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        "molfile": "\n  Marvin  01132100292D          \n\n 15 15  0  0  0  0            999 V2000\n   10.1122   -4.9081    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n    8.6108   -4.4145    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n    7.8009   -4.2757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.3279   -4.8927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4872   -4.7204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.0012   -5.3555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1246   -5.1858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.8983   -4.4582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.3945   -3.7975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.2121   -3.9440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.6440   -3.3629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5284   -3.4941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.3795   -4.6921    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    8.3871   -5.1858    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    8.9579   -3.6946    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  3  1  0  0  0  0\n  5  4  2  0  0  0  0\n  6  5  1  0  0  0  0\n  7  6  2  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  5  1  0  0  0  0\n 10 11  2  0  0  0  0\n 12  3  2  0  0  0  0\n 11 12  1  0  0  0  0\n 13  2  1  0  0  0  0\n 14  2  2  0  0  0  0\n 15  2  2  0  0  0  0\nM  CHG  2   1   1  13  -1\nM  END",
        "smiles": "c1ccc2cc(ccc2c1)S(=O)(=O)[O-].[Na+]",
        "formula": "C10H7O3S.Na",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "230.217",
        "optical_activity": "NONE",
        "references": [
          "03da217b-8366-46f9-87a8-759566d35746",
          "473736a7-8a43-43fe-b4a9-3b3d5247a9f6"
        ],
        "stereo_centers": 0
      },
      "unii": "R5F0CTD2OJ"
    }
  ]
}