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        "molfile": "\n  Marvin  01132100482D          \n\n 46 53  0  0  0  0            999 V2000\n    4.3666   -5.0276    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3666   -4.2025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.0832   -3.7862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.0832   -2.9668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3655   -2.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3655   -1.7290    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6522   -2.9611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.9372   -2.5505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2233   -2.9639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2233   -3.7930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.9383   -4.1988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6522   -3.7900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7965   -2.5505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5109   -2.9630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5109   -3.7920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7976   -4.1988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7976   -5.0238    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5095   -5.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5095   -6.2667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.2233   -6.6760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9406   -6.2659    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9406   -5.4464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.6633   -5.0341    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    8.6633   -4.2089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.3832   -3.7982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.3832   -2.9789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.1018   -2.5682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.1018   -1.7431    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   10.8175   -2.9819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.8175   -3.8100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.5188   -4.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.2357   -3.8171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.2357   -2.9870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.5269   -2.5743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.0943   -4.2165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.0943   -5.0417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    8.6708   -2.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9564   -2.9663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9564   -3.7952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.2253   -5.0276    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.2233   -7.5012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5045   -7.9156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5045   -8.7350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.2190   -9.1494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9312   -8.7446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9312   -7.9156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  2  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  1  0  0  0  0\n  4  5  1  0  0  0  0\n  5  6  2  0  0  0  0\n  5  7  1  0  0  0  0\n  7  8  1  0  0  0  0\n  8  9  2  0  0  0  0\n  9 10  1  0  0  0  0\n 10 11  2  0  0  0  0\n 11 12  1  0  0  0  0\n 12  2  1  0  0  0  0\n 12  7  2  0  0  0  0\n  4 13  2  0  0  0  0\n 13 14  1  0  0  0  0\n 14 15  2  0  0  0  0\n 15 16  1  0  0  0  0\n 16  3  2  0  0  0  0\n 16 17  1  0  0  0  0\n 17 18  1  0  0  0  0\n 18 19  1  0  0  0  0\n 19 20  2  0  0  0  0\n 20 21  1  0  0  0  0\n 21 22  2  0  0  0  0\n 22 23  1  0  0  0  0\n 23 24  1  0  0  0  0\n 24 25  1  0  0  0  0\n 25 26  2  0  0  0  0\n 26 27  1  0  0  0  0\n 27 28  2  0  0  0  0\n 27 29  1  0  0  0  0\n 29 30  1  0  0  0  0\n 30 31  2  0  0  0  0\n 31 32  1  0  0  0  0\n 32 33  2  0  0  0  0\n 33 34  1  0  0  0  0\n 34 29  2  0  0  0  0\n 30 35  1  0  0  0  0\n 35 25  1  0  0  0  0\n 35 36  2  0  0  0  0\n 26 37  1  0  0  0  0\n 37 38  2  0  0  0  0\n 38 39  1  0  0  0  0\n 39 24  2  0  0  0  0\n 22 40  1  0  0  0  0\n 40 18  2  0  0  0  0\n 20 41  1  0  0  0  0\n 41 42  1  0  0  0  0\n 42 43  2  0  0  0  0\n 43 44  1  0  0  0  0\n 44 45  2  0  0  0  0\n 45 46  1  0  0  0  0\n 46 41  2  0  0  0  0\nM  END",
        "smiles": "c1ccc(cc1)-c2nc(Nc3cccc4c3C(=O)c5ccccc5C4=O)nc(Nc6cccc7c6C(=O)c8ccccc8C7=O)n2",
        "formula": "C37H21N5O4",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "599.5951",
        "optical_activity": "NONE",
        "references": [
          "7ffae026-a033-407e-a19d-ececa0528214",
          "d55181d8-01fd-488e-ada3-21e21ba60551"
        ],
        "stereo_centers": 0
      },
      "unii": "LQ3G1P1NFN"
    }
  ]
}