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        "id": "5b999741-a61f-4691-ab96-4ac0c58f9edd",
        "molfile": "\n  Marvin  01132104452D          \n\n 19 19  0  0  0  0            999 V2000\n   13.8839   -4.9681    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0\n   11.0469   -5.0268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.2221   -5.0268    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    9.8080   -4.3124    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    8.9831   -4.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.5690   -5.0303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7440   -5.0303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.3334   -4.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5050   -4.3124    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    6.0944   -3.5979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.0944   -5.0268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7406   -3.5979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.5655   -3.5979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.5266   -4.3572    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   12.3136   -4.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.3136   -5.4376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.5302   -5.6929    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0\n   11.2747   -6.4763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.2678   -3.5738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  2  0  0  0  0\n  4  5  1  0  0  0  0\n  5  6  2  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  9 10  1  0  0  0  0\n  9 11  1  0  0  0  0\n 12  8  1  0  0  0  0\n  5 13  1  0  0  0  0\n 13 12  2  0  0  0  0\n  2 14  1  0  0  0  0\n 14 15  1  0  0  0  0\n 15 16  2  0  0  0  0\n  2 17  2  0  0  0  0\n 17 16  1  0  0  0  0\n 17 18  1  0  0  0  0\n 14 19  1  0  0  0  0\nM  CHG  2   1  -1  17   1\nM  END",
        "smiles": "CN(C)c1ccc(cc1)/N=N/c2[n+](C)ccn2C.[Cl-]",
        "formula": "C13H18N5.Cl",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 1,
        "molecular_weight": "279.769",
        "optical_activity": "NONE",
        "references": [
          "6f73a239-fa92-47f5-85ef-981db692bb0d",
          "8f889be8-3148-4e5a-8f00-16a361dfb7ef"
        ],
        "stereo_centers": 0
      },
      "unii": "A7A946JJ6I"
    }
  ]
}