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        "molfile": "\n  Marvin  01132101422D          \n\n 17 18  0  0  0  0            999 V2000\n    9.1919   -5.5761    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    9.1919   -6.4011    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4774   -6.8136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7630   -6.4011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0485   -6.8136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3340   -6.4011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3340   -5.5761    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0485   -5.1636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7630   -5.5761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4774   -7.6386    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    9.9064   -5.1636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.9064   -4.3386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.5738   -3.8537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.3188   -3.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4938   -3.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.2390   -3.8537    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   10.6209   -5.5761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  1  0  0  0  0\n  3  2  1  0  0  0  0\n  4  3  1  0  0  0  0\n  4  5  2  0  0  0  0\n  5  6  1  0  0  0  0\n  6  7  2  0  0  0  0\n  8  7  1  0  0  0  0\n  8  9  2  0  0  0  0\n  9  4  1  0  0  0  0\n  3 10  2  0  0  0  0\n  1 11  2  0  0  0  0\n 11 12  1  0  0  0  0\n 12 13  2  0  0  0  0\n 13 14  1  0  0  0  0\n 14 15  2  0  0  0  0\n 16 15  1  0  0  0  0\n 16 12  1  0  0  0  0\n 11 17  1  0  0  0  0\nM  END",
        "smiles": "C/C(=N\\NC(=O)c1ccncc1)/c2ccco2",
        "formula": "C12H11N3O2",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 1,
        "molecular_weight": "229.2351",
        "optical_activity": "NONE",
        "references": [
          "0e4d034b-1f80-473a-9671-c667d27b2967",
          "4aa1ad39-0d72-4ba0-bceb-2819fbc85ca1"
        ],
        "stereo_centers": 0
      },
      "unii": "3OUZ124988"
    }
  ]
}