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          "molfile": "\n  Marvin  01132101302D          \n\n 22 24  0  0  1  0            999 V2000\n    7.2616   -5.5620    0.0000 C   0  0  2  0  0  0  0  0  0  2  0  0\n    7.2616   -6.3724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5402   -6.7892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5402   -7.4029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8329   -6.3724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1068   -6.7892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1068   -7.6840    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3949   -6.3724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3949   -5.5620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6828   -5.1029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1068   -5.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8329   -5.5620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5402   -5.1451    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9737   -5.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.6855   -5.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4164   -5.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4164   -4.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.2314   -3.7446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   10.2314   -2.7421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.7137   -3.9179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.7137   -3.0887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9737   -4.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  1  0  0  0  0\n  1 13  1  6  0  0  0\n  1 14  1  0  0  0  0\n  2  3  1  0  0  0  0\n  4  3  2  0  0  0  0\n  3  5  1  0  0  0  0\n  6  5  1  0  0  0  0\n 12  5  2  0  0  0  0\n  7  6  1  0  0  0  0\n  8  6  2  0  0  0  0\n  9  8  1  0  0  0  0\n 10  9  1  0  0  0  0\n 11  9  2  0  0  0  0\n 11 12  1  0  0  0  0\n 13 12  1  0  0  0  0\n 15 14  1  0  0  0  0\n 22 14  2  0  0  0  0\n 16 15  2  0  0  0  0\n 17 16  1  0  0  0  0\n 18 17  1  0  0  0  0\n 20 17  2  0  0  0  0\n 19 18  1  0  0  0  0\n 21 20  1  0  0  0  0\n 20 22  1  0  0  0  0\nM  END",
          "smiles": "COc1ccc(cc1O)[C@@H]2CC(=O)c3c(cc(cc3O2)O)O",
          "formula": "C16H14O6",
          "atropisomerism": "No",
          "charge": 0,
          "count": 1,
          "stereochemistry": "ABSOLUTE",
          "count_amount": {
            "type": "MOL RATIO",
            "average": 1,
            "units": "MOL RATIO",
            "uuid": "65440f33-757d-451c-a4a0-5711496ffe70"
          },
          "defined_stereo": 1,
          "ez_centers": 0,
          "molecular_weight": "302.2794",
          "optical_activity": "UNSPECIFIED",
          "stereo_centers": 1
        }
      ],
      "definition_level": "COMPLETE",
      "uuid": "7e21aa97-43f6-46ea-bc07-f19dc0265471",
      "version": "9",
      "structure": {
        "id": "cac80cad-04cd-4c18-be23-a904598ffdc1",
        "molfile": "\n  Marvin  01132110282D          \n\n 22 24  0  0  1  0            999 V2000\n    5.8329   -6.3724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5402   -6.7892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.2616   -6.3724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.2616   -5.5620    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n    6.5402   -5.1451    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8329   -5.5620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1068   -5.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3949   -5.5620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3949   -6.3724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1068   -6.7892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1068   -7.6840    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6828   -5.1029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9737   -5.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9737   -4.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.7137   -3.9179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.7137   -3.0887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4164   -4.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4164   -5.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.6855   -5.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.2314   -3.7446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   10.2314   -2.7421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5402   -7.4029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  1  0  0  0  0\n  3  2  1  0  0  0  0\n  3  4  1  0  0  0  0\n  4  5  1  0  0  0  0\n  5  6  1  0  0  0  0\n  6  1  2  0  0  0  0\n  7  6  1  0  0  0  0\n  7  8  2  0  0  0  0\n  8  9  1  0  0  0  0\n  9 10  2  0  0  0  0\n 10  1  1  0  0  0  0\n 11 10  1  0  0  0  0\n 12  8  1  0  0  0  0\n  4 13  1  6  0  0  0\n 14 13  2  0  0  0  0\n 15 14  1  0  0  0  0\n 16 15  1  0  0  0  0\n 15 17  2  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 17  1  0  0  0  0\n 21 20  1  0  0  0  0\n 22  2  2  0  0  0  0\nM  END",
        "smiles": "COc1ccc(cc1O)[C@@H]2CC(=O)c3c(cc(cc3O2)O)O",
        "formula": "C16H14O6",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ABSOLUTE",
        "defined_stereo": 1,
        "ez_centers": 0,
        "molecular_weight": "302.2794",
        "optical_activity": "UNSPECIFIED",
        "references": [
          "8da45c75-5564-4880-9435-80860936ecd5",
          "094b3cad-0657-45aa-a6fb-73e216f3681b"
        ],
        "stereo_centers": 1
      },
      "unii": "Q9Q3D557F1"
    }
  ]
}