<?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="-1.896343" y3="2.814180" z3="-1.646375"/>
  <cml:atom id="a2" elementType="C" x3="-1.005236" y3="1.968559" z3="-2.294326"/>
  <cml:atom id="a3" elementType="C" x3="-0.061694" y3="1.251602" z3="-1.567209"/>
  <cml:atom id="a4" elementType="C" x3="-0.019902" y3="1.353744" z3="-0.180840"/>
  <cml:atom id="a5" elementType="C" x3="-0.907017" y3="2.216475" z3="0.465063"/>
  <cml:atom id="a6" elementType="C" x3="-1.838357" y3="2.942672" z3="-0.262793"/>
  <cml:atom id="a7" elementType="H" x3="-2.627619" y3="3.372202" z3="-2.214201"/>
  <cml:atom id="a8" elementType="H" x3="-1.034142" y3="1.868751" z3="-3.370376"/>
  <cml:atom id="a9" elementType="H" x3="0.641632" y3="0.628988" z3="-2.094311"/>
  <cml:atom id="a10" elementType="H" x3="-0.862591" y3="2.322367" z3="1.540532"/>
  <cml:atom id="a11" elementType="H" x3="-2.522611" y3="3.602417" z3="0.252265"/>
  <cml:atom id="a12" elementType="C" x3="1.022673" y3="0.731931" z3="0.679228"/>
  <cml:atom id="a13" elementType="N" x3="1.612565" y3="-0.645276" z3="0.486504"/>
  <cml:atom id="a14" elementType="C" x3="1.068957" y3="-1.644477" z3="-0.468871"/>
  <cml:atom id="a15" elementType="H" x3="0.057831" y3="-1.356469" z3="-0.730567"/>
  <cml:atom id="a16" elementType="H" x3="1.046267" y3="-2.590955" z3="0.067247"/>
  <cml:atom id="a17" elementType="C" x3="3.077776" y3="-0.806066" z3="0.717048"/>
  <cml:atom id="a18" elementType="H" x3="3.420003" y3="0.041693" z3="1.303926"/>
  <cml:atom id="a19" elementType="H" x3="3.203113" y3="-1.726332" z3="1.285188"/>
  <cml:atom id="a20" elementType="C" x3="3.809738" y3="-0.896116" z3="-0.605070"/>
  <cml:atom id="a21" elementType="H" x3="3.719192" y3="0.042052" z3="-1.163376"/>
  <cml:atom id="a22" elementType="H" x3="4.863309" y3="-1.088339" z3="-0.417526"/>
  <cml:atom id="a23" elementType="C" x3="1.948258" y3="-1.763612" z3="-1.706436"/>
  <cml:atom id="a24" elementType="H" x3="1.611230" y3="-2.623319" z3="-2.280927"/>
  <cml:atom id="a25" elementType="O" x3="3.308956" y3="-1.978789" z3="-1.376112"/>
  <cml:atom id="a26" elementType="C" x3="0.795261" y3="-0.301556" z3="1.715392"/>
  <cml:atom id="a27" elementType="H" x3="4.217423" y3="2.781716" z3="1.134250"/>
  <cml:atom id="a28" elementType="H" x3="1.432803" y3="-0.227240" z3="2.589500"/>
  <cml:atom id="a29" elementType="S" x3="-0.636054" y3="-1.208897" z3="2.240810"/>
  <cml:atom id="a30" elementType="H" x3="1.863604" y3="-0.875828" z3="-2.337982"/>
  <cml:atom id="a31" elementType="C" x3="-2.164230" y3="-2.442052" z3="0.436214"/>
  <cml:atom id="a32" elementType="C" x3="-2.948465" y3="-0.307368" z3="1.251829"/>
  <cml:atom id="a33" elementType="C" x3="-2.993603" y3="-2.223572" z3="-0.819863"/>
  <cml:atom id="a34" elementType="H" x3="-2.755259" y3="-3.000103" z3="1.171675"/>
  <cml:atom id="a35" elementType="H" x3="-1.281999" y3="-3.029874" z3="0.197033"/>
  <cml:atom id="a36" elementType="C" x3="-3.747135" y3="-0.152480" z3="-0.031082"/>
  <cml:atom id="a37" elementType="H" x3="-3.573495" y3="-0.775882" z3="2.021224"/>
  <cml:atom id="a38" elementType="H" x3="-2.633613" y3="0.667380" z3="1.609376"/>
  <cml:atom id="a39" elementType="H" x3="-3.356932" y3="-3.177738" z3="-1.196792"/>
  <cml:atom id="a40" elementType="H" x3="-2.377371" y3="-1.748759" z3="-1.592659"/>
  <cml:atom id="a41" elementType="H" x3="-4.661840" y3="0.404724" z3="0.162248"/>
  <cml:atom id="a42" elementType="H" x3="-3.151025" y3="0.388315" z3="-0.772119"/>
  <cml:atom id="a43" elementType="N" x3="-1.759797" y3="-1.129456" z3="0.970671"/>
  <cml:atom id="a44" elementType="O" x3="-4.134769" y3="-1.418950" z3="-0.554913"/>
  <cml:atom id="a45" elementType="N" x3="3.482478" y3="2.566705" z3="1.799046"/>
  <cml:atom id="a46" elementType="H" x3="2.982323" y3="3.432574" z3="1.968525"/>
  <cml:atom id="a47" elementType="H" x3="1.825476" y3="1.417931" z3="0.949632"/>
  <cml:atom id="a48" elementType="H" x3="3.940230" y3="2.322526" z3="2.670299"/>
 </cml:atomArray>
 <cml:bondArray>
  <cml:bond atomRefs2="a8 a2" order="1"/>
  <cml:bond atomRefs2="a30 a23" order="1"/>
  <cml:bond atomRefs2="a2 a1" order="2"/>
  <cml:bond atomRefs2="a2 a3" order="1"/>
  <cml:bond atomRefs2="a24 a23" order="1"/>
  <cml:bond atomRefs2="a7 a1" order="1"/>
  <cml:bond atomRefs2="a9 a3" order="1"/>
  <cml:bond atomRefs2="a23 a25" order="1"/>
  <cml:bond atomRefs2="a23 a14" order="1"/>
  <cml:bond atomRefs2="a1 a6" order="1"/>
  <cml:bond atomRefs2="a40 a33" order="1"/>
  <cml:bond atomRefs2="a3 a4" order="2"/>
  <cml:bond atomRefs2="a25 a20" order="1"/>
  <cml:bond atomRefs2="a39 a33" order="1"/>
  <cml:bond atomRefs2="a21 a20" order="1"/>
  <cml:bond atomRefs2="a33 a44" order="1"/>
  <cml:bond atomRefs2="a33 a31" order="1"/>
  <cml:bond atomRefs2="a42 a36" order="1"/>
  <cml:bond atomRefs2="a15 a14" order="1"/>
  <cml:bond atomRefs2="a20 a22" order="1"/>
  <cml:bond atomRefs2="a20 a17" order="1"/>
  <cml:bond atomRefs2="a44 a36" order="1"/>
  <cml:bond atomRefs2="a14 a16" order="1"/>
  <cml:bond atomRefs2="a14 a13" order="1"/>
  <cml:bond atomRefs2="a6 a11" order="1"/>
  <cml:bond atomRefs2="a6 a5" order="2"/>
  <cml:bond atomRefs2="a4 a5" order="1"/>
  <cml:bond atomRefs2="a4 a12" order="1"/>
  <cml:bond atomRefs2="a36 a41" order="1"/>
  <cml:bond atomRefs2="a36 a32" order="1"/>
  <cml:bond atomRefs2="a35 a31" order="1"/>
  <cml:bond atomRefs2="a31 a43" order="1"/>
  <cml:bond atomRefs2="a31 a34" order="1"/>
  <cml:bond atomRefs2="a5 a10" order="1"/>
  <cml:bond atomRefs2="a13 a12" order="1"/>
  <cml:bond atomRefs2="a13 a17" order="1"/>
  <cml:bond atomRefs2="a13 a26" order="1"/>
  <cml:bond atomRefs2="a12 a47" order="1"/>
  <cml:bond atomRefs2="a12 a26" order="1"/>
  <cml:bond atomRefs2="a17 a19" order="1"/>
  <cml:bond atomRefs2="a17 a18" order="1"/>
  <cml:bond atomRefs2="a43 a32" order="1"/>
  <cml:bond atomRefs2="a43 a29" order="1"/>
  <cml:bond atomRefs2="a27 a45" order="1"/>
  <cml:bond atomRefs2="a32 a38" order="1"/>
  <cml:bond atomRefs2="a32 a37" order="1"/>
  <cml:bond atomRefs2="a26 a29" order="1"/>
  <cml:bond atomRefs2="a26 a28" order="1"/>
  <cml:bond atomRefs2="a45 a46" order="1"/>
  <cml:bond atomRefs2="a45 a48" order="1"/>
 </cml:bondArray>
</cml:molecule>
