File: AtropManyChiralsEnhanced.mrv.noReapply.expected.mrv

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rdkit 202503.1-5
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<?xml version="1.0" encoding="utf-8"?>
<cml xmlns="http://www.chemaxon.com" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://www.chemaxon.com http://www.chemaxon.com/marvin/schema/mrvSchema_20_20_0.xsd"><MDocument><MChemicalStruct><molecule molID="m1"><atomArray><atom id="a1" elementType="O" x2="2.8625" y2="1.0561"/><atom id="a2" elementType="C" x2="2.2921" y2="-0.5174"/><atom id="a3" elementType="C" x2="3.4688" y2="-1.0018"/><atom id="a4" elementType="C" x2="3.6019" y2="-2.4682"/><atom id="a5" elementType="N" x2="2.3988" y2="-3.3169"/><atom id="a6" elementType="C" x2="1.0621" y2="-2.6992"/><atom id="a7" elementType="O" x2="0.1062" y2="-3.9298"/><atom id="a8" elementType="N" x2="0.9288" y2="-1.2328" mrvStereoGroup="or1"/><atom id="a9" elementType="C" x2="-0.5563" y2="-0.6124"/><atom id="a10" elementType="C" x2="-1.5367" y2="-1.8"/><atom id="a11" elementType="C" x2="-0.8947" y2="0.9647" mrvStereoGroup="or1"/><atom id="a12" elementType="C" x2="-0.8778" y2="2.5678" mrvStereoGroup="and1"/><atom id="a13" elementType="C" x2="-0.1398" y2="3.9298"/><atom id="a14" elementType="Br" x2="-1.9563" y2="3.6407"/><atom id="a15" elementType="C" x2="0.5974" y2="1.3136" mrvStereoGroup="or1"/><atom id="a16" elementType="F" x2="1.1268" y2="-0.0778"/><atom id="a17" elementType="C" x2="1.9954" y2="1.9251"/><atom id="a18" elementType="C" x2="-2.4534" y2="0.7177" mrvStereoGroup="and1"/><atom id="a19" elementType="Cl" x2="-3.6019" y2="1.737"/><atom id="a20" elementType="C" x2="-3.4495" y2="-0.4655"/></atomArray><bondArray><bond id="b1" atomRefs2="a1 a2" order="2"/><bond id="b2" atomRefs2="a2 a3" order="1"/><bond id="b3" atomRefs2="a3 a4" order="2"/><bond id="b4" atomRefs2="a4 a5" order="1"/><bond id="b5" atomRefs2="a5 a6" order="1"/><bond id="b6" atomRefs2="a6 a7" order="2"/><bond id="b7" atomRefs2="a6 a8" order="1"/><bond id="b8" atomRefs2="a8 a2" order="1"><bondStereo>W</bondStereo></bond><bond id="b9" atomRefs2="a8 a9" order="1"/><bond id="b10" atomRefs2="a9 a10" order="2"/><bond id="b11" atomRefs2="a11 a9" order="1"><bondStereo>H</bondStereo></bond><bond id="b12" atomRefs2="a11 a12" order="1"/><bond id="b13" atomRefs2="a12 a13" order="1"><bondStereo>W</bondStereo></bond><bond id="b14" atomRefs2="a12 a14" order="1"/><bond id="b15" atomRefs2="a11 a15" order="1"/><bond id="b16" atomRefs2="a15 a16" order="1"/><bond id="b17" atomRefs2="a15 a17" order="1"><bondStereo>H</bondStereo></bond><bond id="b18" atomRefs2="a11 a18" order="1"/><bond id="b19" atomRefs2="a18 a19" order="1"/><bond id="b20" atomRefs2="a18 a20" order="1"><bondStereo>W</bondStereo></bond></bondArray></molecule></MChemicalStruct></MDocument></cml>