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        "molfile": "\n  Marvin  01132107152D          \n\n 27 26  0  0  1  0            999 V2000\n    8.5838   -5.3472    0.0000 Mg  0  2  0  0  0  0  0  0  0  0  0  0\n    1.7775   -6.4663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.3140   -7.1747    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.6071   -6.4663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.1161   -7.1191    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    2.8431   -5.6736    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    3.4313   -6.2485    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6209   -5.3984    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    3.6209   -4.5007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2598   -5.8163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9512   -5.4441    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1550   -5.2102    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    1.5069   -5.7141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7097   -5.4780    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    1.7775   -6.4663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.3140   -7.1747    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.6071   -6.4663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.1161   -7.1191    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    2.8431   -5.6736    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    3.4313   -6.2485    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6209   -5.3984    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n    3.6209   -4.5007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2598   -5.8163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9512   -5.4441    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1550   -5.2102    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    1.5069   -5.7141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7097   -5.4780    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  3  2  1  0  0  0  0\n  4  2  2  0  0  0  0\n  5  4  1  0  0  0  0\n  6  4  1  0  0  0  0\n  6  7  1  1  0  0  0\n  8  6  1  0  0  0  0\n  8  9  1  1  0  0  0\n 10  8  1  0  0  0  0\n 11 10  1  0  0  0  0\n  6 12  1  0  0  0  0\n 12 13  1  0  0  0  0\n 13  2  1  0  0  0  0\n 14 13  2  0  0  0  0\n 16 15  1  0  0  0  0\n 17 15  2  0  0  0  0\n 26 15  1  0  0  0  0\n 18 17  1  0  0  0  0\n 19 17  1  0  0  0  0\n 19 20  1  1  0  0  0\n 21 19  1  0  0  0  0\n 19 25  1  0  0  0  0\n 21 22  1  1  0  0  0\n 23 21  1  0  0  0  0\n 24 23  1  0  0  0  0\n 25 26  1  0  0  0  0\n 27 26  2  0  0  0  0\nM  CHG  3   1   2   5  -1  18  -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 11  17  18  19  20  21  22  23  24  25  26  27\nM  SPA   1 13   2   3   4   5   6   7   8   9  10  11  12  13  14\nM  SDI   1  4    0.2897   -7.5947    0.2897   -4.0807\nM  SDI   1  4    5.3712   -4.0807    5.3712   -7.5947\nM  SMT   1 2\nM  END",
        "smiles": "C([C@@H]([C@]1([H])C(=C(C(=O)O1)O)[O-])O)O.C([C@@H]([C@]1([H])C(=C(C(=O)O1)O)[O-])O)O.[Mg+2]",
        "formula": "2C6H7O6.Mg",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ABSOLUTE",
        "defined_stereo": 4,
        "ez_centers": 0,
        "molecular_weight": "374.5379",
        "optical_activity": "UNSPECIFIED",
        "references": [
          "e2ce288b-a30f-4bb0-ad24-e672504c0a19",
          "07c9365a-0fac-438d-b043-aa01cd50c927"
        ],
        "stereo_centers": 4
      },
      "unii": "0N1G678593"
    }
  ]
}