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      "structure": {
        "id": "7f41d6be-2e3d-45a1-88ec-a24324fc245d",
        "molfile": "\n  Marvin  01132106372D          \n\n 31 28  0  0  1  0            999 V2000\n    7.0465   -1.0312    0.0000 Mg  0  2  0  0  0  0  0  0  0  0  0  0\n   -0.5898   -1.4383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.1252   -1.8461    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    0.1160   -2.6711    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    0.8401   -1.4337    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    0.8310   -0.6087    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    1.5505   -1.8370    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n    1.5413   -2.6665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2654   -1.4245    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    2.2563   -0.5996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.9804   -1.8370    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    2.9712   -2.6665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6908   -1.4245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6817   -0.5996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.4058   -1.8324    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   -1.3001   -1.8507    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.5898   -1.4383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.1252   -1.8461    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    0.1160   -2.6711    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    0.8401   -1.4337    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    0.8310   -0.6087    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    1.5505   -1.8370    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n    1.5413   -2.6665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2654   -1.4245    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    2.2563   -0.5996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.9804   -1.8370    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    2.9712   -2.6665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6908   -1.4245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6817   -0.5996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.4058   -1.8324    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   -1.3001   -1.8507    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  1  6  0  0  0\n  3  5  1  0  0  0  0\n  5  6  1  1  0  0  0\n  5  7  1  0  0  0  0\n  7  8  1  1  0  0  0\n  7  9  1  0  0  0  0\n  9 10  1  1  0  0  0\n 11  9  1  0  0  0  0\n 11 12  1  6  0  0  0\n 13 11  1  0  0  0  0\n 14 13  2  0  0  0  0\n 15 13  1  0  0  0  0\n 16  2  1  0  0  0  0\n 17 18  1  0  0  0  0\n 31 17  1  0  0  0  0\n 18 19  1  6  0  0  0\n 18 20  1  0  0  0  0\n 20 21  1  1  0  0  0\n 20 22  1  0  0  0  0\n 22 23  1  1  0  0  0\n 22 24  1  0  0  0  0\n 24 25  1  1  0  0  0\n 26 24  1  0  0  0  0\n 26 27  1  6  0  0  0\n 28 26  1  0  0  0  0\n 29 28  2  0  0  0  0\n 30 28  1  0  0  0  0\nM  CHG  3   1   2  15  -1  30  -1\nM  STY  1   1 MUL\nM  SCN  1   1 HT \nM  SAL   1 15   2   3   4   5   6   7   8   9  10  11  12  13  14  15  16\nM  SAL   1 15  17  18  19  20  21  22  23  24  25  26  27  28  29  30  31\nM  SPA   1 15   2   3   4   5   6   7   8   9  10  11  12  13  14  15  16\nM  SDI   1  4   -1.7201   -3.0911   -1.7201   -0.1796\nM  SDI   1  4    4.8258   -0.1796    4.8258   -3.0911\nM  SMT   1 2\nM  END",
        "smiles": "C([C@H]([C@H]([C@@H]([C@H]([C@H](C(=O)[O-])O)O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H]([C@H](C(=O)[O-])O)O)O)O)O)O.[Mg+2]",
        "formula": "2C7H13O8.Mg",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ABSOLUTE",
        "defined_stereo": 10,
        "ez_centers": 0,
        "molecular_weight": "474.6523",
        "optical_activity": "UNSPECIFIED",
        "references": [
          "709e5f08-f0b4-49b6-9959-85f68f4a9406",
          "8991f99b-4d7d-4ad5-a49e-254a0b5164f8"
        ],
        "stereo_centers": 10
      },
      "unii": "NR47LC4280"
    }
  ]
}