{"status":"SUCCESS","message":"","cml":"<cml xmlns=\"http://www.xml-cml.org/schema\" convention=\"conventions:molecular\" xmlns:conventions=\"http://www.xml-cml.org/convention/\" xmlns:cmlDict=\"http://www.xml-cml.org/dictionary/cml/\" xmlns:nameDict=\"http://www.xml-cml.org/dictionary/cml/name/\">\n  <molecule id=\"m1\">\n    <name dictRef=\"nameDict:unknown\">2-NITROSTYRENE OXIDE<\/name>\n    <atomArray>\n      <atom id=\"a1\" elementType=\"N\" formalCharge=\"1\" hydrogenCount=\"0\">\n        <label value=\"N\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a2\" elementType=\"O\" hydrogenCount=\"0\">\n        <label value=\"O\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a3\" elementType=\"O\" formalCharge=\"-1\" hydrogenCount=\"0\">\n        <label value=\"O'\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a4\" elementType=\"C\">\n        <label value=\"beta\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a5\" elementType=\"C\">\n        <label value=\"alpha\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a6\" elementType=\"C\" hydrogenCount=\"0\">\n        <label value=\"1\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a7\" elementType=\"C\" hydrogenCount=\"0\">\n        <label value=\"2\" dictRef=\"cmlDict:locant\"/>\n        <label value=\"ortho\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a8\" elementType=\"C\">\n        <label value=\"3\" dictRef=\"cmlDict:locant\"/>\n        <label value=\"meta\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a9\" elementType=\"C\">\n        <label value=\"4\" dictRef=\"cmlDict:locant\"/>\n        <label value=\"para\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a10\" elementType=\"C\">\n        <label value=\"5\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a11\" elementType=\"C\">\n        <label value=\"6\" dictRef=\"cmlDict:locant\"/>\n      <\/atom>\n      <atom id=\"a12\" elementType=\"O\" hydrogenCount=\"0\"/>\n      <atom id=\"a13\" elementType=\"H\"/>\n      <atom id=\"a14\" elementType=\"H\"/>\n      <atom id=\"a15\" elementType=\"H\"/>\n      <atom id=\"a16\" elementType=\"H\"/>\n      <atom id=\"a17\" elementType=\"H\"/>\n      <atom id=\"a18\" elementType=\"H\"/>\n      <atom id=\"a19\" elementType=\"H\"/>\n    <\/atomArray>\n    <bondArray>\n      <bond id=\"a1_a2\" atomRefs2=\"a1 a2\" order=\"D\"/>\n      <bond id=\"a1_a3\" atomRefs2=\"a1 a3\" order=\"S\"/>\n      <bond id=\"a1_a7\" atomRefs2=\"a1 a7\" order=\"S\"/>\n      <bond id=\"a4_a5\" atomRefs2=\"a4 a5\" order=\"S\"/>\n      <bond id=\"a5_a6\" atomRefs2=\"a5 a6\" order=\"S\"/>\n      <bond id=\"a6_a7\" atomRefs2=\"a6 a7\" order=\"D\"/>\n      <bond id=\"a7_a8\" atomRefs2=\"a7 a8\" order=\"S\"/>\n      <bond id=\"a8_a9\" atomRefs2=\"a8 a9\" order=\"D\"/>\n      <bond id=\"a9_a10\" atomRefs2=\"a9 a10\" order=\"S\"/>\n      <bond id=\"a10_a11\" atomRefs2=\"a10 a11\" order=\"D\"/>\n      <bond id=\"a6_a11\" atomRefs2=\"a6 a11\" order=\"S\"/>\n      <bond id=\"a4_a12\" atomRefs2=\"a4 a12\" order=\"S\"/>\n      <bond id=\"a5_a12\" atomRefs2=\"a5 a12\" order=\"S\"/>\n      <bond id=\"a4_a13\" atomRefs2=\"a4 a13\" order=\"S\"/>\n      <bond id=\"a4_a14\" atomRefs2=\"a4 a14\" order=\"S\"/>\n      <bond id=\"a5_a15\" atomRefs2=\"a5 a15\" order=\"S\"/>\n      <bond id=\"a8_a16\" atomRefs2=\"a8 a16\" order=\"S\"/>\n      <bond id=\"a9_a17\" atomRefs2=\"a9 a17\" order=\"S\"/>\n      <bond id=\"a10_a18\" atomRefs2=\"a10 a18\" order=\"S\"/>\n      <bond id=\"a11_a19\" atomRefs2=\"a11 a19\" order=\"S\"/>\n    <\/bondArray>\n  <\/molecule>\n<\/cml>","inchi":"InChI=1/C8H7NO3/c10-9(11)7-4-2-1-3-6(7)8-5-12-8/h1-4,8H,5H2","stdinchi":"InChI=1S/C8H7NO3/c10-9(11)7-4-2-1-3-6(7)8-5-12-8/h1-4,8H,5H2","stdinchikey":"KYHJWLAPKITUMU-UHFFFAOYSA-N","smiles":"[N+](=O)([O-])C1=C(C2CO2)C=CC=C1"}