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        "molfile": "\n  Marvin  01132107362D          \n\n 42 50  0  0  0  0            999 V2000\n   -2.4538   -3.4338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.4485   -2.6165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.7535   -2.2143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.0490   -2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.0496   -3.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.7535   -3.8402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.3370   -3.8402    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.3370   -4.6494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.0413   -5.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.3718   -3.4298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.3718   -2.6130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.0716   -2.1979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.7844   -2.6048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.7844   -3.4298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.0756   -3.8360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.4964   -3.8402    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.2132   -3.4256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.2091   -2.6006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.4882   -2.1902    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    3.9211   -2.1821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.9172   -1.3689    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n    4.6422   -2.5967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.6381   -3.4256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.9253   -3.8360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.9253   -4.6494    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n    5.3544   -3.8402    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    6.0705   -3.4256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.0705   -2.5967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.3544   -2.1780    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    6.7873   -2.1861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.4994   -2.5967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2157   -2.1739    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    8.9400   -2.6006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.6609   -2.1821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.3813   -2.5967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.3813   -3.4338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.6609   -3.8525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.9407   -3.4338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.4994   -3.4338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.7873   -3.8402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2157   -1.3647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.9161   -0.9585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  2  0  0  0  0\n  3  2  1  0  0  0  0\n  4  3  2  0  0  0  0\n  4  5  1  0  0  0  0\n  5  6  2  0  0  0  0\n  6  1  1  0  0  0  0\n  7  5  1  0  0  0  0\n  7  8  1  0  0  0  0\n  8  9  1  0  0  0  0\n 10  7  1  0  0  0  0\n 10 11  2  0  0  0  0\n 11  4  1  0  0  0  0\n 12 11  1  0  0  0  0\n 13 12  2  0  0  0  0\n 14 13  1  0  0  0  0\n 14 15  2  0  0  0  0\n 15 10  1  0  0  0  0\n 16 14  1  0  0  0  0\n 17 16  1  0  0  0  0\n 17 18  1  0  0  0  0\n 18 19  2  0  0  0  0\n 19 13  1  0  0  0  0\n 20 18  1  0  0  0  0\n 20 21  1  0  0  0  0\n 22 20  2  0  0  0  0\n 23 22  1  0  0  0  0\n 23 24  1  0  0  0  0\n 24 25  1  0  0  0  0\n 24 17  2  0  0  0  0\n 26 23  2  0  0  0  0\n 27 26  1  0  0  0  0\n 27 28  2  0  0  0  0\n 28 29  1  0  0  0  0\n 29 22  1  0  0  0  0\n 30 28  1  0  0  0  0\n 31 30  2  0  0  0  0\n 31 32  1  0  0  0  0\n 32 33  1  0  0  0  0\n 33 34  1  0  0  0  0\n 34 35  2  0  0  0  0\n 36 35  1  0  0  0  0\n 37 36  2  0  0  0  0\n 38 37  1  0  0  0  0\n 38 33  2  0  0  0  0\n 39 38  1  0  0  0  0\n 39 40  2  0  0  0  0\n 40 27  1  0  0  0  0\n 39 31  1  0  0  0  0\n 32 41  1  0  0  0  0\n 41 42  1  0  0  0  0\nM  END",
        "smiles": "CCn1c2ccccc2c3cc4c(cc31)Oc5c(c6=Nc7cc8c9ccccc9n(CC)c8cc7Oc6c(c5=N4)Cl)Cl",
        "formula": "C34H22Cl2N4O2",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "589.4712",
        "optical_activity": "NONE",
        "references": [
          "bd3ee250-fabc-4557-9165-bb56b4a678ce",
          "3f7ddbee-e044-4ccd-8150-5cecd558e985"
        ],
        "stereo_centers": 0
      },
      "unii": "8U8Z6628KF"
    }
  ]
}