4.753395"
                        y3="0.916064"
                        z3="0.714618"/>
                  <atom elementType="H"
                        id="a20"
                        x3="4.972206"
                        y3="-1.208579"
                        z3="-1.473105"/>
                  <atom elementType="H"
                        id="a21"
                        x3="4.834887"
                        y3="0.522383"
                        z3="-1.744878"/>
                  <atom elementType="H"
                        id="a22"
                        x3="0.37549"
                        y3="1.371036"
                        z3="-0.565911"/>
                  <atom elementType="H"
                        id="a23"
                        x3="2.707482"
                        y3="-1.12084"
                        z3="0.063996"/>
                  <atom elementType="H"
                        id="a24"
                        x3="-1.597809"
                        y3="-2.038332"
                        z3="-0.870701"/>
                  <atom elementType="H"
                        id="a25"
                        x3="-1.798382"
                        y3="1.593838"
                        z3="1.453721"/>
                  <atom elementType="H"
                        id="a26"
                        x3="7.153075"
                        y3="-0.84499"
                        z3="-0.262008"/>
                  <atom elementType="H"
                        id="a27"
                        x3="7.217195"
                        y3="-0.211829"
                        z3="-1.902665"/>
                  <atom elementType="H"
                        id="a28"
                        x3="7.013064"
                        y3="0.890867"
                        z3="-0.546827"/>
                  <atom elementType="H"
                        id="a29"
                        x3="-3.976859"
                        y3="-1.751336"
                        z3="-1.493623"/>
                  <atom elementType="H"
                        id="a30"
                        x3="-4.164539"
                        y3="1.85894"
                        z3="0.80927"/>
                  <atom elementType="H"
                        id="a31"
                        x3="1.030756"
                        y3="-0.13482"
                        z3="2.557941"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a17" order="S"/>
                  <bond atomRefs2="a2 a9" order="S"/>
                  <bond atomRefs2="a2 a6" order="S"/>
                  <bond atomRefs2="a2 a4" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a4 a31" order="S"/>
                  <bond atomRefs2="a5 a11" order="S"/>
                  <bond atomRefs2="a6 a11" order="S"/>
                  <bond atomRefs2="a6 a22" order="S"/>
                  <bond atomRefs2="a7 a8" order="S"/>
                  <bond atomRefs2="a7 a11" order="S"/>
                  <bond atomRefs2="a7 a23" order="S"/>
                  <bond atomRefs2="a8 a10" order="S"/>
                  <bond atomRefs2="a8 a18" order="S"/>
                  <bond atomRefs2="a8 a19" order="S"/>
                  <bond atomRefs2="a9 a13" order="S"/>
                  <bond atomRefs2="a9 a12" order="S"/>
                  <bond atomRefs2="a10 a14" order="S"/>
                  <bond atomRefs2="a10 a20" order="S"/>
                  <bond atomRefs2="a10 a21" order="S"/>
                  <bond atomRefs2="a12 a15" order="S"/>
                  <bond atomRefs2="a12 a24" order="S"/>
                  <bond atomRefs2="a13 a16" order="S"/>
                  <bond atomRefs2="a13 a25" order="S"/>
                  <bond atomRefs2="a14 a26" order="S"/>
                  <bond atomRefs2="a14 a28" order="S"/>
                  <bond atomRefs2="a14 a27" order="S"/>
                  <bond atomRefs2="a15 a17" order="S"/>
                  <bond atomRefs2="a15 a29" order="S"/>
                  <bond atomRefs2="a16 a17" order="S"/>
                  <bond atomRefs2="a16 a30" order="S"/>
               </bondArray>
               <formula concise="C10H14ClN2O3S">
                  <atomArray count="10 14 1 2 3 1" elementType="C H Cl N O S"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">263.6365999999999</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1S/C10H14ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6,12-13,15H,2,7H2,1H3">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:14,10,15,16,12,13,8,17,9,11,1,7,6,5,4,3,2/E:(3,4)(5,6)/CRV:3.3,4.3,5.3,6.3,8.3,9.3,10.3,14.1,16.1/rA:31ClSO1OO1NNCC3CC3C3C3CC3C3C3HHHHHHHHHHHHHH/rB:;s2;s2;;s2;;s7;s2;s8;s5s6s7;s9;s9;s10;s12;s13;s1s15s16;s8;s8;s10;s10;s6;s7;s12;s13;s14;s14;s14;s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</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">-1582.89751835</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:nucrepener" units="nonsi:hartree">1484.05411780</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:electener" units="nonsi:hartree">-3066.95163615</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="cc:oneelecener"
                          units="nonsi:hartree">-5099.19377532</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:twoeener" units="nonsi:hartree">2032.24213917</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="cc:potentialEnergy"
                          units="nonsi:hartree">-3161.37832493</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="cc:kineticenergy"
                          units="nonsi:hartree">1578.48080658</scalar>
                  <scalar dataType="xsd:double" dictRef="o:vircoeff">2.00279808</scalar>
                  <list id="dftcomponents">
                     <scalar dataType="xsd:double" dictRef="cc:alphae">72.000006484234</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:betae">72.000006484234</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:totale">144.000012968467</scalar>
                     <scalar dataType="xsd:double" dictRef="o:xcener" units="nonsi:hartree">-108.599810346552</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="orbitalenergies" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="orbital">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="745">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 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 376 377 378 379 380 381 382 383 384 385 386 387 388 389 390 391 392 393 394 395 396 397 398 399 400 401 402 403 404 405 406 407 408 409 410 411 412 413 414 415 416 417 418 419 420 421 422 423 424 425 426 427 428 429 430 431 432 433 434 435 436 437 438 439 440 441 442 443 444 445 446 447 448 449 450 451 452 453 454 455 456 457 458 459 460 461 462 463 464 465 466 467 468 469 470 471 472 473 474 475 476 477 478 479 480 481 482 483 484 485 486 487 488 489 490 491 492 493 494 495 496 497 498 499 500 501 502 503 504 505 506 507 508 509 510 511 512 513 514 515 516 517 518 519 520 521 522 523 524 525 526 527 528 529 530 531 532 533 534 535 536 537 538 539 540 541 542 543 544 545 546 547 548 549 550 551 552 553 554 555 556 557 558 559 560 561 562 563 564 565 566 567 568 569 570 571 572 573 574 575 576 577 578 579 580 581 582 583 584 585 586 587 588 589 590 591 592 593 594 595 596 597 598 599 600 601 602 603 604 605 606 607 608 609 610 611 612 613 614 615 616 617 618 619 620 621 622 623 624 625 626 627 628 629 630 631 632 633 634 635 636 637 638 639 640 641 642 643 644 645 646 647 648 649 650 651 652 653 654 655 656 657 658 659 660 661 662 663 664 665 666 667 668 669 670 671 672 673 674 675 676 677 678 679 680 681 682 683 684 685 686 687 688 689 690 691 692 693 694 695 696 697 698 699 700 701 702 703 704 705 706 707 708 709 710 711 712 713 714 715 716 717 718 719 720 721 722 723 724 725 726 727 728 729 730 731 732 733 734 735 736 737 738 739 740 741 742 743 744</array>
                     <array dataType="xsd:double" dictRef="cc:occup" size="745">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 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 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 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 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 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="745"
                            units="nonsi:electronvolt">-2768.8488 -2431.9174 -530.3710 -528.7996 -526.7390 -398.6618 -397.2735 -287.7189 -285.8986 -285.5602 -284.9464 -284.9054 -284.3501 -284.3099 -283.8690 -282.4216 -281.7865 -264.1116 -229.6344 -202.9566 -202.7146 -202.6903 -173.9934 -173.9198 -173.8669 -39.9333 -37.1514 -36.4811 -33.8572 -32.6500 -32.0646 -30.7439 -28.9108 -28.5136 -27.6261 -26.7548 -25.4023 -24.7739 -24.4352 -24.1127 -23.2690 -22.8390 -22.3493 -22.0396 -21.5310 -20.6183 -20.2630 -20.0201 -19.4663 -19.2030 -19.1276 -18.9675 -18.7977 -18.5865 -18.2023 -18.1595 -17.5540 -17.4034 -16.9877 -16.8898 -16.7827 -16.1418 -16.0228 -15.7127 -15.4922 -14.9279 -14.7057 -14.4972 -14.4034 -14.1113 -13.5351 -13.3666 -4.0061 -2.9238 -2.1177 -1.5524 -1.0460 -0.7339 -0.2522 -0.1240 0.3101 0.4274 0.5128 0.9414 1.1879 1.2927 1.5324 1.6548 1.7096 1.8908 2.1904 2.4192 2.6626 2.7335 2.9435 2.9985 3.1996 3.4072 3.6779 3.7273 3.8772 4.0296 4.1530 4.4504 4.5175 4.6727 4.9217 5.0630 5.0976 5.3358 5.5387 5.5769 5.7201 6.0128 6.0831 6.1379 6.6210 6.6374 6.7927 6.9563 7.0431 7.2280 7.3289 7.4083 7.6172 7.8815 8.1018 8.2588 8.3763 8.4807 8.5642 8.7108 8.9147 9.1280 9.2464 9.4850 9.5572 9.8030 9.8948 10.0440 10.1748 10.3127 10.4026 10.6658 10.7618 10.8383 10.9105 11.2217 11.3321 11.3618 11.6650 11.7891 11.9221 12.0203 12.2589 12.3855 12.4378 12.6483 12.6904 12.7453 13.0623 13.2264 13.3191 13.4976 13.6203 13.6799 13.8965 14.0338 14.3364 14.5124 14.6715 14.8779 15.0309 15.3981 15.5818 15.7830 15.8454 16.0875 16.2732 16.3936 16.4767 16.7951 17.1287 17.3861 17.4442 17.5874 17.9661 18.0713 18.3547 18.5178 18.6588 18.7356 18.9873 19.0392 19.6511 19.8451 20.1569 20.1795 20.2185 20.4812 20.6829 21.0208 21.5220 21.7192 21.8706 22.1446 22.2913 22.3754 22.5541 22.6479 22.8196 23.1169 23.5385 23.8821 24.1331 24.4475 24.6366 24.7983 24.9603 25.2609 25.3358 25.5201 25.7484 25.9963 26.0954 26.3398 26.7802 26.9189 27.1115 27.5483 27.8360 27.9243 27.9943 28.1483 28.3933 28.7957 28.8651 29.2535 29.5843 29.6626 29.9475 30.0072 30.4545 30.7893 30.8487 31.2818 31.6333 31.6684 31.8652 31.9242 32.2044 32.3187 32.3772 32.9390 33.0953 33.3683 33.6885 33.7986 33.9385 33.9913 34.0987 34.2389 34.6848 34.9224 35.0443 35.2016 35.4108 35.6071 35.8334 35.9214 36.2442 36.6139 37.2488 37.3277 37.6801 37.9910 38.1002 38.3549 38.5548 38.8700 39.0115 39.1005 39.1274 39.3254 39.5254 39.6758 39.8974 40.1368 40.2095 40.2880 40.5265 40.8730 40.9406 41.1980 41.4436 41.6901 41.7371 42.0513 42.3866 42.6679 42.9133 43.2019 43.2892 43.5650 43.7475 44.0870 44.3452 44.5811 44.9100 45.0828 45.1340 45.2992 45.7328 46.1231 46.5475 47.0032 47.1493 47.6742 47.8472 48.2968 48.3689 48.6263 48.9611 49.2769 49.5766 49.6899 50.1582 50.3309 50.6098 51.0737 51.3005 51.6327 52.0049 52.5378 52.6278 53.0769 53.2092 53.7314 53.8476 53.9267 54.3253 54.6442 55.0513 55.0629 55.5245 55.7940 56.0179 56.1448 56.1822 56.3764 56.6665 57.0121 57.3414 58.2223 58.3452 58.8493 58.9957 59.2776 59.5184 59.7717 60.0423 60.4376 60.6549 60.8334 61.1376 61.1841 61.6239 61.9268 62.2498 62.3360 62.5549 62.8758 63.2944 63.4786 63.5714 64.0835 64.1173 65.0114 65.8612 66.3979 66.5980 67.3852 67.5685 68.1574 68.2501 68.5653 68.8460 69.3681 69.5937 69.7518 70.2233 70.5330 71.0236 71.5246 71.6413 71.8792 72.3905 72.5724 72.7564 72.8921 73.0852 74.0950 74.3531 74.4771 74.9234 75.2247 75.4678 75.6035 75.7785 75.9671 76.2678 76.8447 76.9276 77.1373 77.4389 77.5853 77.7201 78.0067 78.0848 78.4610 78.5515 78.6259 78.9066 79.2240 79.3403 79.5406 79.8961 80.1191 80.1614 80.3513 80.4812 80.8100 80.9184 81.2994 81.4729 81.7924 82.0812 82.5976 82.9052 83.0282 83.1985 83.4018 83.6952 83.7500 83.9492 84.2082 84.3474 84.4904 84.6498 84.8658 84.8853 85.0128 85.1387 85.4191 85.5406 85.9869 86.0934 86.2990 86.4796 86.7386 86.8187 86.9769 87.1427 87.3082 87.4889 87.6585 87.7268 88.0360 88.2429 88.3235 88.8575 89.0470 89.3078 89.5778 89.6874 89.8807 90.1353 90.3538 90.5824 91.3848 91.6382 91.7305 92.3398 92.5038 92.6719 92.8683 93.1285 93.1937 93.3541 94.1621 94.3303 94.6198 94.8152 95.3046 95.5079 95.5932 95.7926 96.0652 96.2549 96.5273 97.0700 97.3297 97.7976 98.1035 98.4100 98.7742 98.8838 99.0556 99.0693 99.1733 99.4762 100.2196 100.6221 101.0540 101.3145 101.4865 101.6178 101.8681 101.9741 102.1839 102.3451 102.6499 102.9636 103.1649 103.4897 103.8865 104.1168 104.3516 104.5552 104.8641 105.2205 105.5492 105.6430 105.8678 106.0189 106.2891 106.6391 106.8007 107.0023 107.3429 107.4340 107.5371 107.6386 108.1973 108.3568 108.9812 109.3515 109.6873 109.7258 109.9149 110.2132 110.5657 110.8562 110.9833 111.1538 111.6475 111.8602 112.0025 112.2217 112.4820 112.5482 112.8293 113.2695 113.3250 113.8490 113.9356 114.2271 114.4741 114.7687 115.0639 115.3282 115.5990 115.9091 116.4145 116.4269 116.6253 116.7472 116.9619 117.0172 117.3220 117.6137 118.2014 118.3200 118.6729 119.4321 119.5243 120.6642 121.2117 121.5604 121.8572 122.2159 122.3185 123.1465 123.3558 123.6658 124.3688 125.0358 125.3749 125.8328 126.5580 126.9479 127.0781 127.2273 127.3099 127.3577 127.6414 127.9241 128.3851 128.7170 129.1462 129.2328 129.8016 130.8194 131.0085 131.5454 132.2139 132.7782 133.5882 133.6478 133.9652 134.0474 134.2548 134.5876 135.0220 135.2309 135.6745 136.0592 136.8873 137.4523 137.8548 138.2830 138.4229 138.7787 139.0866 139.8743 140.1395 140.7314 140.9292 141.4995 141.8823 141.9906 142.1270 142.9145 143.2210 143.5500 143.6295 143.8570 144.0956 144.2032 144.3961 144.5709 144.8237 145.3018 145.8725 146.1296 146.2559 146.5510 147.2001 147.7981 148.9883 149.2767 149.5473 149.8331 150.0592 150.3731 150.7501 150.9883 151.1673 151.3767 151.4855 151.6131 152.6711 152.7828 152.9085 153.8423 154.5643 154.8244 155.2371 155.5145 155.9162 156.3373 156.4809 157.4855 158.6755 162.6068 164.9930 165.9061 167.8264 169.0993 170.9002 171.4616 171.7265 172.6718 172.8122 173.1690 174.9629 175.3790 176.1498 176.6402 176.9023 178.7473 180.1892 181.5551 182.1473 182.8750 184.8799 186.3739 186.4421 187.9454 188.8647 192.9691 194.3583 195.9960 196.8300 204.5725 208.8332 210.8117 218.1191 219.4716 219.9817 224.0023 226.4935 255.9714 257.2115 267.8278 291.4561 294.1296 309.3026 607.8370 614.0816 621.1923 628.2075 630.1541 631.8336 636.0808 636.4018 637.7028 643.5217 648.6022 712.4087 886.9928 895.6394 1189.9229 1192.3974 1194.6548</array>
                  </list>
               </module>
               <module cmlx:templateRef="mullikenpopulation" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="atomiccharges">
                     <scalar dataType="xsd:double" dictRef="x:chargesum">1.0000000</scalar>
                     <array dataType="xsd:integer" dictRef="cc:serial" size="31">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</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="31">Cl S O O O N N C C C C C C C C C C H H H H H H H H H H H H H H</array>
                     <array dataType="xsd:double" dictRef="x:charge" size="31">0.036120 0.778207 -0.372470 -0.200378 -0.304943 -0.153505 -0.246883 -0.045415 -0.023446 -0.100526 0.330506 -0.090918 -0.130309 -0.242055 -0.079221 -0.079627 0.053298 0.107916 0.109364 0.062455 0.084109 0.192514 0.177276 0.162243 0.157687 0.079091 0.099994 0.087133 0.154084 0.154010 0.243691</array>
                  </module>
               </module>
               <module cmlx:templateRef="loewdin" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:integer" dictRef="cc:serial" size="31">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</array>
                  <array dataType="xsd:string" dictRef="cc:elementType" size="31">Cl S O O O N N C C C C C C C C C C H H H H H H H H H H H H H H</array>
                  <array dataType="xsd:double" dictRef="x:charge" size="31">0.508046 0.857401 -0.172554 0.199581 0.146017 0.125251 0.307691 -0.036306 -0.265004 -0.043429 -0.496576 0.020902 0.005588 0.013069 0.005890 0.005113 -0.365923 0.025327 0.032632 0.017575 0.023675 -0.010009 -0.027936 0.041316 0.037268 0.014651 0.019534 0.016933 0.041303 0.041205 -0.088233</array>
               </module>
               <module cmlx:templateRef="mayer" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="mayercharges">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="31">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</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="31">Cl S O O O N N C C C C C C C C C C H H H H H H H H H H H H H H</array>
                     <array dataType="xsd:double" dictRef="o:na" size="31">16.9639 15.2218 8.3725 8.2004 8.3049 7.1535 7.2469 6.0454 6.0234 6.1005 5.6695 6.0909 6.1303 6.2421 6.0792 6.0796 5.9467 0.8921 0.8906 0.9375 0.9159 0.8075 0.8227 0.8378 0.8423 0.9209 0.9000 0.9129 0.8459 0.8460 0.7563</array>
                     <array dataType="xsd:double" dictRef="o:za" size="31">17.0000 16.0000 8.0000 8.0000 8.0000 7.0000 7.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 1.0000 1.0000 1.0000 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="31">0.0361 0.7782 -0.3725 -0.2004 -0.3049 -0.1535 -0.2469 -0.0454 -0.0234 -0.1005 0.3305 -0.0909 -0.1303 -0.2421 -0.0792 -0.0796 0.0533 0.1079 0.1094 0.0625 0.0841 0.1925 0.1773 0.1622 0.1577 0.0791 0.1000 0.0871 0.1541 0.1540 0.2437</array>
                     <array dataType="xsd:double" dictRef="o:va" size="31">1.3494 5.6634 2.1148 2.2251 2.2055 3.1187 3.1938 3.8305 3.7280 3.8879 4.3457 3.9992 4.0468 3.9622 3.9718 3.9931 4.1052 1.0008 1.0113 1.0093 1.0136 1.0216 1.0220 1.0037 1.0070 1.0037 1.0059 1.0033 1.0041 1.0044 1.0247</array>
                     <array dataType="xsd:double" dictRef="o:bva" size="31">1.3494 5.6634 2.1148 2.2251 2.2055 3.1187 3.1938 3.8305 3.7280 3.8879 4.3457 3.9992 4.0468 3.9622 3.9718 3.9931 4.1052 1.0008 1.0113 1.0093 1.0136 1.0216 1.0220 1.0037 1.0070 1.0037 1.0059 1.0033 1.0041 1.0044 1.0247</array>
                     <array dataType="xsd:double" dictRef="o:fa" size="31">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>
                  </module>
                  <module cmlx:templateRef="bonds">
                     <array dataType="xsd:double" dictRef="x:distance" size="31">1.1807 1.9646 1.1923 1.1987 0.9713 0.9455 2.0458 0.9177 0.9342 0.8681 1.2710 0.9477 0.9370 0.9874 0.9974 1.3357 1.3236 0.9538 0.9960 1.0009 1.4734 0.9394 1.5112 0.9364 0.9894 0.9916 0.9935 1.3787 0.9547 1.3622 0.9527</array>
                     <matrix cols="2" dataType="xsd:integer" dictRef="x:serial" rows="31">0 16 1 2 1 3 1 5 1 8 3 30 4 10 5 10 5 21 6 7 6 10 6 22 7 9 7 17 7 18 8 11 8 12 9 13 9 19 9 20 11 14 11 23 12 15 12 24 13 25 13 26 13 27 14 16 14 28 15 16 15 29</matrix>
                  </module>
               </module>
               <module cmlx:templateRef="dftd3" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:dispcorr" units="nonsi:hartree">-0.013677848</scalar>
               </module>
               <module cmlx:templateRef="finalspenergy" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="cc:energy">-1582.911256440108</scalar>
               </module>
               <module cmlx:templateRef="electricproperties" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="cc:dipole" size="9">40.96609 -40.91612 0.04997 -1.35722 0.86678 -0.49044 -1.09901 1.92599 0.82698</array>
                  <scalar dataType="xsd:double" dictRef="o:magnitude" units="nonsi2:au">0.96277</scalar>
                  <scalar dataType="xsd:double" dictRef="o:magnitude" units="nonsi2:debye">2.44717</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">277.75</scalar>
               </module>
               <module cmlx:templateRef="innerenergy" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="contributions">
                     <scalar dataType="xsd:double" dictRef="o:electronic" units="nonsi:hartree">-1582.91125644</scalar>
                     <scalar dataType="xsd:double" dictRef="o:zeropoint" units="nonsi:hartree">0.24407169</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="o:thermalvibcorrection"
                             units="nonsi:hartree">0.01506213</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">-1582.64929008</scalar>
                  </module>
                  <module cmlx:templateRef="corrections">
                     <scalar dataType="xsd:double" dictRef="o:thermalcorr" units="nonsi:hartree">0.01789467</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="o:nonthermalcorr"
                             units="nonsi:hartree">0.24407169</scalar>
                     <scalar dataType="xsd:double" dictRef="o:totalcorr" units="nonsi:hartree">0.26196636</scalar>
                  </module>
               </module>
               <module cmlx:templateRef="enthalpy" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="o:totalfree" units="nonsi:hartree">-1582.64929008</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="o:thermalcorrenthalpy"
                          units="nonsi:hartree">0.00094421</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="o:totalenthalpy"
                          units="nonsi:hartree">-1582.64834587</scalar>
               </module>
               <module cmlx:templateRef="gibbs" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double"
                          dictRef="o:totalenthalpy"
                          units="nonsi:hartree">-1582.64834587</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="o:totalentropycorr"
                          units="nonsi:hartree">-0.06399595</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="o:gibbsenthalpy"
                          units="nonsi:hartree">-1582.71234182</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="o:gibbsminuselec"
                          units="nonsi:hartree">0.19891462</scalar>
               </module>
            </module>
         </module>
      </module>
   </module>
</module>
