<?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="-2.340306" y3="1.578468" z3="-0.847650"/>
  <cml:atom id="a2" elementType="C" spinMultiplicity="2" x3="0.856319" y3="-1.391346" z3="-0.397000"/>
  <cml:atom id="a3" elementType="O" x3="1.907665" y3="-1.427375" z3="-1.078228"/>
  <cml:atom id="a4" elementType="O" x3="-1.465177" y3="2.449975" z3="-0.952769"/>
  <cml:atom id="a5" elementType="O" x3="0.519789" y3="3.546231" z3="0.711045"/>
  <cml:atom id="a6" elementType="O" x3="0.836258" y3="-1.042968" z3="0.848660"/>
  <cml:atom id="a7" elementType="B" x3="3.368429" y3="-1.152090" z3="-0.445076"/>
  <cml:atom id="a8" elementType="B" x3="2.088522" y3="-0.719217" z3="1.546662"/>
  <cml:atom id="a9" elementType="C" x3="-0.444015" y3="-1.768319" z3="-1.004170"/>
  <cml:atom id="a10" elementType="H" x3="-0.728738" y3="-2.747535" z3="-0.613933"/>
  <cml:atom id="a11" elementType="H" x3="-0.363343" y3="-1.818472" z3="-2.084693"/>
  <cml:atom id="a12" elementType="H" x3="-1.208705" y3="-1.058221" z3="-0.697212"/>
  <cml:atom id="a13" elementType="C" x3="4.360221" y3="-2.218247" z3="-1.066477"/>
  <cml:atom id="a14" elementType="H" x3="5.374320" y3="-2.051834" z3="-0.695354"/>
  <cml:atom id="a15" elementType="H" x3="4.069926" y3="-3.234821" z3="-0.792810"/>
  <cml:atom id="a16" elementType="H" x3="4.390610" y3="-2.156483" z3="-2.156122"/>
  <cml:atom id="a17" elementType="C" x3="1.910164" y3="-0.221836" z3="3.011755"/>
  <cml:atom id="a18" elementType="H" x3="2.834687" y3="0.197681" z3="3.406315"/>
  <cml:atom id="a19" elementType="H" x3="1.122701" y3="0.529341" z3="3.081788"/>
  <cml:atom id="a20" elementType="H" x3="1.617308" y3="-1.055401" z3="3.657518"/>
  <cml:atom id="a21" elementType="C" x3="-1.849418" y3="1.189017" z3="1.513146"/>
  <cml:atom id="a22" elementType="H" x3="-2.234713" y3="0.538508" z3="2.294781"/>
  <cml:atom id="a23" elementType="H" x3="-0.787082" y3="0.989767" z3="1.380572"/>
  <cml:atom id="a24" elementType="H" x3="-1.961280" y3="2.227727" z3="1.824747"/>
  <cml:atom id="a25" elementType="N" x3="-2.587325" y3="0.922171" z3="0.291145"/>
  <cml:atom id="a26" elementType="H" x3="-3.349514" y3="0.233504" z3="0.325398"/>
  <cml:atom id="a27" elementType="C" x3="-3.179568" y3="1.191421" z3="-2.043928"/>
  <cml:atom id="a28" elementType="H" x3="-2.519888" y3="0.798101" z3="-2.817747"/>
  <cml:atom id="a29" elementType="H" x3="-3.938656" y3="0.448000" z3="-1.810102"/>
  <cml:atom id="a30" elementType="H" x3="-3.658077" y3="2.085357" z3="-2.442244"/>
  <cml:atom id="a31" elementType="O" x3="3.693753" y3="0.228309" z3="-0.929957"/>
  <cml:atom id="a32" elementType="C" x3="3.117158" y3="1.297641" z3="-0.440143"/>
  <cml:atom id="a33" elementType="O" x3="2.229244" y3="1.258530" z3="0.414533"/>
  <cml:atom id="a34" elementType="C" x3="3.637507" y3="2.589352" z3="-0.996169"/>
  <cml:atom id="a35" elementType="H" x3="3.749010" y3="2.515116" z3="-2.076251"/>
  <cml:atom id="a36" elementType="H" x3="2.974608" y3="3.408722" z3="-0.734753"/>
  <cml:atom id="a37" elementType="H" x3="4.626807" y3="2.774890" z3="-0.574072"/>
  <cml:atom id="a38" elementType="H" x3="-0.218360" y3="3.189581" z3="0.183650"/>
  <cml:atom id="a39" elementType="O" x3="3.221907" y3="-1.180840" z3="0.989768"/>
  <cml:atom id="a40" elementType="H" x3="-4.956331" y3="-1.232719" z3="1.447370"/>
  <cml:atom id="a41" elementType="N" x3="-4.664757" y3="-1.159560" z3="0.479681"/>
  <cml:atom id="a42" elementType="H" x3="-5.502633" y3="-0.958028" z3="-0.053188"/>
  <cml:atom id="a43" elementType="C" x3="-4.064121" y3="-2.423564" z3="0.030862"/>
  <cml:atom id="a44" elementType="H" x3="-4.733234" y3="-3.286192" z3="0.103593"/>
  <cml:atom id="a45" elementType="H" x3="-3.748885" y3="-2.322937" z3="-1.007642"/>
  <cml:atom id="a46" elementType="H" x3="-3.176266" y3="-2.629101" z3="0.628100"/>
  <cml:atom id="a47" elementType="H" x3="1.154818" y3="2.815153" z3="0.727662"/>
 </cml:atomArray>
 <cml:bondArray>
  <cml:bond atomRefs2="a28 a27" order="1"/>
  <cml:bond atomRefs2="a30 a27" order="1"/>
  <cml:bond atomRefs2="a16 a13" order="1"/>
  <cml:bond atomRefs2="a11 a9" order="1"/>
  <cml:bond atomRefs2="a35 a34" order="1"/>
  <cml:bond atomRefs2="a27 a29" order="1"/>
  <cml:bond atomRefs2="a27 a1" order="1"/>
  <cml:bond atomRefs2="a3 a7" order="1"/>
  <cml:bond atomRefs2="a3 a2" order="1"/>
  <cml:bond atomRefs2="a13 a15" order="1"/>
  <cml:bond atomRefs2="a13 a14" order="1"/>
  <cml:bond atomRefs2="a13 a7" order="1"/>
  <cml:bond atomRefs2="a45 a43" order="1"/>
  <cml:bond atomRefs2="a9 a12" order="1"/>
  <cml:bond atomRefs2="a9 a10" order="1"/>
  <cml:bond atomRefs2="a9 a2" order="1"/>
  <cml:bond atomRefs2="a34 a36" order="1"/>
  <cml:bond atomRefs2="a34 a37" order="1"/>
  <cml:bond atomRefs2="a34 a32" order="1"/>
  <cml:bond atomRefs2="a4 a1" order="2"/>
  <cml:bond atomRefs2="a31 a7" order="1"/>
  <cml:bond atomRefs2="a31 a32" order="1"/>
  <cml:bond atomRefs2="a1 a25" order="1"/>
  <cml:bond atomRefs2="a7 a39" order="1"/>
  <cml:bond atomRefs2="a32 a33" order="2"/>
  <cml:bond atomRefs2="a2 a6" order="1"/>
  <cml:bond atomRefs2="a42 a41" order="1"/>
  <cml:bond atomRefs2="a43 a44" order="1"/>
  <cml:bond atomRefs2="a43 a41" order="1"/>
  <cml:bond atomRefs2="a43 a46" order="1"/>
  <cml:bond atomRefs2="a38 a5" order="1"/>
  <cml:bond atomRefs2="a25 a26" order="1"/>
  <cml:bond atomRefs2="a25 a21" order="1"/>
  <cml:bond atomRefs2="a41 a40" order="1"/>
  <cml:bond atomRefs2="a5 a47" order="1"/>
  <cml:bond atomRefs2="a6 a8" order="1"/>
  <cml:bond atomRefs2="a39 a8" order="1"/>
  <cml:bond atomRefs2="a23 a21" order="1"/>
  <cml:bond atomRefs2="a21 a24" order="1"/>
  <cml:bond atomRefs2="a21 a22" order="1"/>
  <cml:bond atomRefs2="a8 a17" order="1"/>
  <cml:bond atomRefs2="a17 a19" order="1"/>
  <cml:bond atomRefs2="a17 a18" order="1"/>
  <cml:bond atomRefs2="a17 a20" order="1"/>
 </cml:bondArray>
</cml:molecule>
