<?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="1.510051" y3="-0.237745" z3="0.444545"/>
  <cml:atom id="a2" elementType="C" x3="0.625895" y3="-0.226070" z3="-0.824608"/>
  <cml:atom id="a3" elementType="C" x3="0.944374" y3="0.965240" z3="-1.768107"/>
  <cml:atom id="a4" elementType="C" x3="1.136769" y3="2.293651" z3="-1.031291"/>
  <cml:atom id="a5" elementType="C" x3="2.278123" y3="2.181894" z3="-0.016814"/>
  <cml:atom id="a6" elementType="C" x3="2.005321" y3="1.102598" z3="1.044691"/>
  <cml:atom id="a7" elementType="H" x3="0.142412" y3="1.045502" z3="-2.519053"/>
  <cml:atom id="a8" elementType="H" x3="0.877219" y3="-1.149338" z3="-1.367825"/>
  <cml:atom id="a9" elementType="H" x3="0.976308" y3="-0.792445" z3="1.232648"/>
  <cml:atom id="a10" elementType="H" x3="0.203156" y3="2.594962" z3="-0.523116"/>
  <cml:atom id="a11" elementType="H" x3="1.358973" y3="3.090768" z3="-1.760065"/>
  <cml:atom id="a12" elementType="H" x3="2.449896" y3="3.145860" z3="0.491038"/>
  <cml:atom id="a13" elementType="H" x3="3.207287" y3="1.929954" z3="-0.553444"/>
  <cml:atom id="a14" elementType="H" x3="1.230244" y3="1.481623" z3="1.728777"/>
  <cml:atom id="a15" elementType="H" x3="1.874284" y3="0.728779" z3="-2.307024"/>
  <cml:atom id="a16" elementType="N" x3="2.769441" y3="-1.030642" z3="0.261705"/>
  <cml:atom id="a17" elementType="C" x3="3.552014" y3="-0.773958" z3="1.495639"/>
  <cml:atom id="a18" elementType="H" x3="3.173015" y3="-1.459511" z3="2.267650"/>
  <cml:atom id="a19" elementType="C" x3="3.275989" y3="0.701123" z3="1.851813"/>
  <cml:atom id="a20" elementType="H" x3="4.125575" y3="1.340096" z3="1.570471"/>
  <cml:atom id="a21" elementType="H" x3="3.129378" y3="0.813040" z3="2.935207"/>
  <cml:atom id="a22" elementType="O" spinMultiplicity="2" x3="2.752245" y3="-2.899455" z3="-1.280290"/>
  <cml:atom id="a23" elementType="H" x3="3.431064" y3="-3.578749" z3="-1.165761"/>
  <cml:atom id="a24" elementType="C" x3="-0.863150" y3="-0.319670" z3="-0.502021"/>
  <cml:atom id="a25" elementType="C" x3="-1.462605" y3="0.436822" z3="0.536162"/>
  <cml:atom id="a26" elementType="C" x3="-1.670393" y3="-1.158677" z3="-1.286200"/>
  <cml:atom id="a27" elementType="C" x3="-2.828577" y3="0.314944" z3="0.721638"/>
  <cml:atom id="a28" elementType="H" x3="-0.885474" y3="1.096136" z3="1.184415"/>
  <cml:atom id="a29" elementType="C" x3="-3.061101" y3="-1.276639" z3="-1.088627"/>
  <cml:atom id="a30" elementType="H" x3="-1.205409" y3="-1.746001" z3="-2.082091"/>
  <cml:atom id="a31" elementType="C" x3="-3.616590" y3="-0.520911" z3="-0.072205"/>
  <cml:atom id="a32" elementType="H" x3="-3.670977" y3="-1.940589" z3="-1.703534"/>
  <cml:atom id="a33" elementType="O" x3="-3.615544" y3="0.913752" z3="1.667054"/>
  <cml:atom id="a34" elementType="O" x3="-4.914294" y3="-0.465794" z3="0.359104"/>
  <cml:atom id="a35" elementType="C" x3="-4.963523" y3="0.579944" z3="1.330293"/>
  <cml:atom id="a36" elementType="H" x3="-5.469005" y3="1.465444" z3="0.899713"/>
  <cml:atom id="a37" elementType="H" x3="-5.495332" y3="0.229873" z3="2.228219"/>
  <cml:atom id="a38" elementType="H" x3="4.601218" y3="-1.014565" z3="1.289481"/>
  <cml:atom id="a39" elementType="H" x3="2.600486" y3="-2.112761" z3="-0.064551"/>
  <cml:atom id="a40" elementType="O" x3="3.488271" y3="-0.665722" z3="-0.894621"/>
  <cml:atom id="a41" elementType="H" x3="3.344031" y3="-1.664971" z3="-1.364302"/>
 </cml:atomArray>
 <cml:bondArray>
  <cml:bond atomRefs2="a7 a3" order="1"/>
  <cml:bond atomRefs2="a15 a3" order="1"/>
  <cml:bond atomRefs2="a30 a26" order="1"/>
  <cml:bond atomRefs2="a3 a4" order="1"/>
  <cml:bond atomRefs2="a3 a2" order="1"/>
  <cml:bond atomRefs2="a11 a4" order="1"/>
  <cml:bond atomRefs2="a32 a29" order="1"/>
  <cml:bond atomRefs2="a8 a2" order="1"/>
  <cml:bond atomRefs2="a41 a40" order="1"/>
  <cml:bond atomRefs2="a26 a29" order="2"/>
  <cml:bond atomRefs2="a26 a24" order="1"/>
  <cml:bond atomRefs2="a22 a23" order="1"/>
  <cml:bond atomRefs2="a29 a31" order="1"/>
  <cml:bond atomRefs2="a4 a10" order="1"/>
  <cml:bond atomRefs2="a4 a5" order="1"/>
  <cml:bond atomRefs2="a40 a16" order="1"/>
  <cml:bond atomRefs2="a2 a24" order="1"/>
  <cml:bond atomRefs2="a2 a1" order="1"/>
  <cml:bond atomRefs2="a13 a5" order="1"/>
  <cml:bond atomRefs2="a24 a25" order="2"/>
  <cml:bond atomRefs2="a31 a34" order="1"/>
  <cml:bond atomRefs2="a31 a27" order="2"/>
  <cml:bond atomRefs2="a39 a16" order="1"/>
  <cml:bond atomRefs2="a5 a12" order="1"/>
  <cml:bond atomRefs2="a5 a6" order="1"/>
  <cml:bond atomRefs2="a16 a1" order="1"/>
  <cml:bond atomRefs2="a16 a17" order="1"/>
  <cml:bond atomRefs2="a34 a35" order="1"/>
  <cml:bond atomRefs2="a1 a6" order="1"/>
  <cml:bond atomRefs2="a1 a9" order="1"/>
  <cml:bond atomRefs2="a25 a27" order="1"/>
  <cml:bond atomRefs2="a25 a28" order="1"/>
  <cml:bond atomRefs2="a27 a33" order="1"/>
  <cml:bond atomRefs2="a36 a35" order="1"/>
  <cml:bond atomRefs2="a6 a14" order="1"/>
  <cml:bond atomRefs2="a6 a19" order="1"/>
  <cml:bond atomRefs2="a38 a17" order="1"/>
  <cml:bond atomRefs2="a35 a33" order="1"/>
  <cml:bond atomRefs2="a35 a37" order="1"/>
  <cml:bond atomRefs2="a17 a19" order="1"/>
  <cml:bond atomRefs2="a17 a18" order="1"/>
  <cml:bond atomRefs2="a20 a19" order="1"/>
  <cml:bond atomRefs2="a19 a21" order="1"/>
 </cml:bondArray>
</cml:molecule>
