File: marvin01.mrv

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rdkit 202503.1-4
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<cml xmlns="http://www.chemaxon.com" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" version="ChemAxon file format v20.20.0, generated by vunknown" xsi:schemaLocation="http://www.chemaxon.com http://www.chemaxon.com/marvin/schema/mrvSchema_20_20_0.xsd"><MDocument xmlns=""><MChemicalStruct><molecule molID="m1"><atomArray><atom id="a1" elementType="C" x2="12.662933710663964" y2="-5.774929461378871"/><atom id="a2" elementType="C" x2="11.36399593369809" y2="-6.524916030262885"/><atom id="a3" elementType="C" x2="11.36399593369809" y2="-8.025083969737116"/><atom id="a4" elementType="C" x2="12.662933710663964" y2="-8.77507053862113"/><atom id="a5" elementType="C" x2="13.961968888482936" y2="-8.025083969737116"/><atom id="a6" elementType="C" x2="13.961968888482936" y2="-6.524916030262885"/><atom id="a7" elementType="Cl" x2="12.66283630981086" y2="-4.274956323610844"/><atom id="a8" elementType="C" x2="15.261004066301908" y2="-8.77507053862113"/><atom id="a9" elementType="N" x2="10.064960755879119" y2="-8.77507053862113" formalCharge="1"/><atom id="a10" elementType="O" x2="15.261004066301908" y2="-10.275043676389156"/><atom id="a11" elementType="O" x2="16.56003924412088" y2="-8.025181370590218" formalCharge="-1"/></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"/><bond id="b7" atomRefs2="a5 a8" order="1"/><bond id="b8" atomRefs2="a1 a7" order="1"/><bond id="b9" atomRefs2="a3 a9" order="1"/><bond id="b10" atomRefs2="a8 a10" order="2"/><bond id="b11" atomRefs2="a8 a11" order="1"/></bondArray></molecule></MChemicalStruct></MDocument></cml>