File: marvin03.mrv.expected.mrv

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rdkit 202503.1-4
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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><reaction><reactantList><molecule molID="m1"><atomArray><atom id="a1" elementType="C" x2="9.62761" y2="-7.46242"/><atom id="a2" elementType="C" x2="8.32877" y2="-8.2124"/><atom id="a3" elementType="C" x2="8.32877" y2="-9.71257"/><atom id="a4" elementType="C" x2="9.62761" y2="-10.4626"/><atom id="a5" elementType="C" x2="10.9266" y2="-9.71257"/><atom id="a6" elementType="C" x2="10.9266" y2="-8.2124"/></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="2"/><bond id="b6" atomRefs2="a6 a1" order="1"/></bondArray></molecule></reactantList><agentList><molecule molID="m2"><atomArray><atom id="a7" elementType="Br" x2="14.863" y2="-7.25797"/><atom id="a8" elementType="Br" x2="16.363" y2="-7.25797"/></atomArray><bondArray><bond id="b7" atomRefs2="a7 a8" order="1"/></bondArray></molecule></agentList><productList><molecule molID="m3"><atomArray><atom id="a9" elementType="C" x2="24.1971" y2="-7.46242"/><atom id="a10" elementType="C" x2="22.8983" y2="-8.2124"/><atom id="a11" elementType="C" x2="22.8983" y2="-9.71257"/><atom id="a12" elementType="C" x2="24.1971" y2="-10.4626"/><atom id="a13" elementType="C" x2="25.4962" y2="-9.71257"/><atom id="a14" elementType="C" x2="25.4962" y2="-8.2124"/><atom id="a15" elementType="Br" x2="24.1971" y2="-5.96245"/></atomArray><bondArray><bond id="b8" atomRefs2="a9 a10" order="2"/><bond id="b9" atomRefs2="a10 a11" order="1"/><bond id="b10" atomRefs2="a11 a12" order="2"/><bond id="b11" atomRefs2="a12 a13" order="1"/><bond id="b12" atomRefs2="a13 a14" order="2"/><bond id="b13" atomRefs2="a14 a9" order="1"/><bond id="b14" atomRefs2="a9 a15" order="1"/></bondArray></molecule></productList><arrow type="DEFAULT" x1="11.4266" y1="-7.75797" x2="22.3983" y2="-7.75797"/></reaction></MChemicalStruct></MDocument></cml>