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        "molfile": "\n  Marvin  01132109412D          \n\n 17 16  0  0  0  0            999 V2000\n    2.4527   -0.9355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.4527   -1.7606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.7382   -2.1731    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    1.0237   -1.7606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.1672   -2.1731    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.8816   -1.7606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.8816   -0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.5961   -0.5231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.3105   -0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.3105   -1.7606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.0251   -2.1731    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    6.7742   -2.5933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.4886   -3.0058    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.4886   -3.8308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2032   -2.5933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.5961   -2.1731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.0151   -0.1735    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  2  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  1  0  0  0  0\n  5  2  1  0  0  0  0\n  6  5  1  0  0  0  0\n  6  7  1  0  0  0  0\n  7  8  2  0  0  0  0\n  8  9  1  0  0  0  0\n 10  9  2  0  0  0  0\n 10 11  1  0  0  0  0\n 11 12  2  3  0  0  0\n 12 13  1  0  0  0  0\n 13 14  1  0  0  0  0\n 13 15  1  0  0  0  0\n 16 10  1  0  0  0  0\n  6 16  2  0  0  0  0\nM  END",
        "smiles": "CNC(=O)Oc1cccc(c1)N=CN(C)C.Cl",
        "formula": "C11H15N3O2.ClH",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "257.717",
        "optical_activity": "NONE",
        "references": [
          "301598fd-56a9-40fe-9288-20ac5c7d272b",
          "40eb6e78-b259-41e9-bc19-179e418739a6"
        ],
        "stereo_centers": 0
      },
      "unii": "W0Y3OP0N2Z"
    }
  ]
}