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        "molfile": "\n  Marvin  01132102112D          \n\n 37 36  0  0  1  0            999 V2000\n    2.1455   -7.7922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.8996   -7.4108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   24.4988  -12.5026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6357   -7.7658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   23.7448  -12.1211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3452   -7.3933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   23.6205  -11.2694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1082   -7.7658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   22.9111  -10.9414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8357   -7.3933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   22.7690  -10.0631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5542   -7.7658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   22.6538   -8.4045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   22.0329   -9.7084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.2814   -7.3933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   21.9440   -8.9277    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n    8.0176   -7.7658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   21.2079   -8.5284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.7538   -7.3933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   21.1369   -7.7213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4900   -7.7480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   20.4006   -7.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.1997   -7.3665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   19.6645   -7.7213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.9538   -7.7480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   18.9549   -7.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.6635   -7.3665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   18.2010   -7.7213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.3996   -7.7480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.4645   -7.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.1359   -7.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   16.7550   -7.7213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.5728   -6.5150    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   13.8631   -7.7480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   16.0188   -7.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.5728   -7.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.2913   -7.7213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  1  0  0  0  0\n  4  2  1  0  0  0  0\n  5  3  1  0  0  0  0\n  6  4  1  0  0  0  0\n  7  5  1  0  0  0  0\n  8  6  1  0  0  0  0\n  9  7  1  0  0  0  0\n 10  8  1  0  0  0  0\n 11  9  1  0  0  0  0\n 12 10  1  0  0  0  0\n 14 11  1  0  0  0  0\n 15 12  1  0  0  0  0\n 16 13  1  6  0  0  0\n 16 14  1  0  0  0  0\n 17 15  1  0  0  0  0\n 18 16  1  0  0  0  0\n 19 17  1  0  0  0  0\n 20 18  1  0  0  0  0\n 21 19  1  0  0  0  0\n 22 20  2  0  0  0  0\n 23 21  1  0  0  0  0\n 24 22  1  0  0  0  0\n 25 23  1  0  0  0  0\n 26 24  1  0  0  0  0\n 27 25  1  0  0  0  0\n 28 26  1  0  0  0  0\n 29 27  1  0  0  0  0\n 30 28  1  0  0  0  0\n 31 29  1  0  0  0  0\n 32 30  1  0  0  0  0\n 34 31  1  0  0  0  0\n 35 32  1  0  0  0  0\n 36 33  2  0  0  0  0\n 36 34  1  0  0  0  0\n 37 35  1  0  0  0  0\n 37 36  1  0  0  0  0\nM  END",
        "smiles": "CCCCCCCCCCCCCCCCOC(=O)CCCCCCC/C=C\\C[C@@H](CCCCCC)O",
        "formula": "C34H66O3",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ABSOLUTE",
        "defined_stereo": 1,
        "ez_centers": 1,
        "molecular_weight": "522.8873",
        "optical_activity": "UNSPECIFIED",
        "references": [
          "c7d24f23-0544-4709-b296-006870e22b6c",
          "c93a5724-cdfc-4752-9ec5-e26570881c59"
        ],
        "stereo_centers": 1
      },
      "unii": "1P677500YD"
    }
  ]
}