<?xml version="1.0"?>
<cml:molecule id="output-0" xmlns:cml="http://www.xml-cml.org/schema">
 <cml:atomArray>
  <cml:atom id="a1" elementType="C" x3="0.727837" y3="3.633760" z3="0.582928"/>
  <cml:atom id="a2" elementType="C" x3="0.340688" y3="3.345714" z3="-0.721478"/>
  <cml:atom id="a3" elementType="C" x3="-0.074254" y3="2.063934" z3="-1.057102"/>
  <cml:atom id="a4" elementType="C" x3="-0.112601" y3="1.064503" z3="-0.083850"/>
  <cml:atom id="a5" elementType="C" x3="0.274693" y3="1.358802" z3="1.224910"/>
  <cml:atom id="a6" elementType="C" x3="0.696326" y3="2.637768" z3="1.554987"/>
  <cml:atom id="a7" elementType="H" x3="1.059316" y3="4.629971" z3="0.840892"/>
  <cml:atom id="a8" elementType="H" x3="0.370042" y3="4.115962" z3="-1.479421"/>
  <cml:atom id="a9" elementType="H" x3="-0.356776" y3="1.827611" z3="-2.073457"/>
  <cml:atom id="a10" elementType="H" x3="0.251253" y3="0.582238" z3="1.976679"/>
  <cml:atom id="a11" elementType="H" x3="1.004678" y3="2.857096" z3="2.567497"/>
  <cml:atom id="a12" elementType="C" spinMultiplicity="3" x3="-0.505649" y3="-0.292792" z3="-0.470194"/>
  <cml:atom id="a13" elementType="N" x3="-2.156023" y3="-0.592088" z3="0.578487"/>
  <cml:atom id="a14" elementType="C" x3="-2.960652" y3="0.597946" z3="0.911704"/>
  <cml:atom id="a15" elementType="H" x3="-2.302922" y3="1.381224" z3="1.278995"/>
  <cml:atom id="a16" elementType="H" x3="-3.654864" y3="0.336456" z3="1.714982"/>
  <cml:atom id="a17" elementType="C" x3="-2.955955" y3="-1.634168" z3="-0.076106"/>
  <cml:atom id="a18" elementType="H" x3="-2.288108" y3="-2.414372" z3="-0.441368"/>
  <cml:atom id="a19" elementType="H" x3="-3.625691" y3="-2.084833" z3="0.659700"/>
  <cml:atom id="a20" elementType="C" x3="-3.754202" y3="-1.060006" z3="-1.234603"/>
  <cml:atom id="a21" elementType="H" x3="-3.082946" y3="-0.739147" z3="-2.038168"/>
  <cml:atom id="a22" elementType="H" x3="-4.427441" y3="-1.816799" z3="-1.630770"/>
  <cml:atom id="a23" elementType="C" x3="-3.736480" y3="1.079514" z3="-0.297373"/>
  <cml:atom id="a24" elementType="H" x3="-4.396406" y3="1.896839" z3="-0.015465"/>
  <cml:atom id="a25" elementType="O" x3="-4.555179" y3="0.040948" z3="-0.823386"/>
  <cml:atom id="a26" elementType="C" spinMultiplicity="2" x3="-0.360664" y3="-1.070342" z3="-1.576640"/>
  <cml:atom id="a27" elementType="H" x3="-1.517366" y3="-2.603919" z3="3.200617"/>
  <cml:atom id="a28" elementType="S" x3="0.576173" y3="-1.793083" z3="-0.378820"/>
  <cml:atom id="a29" elementType="H" x3="-3.050662" y3="1.438043" z3="-1.073553"/>
  <cml:atom id="a30" elementType="C" x3="3.116317" y3="-1.873717" z3="0.438384"/>
  <cml:atom id="a31" elementType="C" x3="2.734759" y3="-0.628791" z3="-1.659968"/>
  <cml:atom id="a32" elementType="C" x3="3.713012" y3="-0.600499" z3="1.018904"/>
  <cml:atom id="a33" elementType="H" x3="3.912918" y3="-2.515658" z3="0.056316"/>
  <cml:atom id="a34" elementType="H" x3="2.575170" y3="-2.428177" z3="1.205531"/>
  <cml:atom id="a35" elementType="C" x3="3.374103" y3="0.579131" z3="-0.985906"/>
  <cml:atom id="a36" elementType="H" x3="3.477415" y3="-1.156569" z3="-2.262201"/>
  <cml:atom id="a37" elementType="H" x3="1.926213" y3="-0.314723" z3="-2.318725"/>
  <cml:atom id="a38" elementType="H" x3="4.490599" y3="-0.842949" z3="1.740958"/>
  <cml:atom id="a39" elementType="H" x3="2.936041" y3="-0.011902" z3="1.519672"/>
  <cml:atom id="a40" elementType="H" x3="3.911651" y3="1.174788" z3="-1.721319"/>
  <cml:atom id="a41" elementType="H" x3="2.606007" y3="1.202955" z3="-0.520218"/>
  <cml:atom id="a42" elementType="N" x3="2.209042" y3="-1.566751" z3="-0.672238"/>
  <cml:atom id="a43" elementType="O" x3="4.325335" y3="0.179380" z3="-0.002799"/>
  <cml:atom id="a44" elementType="N" x3="-1.009431" y3="-1.747604" z3="3.008160"/>
  <cml:atom id="a45" elementType="H" x3="-0.027667" y3="-1.995988" z3="2.960507"/>
  <cml:atom id="a46" elementType="H" x3="-1.738720" y3="-0.976665" z3="1.446482"/>
  <cml:atom id="a47" elementType="H" x3="-1.123159" y3="-1.151335" z3="3.820387"/>
  <cml:atom id="a48" elementType="H" x3="-0.717373" y3="-1.322889" z3="-2.556385"/>
 </cml:atomArray>
 <cml:bondArray>
  <cml:bond atomRefs2="a48 a26" order="1"/>
  <cml:bond atomRefs2="a37 a31" order="1"/>
  <cml:bond atomRefs2="a36 a31" order="1"/>
  <cml:bond atomRefs2="a9 a3" order="1"/>
  <cml:bond atomRefs2="a21 a20" order="1"/>
  <cml:bond atomRefs2="a40 a35" order="1"/>
  <cml:bond atomRefs2="a31 a35" order="1"/>
  <cml:bond atomRefs2="a31 a42" order="1"/>
  <cml:bond atomRefs2="a22 a20" order="1"/>
  <cml:bond atomRefs2="a26 a12" order="1"/>
  <cml:bond atomRefs2="a26 a28" order="1"/>
  <cml:bond atomRefs2="a8 a2" order="1"/>
  <cml:bond atomRefs2="a20 a25" order="1"/>
  <cml:bond atomRefs2="a20 a17" order="1"/>
  <cml:bond atomRefs2="a29 a23" order="1"/>
  <cml:bond atomRefs2="a3 a2" order="2"/>
  <cml:bond atomRefs2="a3 a4" order="1"/>
  <cml:bond atomRefs2="a35 a41" order="1"/>
  <cml:bond atomRefs2="a35 a43" order="1"/>
  <cml:bond atomRefs2="a25 a23" order="1"/>
  <cml:bond atomRefs2="a2 a1" order="1"/>
  <cml:bond atomRefs2="a42 a28" order="1"/>
  <cml:bond atomRefs2="a42 a30" order="1"/>
  <cml:bond atomRefs2="a12 a4" order="1"/>
  <cml:bond atomRefs2="a18 a17" order="1"/>
  <cml:bond atomRefs2="a23 a24" order="1"/>
  <cml:bond atomRefs2="a23 a14" order="1"/>
  <cml:bond atomRefs2="a4 a5" order="2"/>
  <cml:bond atomRefs2="a17 a13" order="1"/>
  <cml:bond atomRefs2="a17 a19" order="1"/>
  <cml:bond atomRefs2="a43 a32" order="1"/>
  <cml:bond atomRefs2="a33 a30" order="1"/>
  <cml:bond atomRefs2="a30 a32" order="1"/>
  <cml:bond atomRefs2="a30 a34" order="1"/>
  <cml:bond atomRefs2="a13 a14" order="1"/>
  <cml:bond atomRefs2="a13 a46" order="1"/>
  <cml:bond atomRefs2="a1 a7" order="1"/>
  <cml:bond atomRefs2="a1 a6" order="2"/>
  <cml:bond atomRefs2="a14 a15" order="1"/>
  <cml:bond atomRefs2="a14 a16" order="1"/>
  <cml:bond atomRefs2="a32 a39" order="1"/>
  <cml:bond atomRefs2="a32 a38" order="1"/>
  <cml:bond atomRefs2="a5 a6" order="1"/>
  <cml:bond atomRefs2="a5 a10" order="1"/>
  <cml:bond atomRefs2="a6 a11" order="1"/>
  <cml:bond atomRefs2="a45 a44" order="1"/>
  <cml:bond atomRefs2="a44 a27" order="1"/>
  <cml:bond atomRefs2="a44 a47" order="1"/>
 </cml:bondArray>
</cml:molecule>
