<?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="1.581163" y3="3.066573" z3="1.589208"/>
  <cml:atom id="a2" elementType="C" x3="0.689467" y3="2.222907" z3="2.238767"/>
  <cml:atom id="a3" elementType="C" x3="-0.168734" y3="1.408780" z3="1.506506"/>
  <cml:atom id="a4" elementType="C" x3="-0.130220" y3="1.418840" z3="0.117621"/>
  <cml:atom id="a5" elementType="C" x3="0.750491" y3="2.284447" z3="-0.531071"/>
  <cml:atom id="a6" elementType="C" x3="1.603814" y3="3.099640" z3="0.197954"/>
  <cml:atom id="a7" elementType="H" x3="2.248911" y3="3.697205" z3="2.159516"/>
  <cml:atom id="a8" elementType="H" x3="0.653220" y3="2.197722" z3="3.319152"/>
  <cml:atom id="a9" elementType="H" x3="-0.873692" y3="0.782578" z3="2.029414"/>
  <cml:atom id="a10" elementType="H" x3="0.761655" y3="2.326276" z3="-1.612625"/>
  <cml:atom id="a11" elementType="H" x3="2.285913" y3="3.759924" z3="-0.319650"/>
  <cml:atom id="a12" elementType="C" x3="-1.109848" y3="0.672706" z3="-0.736759"/>
  <cml:atom id="a13" elementType="N" x3="-1.893420" y3="-0.446175" z3="-0.218749"/>
  <cml:atom id="a14" elementType="C" x3="-1.347181" y3="-1.502286" z3="0.623516"/>
  <cml:atom id="a15" elementType="H" x3="-0.341439" y3="-1.233920" z3="0.928411"/>
  <cml:atom id="a16" elementType="H" x3="-1.302091" y3="-2.435086" z3="0.054414"/>
  <cml:atom id="a17" elementType="C" x3="-3.326870" y3="-0.547548" z3="-0.495860"/>
  <cml:atom id="a18" elementType="H" x3="-3.654851" y3="0.352698" z3="-1.006953"/>
  <cml:atom id="a19" elementType="H" x3="-3.513867" y3="-1.410857" z3="-1.138100"/>
  <cml:atom id="a20" elementType="C" x3="-4.082060" y3="-0.732854" z3="0.813314"/>
  <cml:atom id="a21" elementType="H" x3="-3.984003" y3="0.161131" z3="1.438356"/>
  <cml:atom id="a22" elementType="H" x3="-5.135956" y3="-0.909498" z3="0.609329"/>
  <cml:atom id="a23" elementType="C" x3="-2.226900" y3="-1.702023" z3="1.857734"/>
  <cml:atom id="a24" elementType="H" x3="-1.911478" y3="-2.603176" z3="2.378747"/>
  <cml:atom id="a25" elementType="O" x3="-3.591486" y3="-1.871541" z3="1.509577"/>
  <cml:atom id="a26" elementType="C" spinMultiplicity="2" x3="-0.727829" y3="-0.266280" z3="-1.809035"/>
  <cml:atom id="a27" elementType="H" x3="-3.710083" y3="3.169611" z3="-1.132324"/>
  <cml:atom id="a28" elementType="H" x3="-1.418104" y3="-0.327053" z3="-2.643663"/>
  <cml:atom id="a29" elementType="S" x3="0.517789" y3="-1.372383" z3="-2.017187"/>
  <cml:atom id="a30" elementType="H" x3="-2.125985" y3="-0.850594" z3="2.538320"/>
  <cml:atom id="a31" elementType="C" x3="2.050228" y3="-2.284404" z3="-0.065745"/>
  <cml:atom id="a32" elementType="C" x3="2.809045" y3="-0.275621" z3="-1.204622"/>
  <cml:atom id="a33" elementType="C" x3="2.891066" y3="-1.869236" z3="1.130758"/>
  <cml:atom id="a34" elementType="H" x3="2.634332" y3="-2.947256" z3="-0.713725"/>
  <cml:atom id="a35" elementType="H" x3="1.169567" y3="-2.825193" z3="0.271872"/>
  <cml:atom id="a36" elementType="C" x3="3.621912" y3="0.063869" z3="0.033243"/>
  <cml:atom id="a37" elementType="H" x3="3.425753" y3="-0.838403" z3="-1.913963"/>
  <cml:atom id="a38" elementType="H" x3="2.471869" y3="0.638842" z3="-1.683760"/>
  <cml:atom id="a39" elementType="H" x3="3.262465" y3="-2.753312" z3="1.644942"/>
  <cml:atom id="a40" elementType="H" x3="2.280565" y3="-1.281986" z3="1.826132"/>
  <cml:atom id="a41" elementType="H" x3="4.529384" y3="0.591375" z3="-0.253335"/>
  <cml:atom id="a42" elementType="H" x3="3.031790" y3="0.702655" z3="0.696555"/>
  <cml:atom id="a43" elementType="N" x3="1.635448" y3="-1.064333" z3="-0.784580"/>
  <cml:atom id="a44" elementType="O" x3="4.024028" y3="-1.112584" z3="0.726792"/>
  <cml:atom id="a45" elementType="N" x3="-2.934996" y3="2.893033" z3="-1.724798"/>
  <cml:atom id="a46" elementType="H" x3="-2.311017" y3="3.689525" z3="-1.788878"/>
  <cml:atom id="a47" elementType="H" x3="-1.823297" y3="1.422782" z3="-1.146214"/>
  <cml:atom id="a48" elementType="H" x3="-3.309015" y3="2.732413" z3="-2.654221"/>
 </cml:atomArray>
 <cml:bondArray>
  <cml:bond atomRefs2="a48 a45" order="1"/>
  <cml:bond atomRefs2="a28 a26" order="1"/>
  <cml:bond atomRefs2="a29 a26" order="1"/>
  <cml:bond atomRefs2="a29 a43" order="1"/>
  <cml:bond atomRefs2="a37 a32" order="1"/>
  <cml:bond atomRefs2="a26 a12" order="1"/>
  <cml:bond atomRefs2="a46 a45" order="1"/>
  <cml:bond atomRefs2="a45 a27" order="1"/>
  <cml:bond atomRefs2="a38 a32" order="1"/>
  <cml:bond atomRefs2="a10 a5" order="1"/>
  <cml:bond atomRefs2="a32 a43" order="1"/>
  <cml:bond atomRefs2="a32 a36" order="1"/>
  <cml:bond atomRefs2="a47 a12" order="1"/>
  <cml:bond atomRefs2="a19 a17" order="1"/>
  <cml:bond atomRefs2="a18 a17" order="1"/>
  <cml:bond atomRefs2="a43 a31" order="1"/>
  <cml:bond atomRefs2="a12 a13" order="1"/>
  <cml:bond atomRefs2="a12 a4" order="1"/>
  <cml:bond atomRefs2="a34 a31" order="1"/>
  <cml:bond atomRefs2="a5 a4" order="2"/>
  <cml:bond atomRefs2="a5 a6" order="1"/>
  <cml:bond atomRefs2="a17 a13" order="1"/>
  <cml:bond atomRefs2="a17 a20" order="1"/>
  <cml:bond atomRefs2="a11 a6" order="1"/>
  <cml:bond atomRefs2="a41 a36" order="1"/>
  <cml:bond atomRefs2="a13 a14" order="1"/>
  <cml:bond atomRefs2="a31 a35" order="1"/>
  <cml:bond atomRefs2="a31 a33" order="1"/>
  <cml:bond atomRefs2="a36 a42" order="1"/>
  <cml:bond atomRefs2="a36 a44" order="1"/>
  <cml:bond atomRefs2="a16 a14" order="1"/>
  <cml:bond atomRefs2="a4 a3" order="1"/>
  <cml:bond atomRefs2="a6 a1" order="2"/>
  <cml:bond atomRefs2="a22 a20" order="1"/>
  <cml:bond atomRefs2="a14 a15" order="1"/>
  <cml:bond atomRefs2="a14 a23" order="1"/>
  <cml:bond atomRefs2="a44 a33" order="1"/>
  <cml:bond atomRefs2="a20 a21" order="1"/>
  <cml:bond atomRefs2="a20 a25" order="1"/>
  <cml:bond atomRefs2="a33 a39" order="1"/>
  <cml:bond atomRefs2="a33 a40" order="1"/>
  <cml:bond atomRefs2="a3 a9" order="1"/>
  <cml:bond atomRefs2="a3 a2" order="2"/>
  <cml:bond atomRefs2="a25 a23" order="1"/>
  <cml:bond atomRefs2="a1 a7" order="1"/>
  <cml:bond atomRefs2="a1 a2" order="1"/>
  <cml:bond atomRefs2="a23 a24" order="1"/>
  <cml:bond atomRefs2="a23 a30" order="1"/>
  <cml:bond atomRefs2="a2 a8" order="1"/>
 </cml:bondArray>
</cml:molecule>
