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        "molfile": "\n  Marvin  01132107042D          \n\n 16 12  0  0  0  0            999 V2000\n    7.6243   -3.3835    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    8.0378   -2.6696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.8796   -2.6696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.2860   -1.9533    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    9.2860   -3.3835    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    8.0520   -4.0936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.6510   -4.8099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.0520   -5.5221    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8063   -4.8099    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    6.7837   -3.3835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3702   -2.6696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.5250   -2.6696    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    6.7837   -1.9533    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    2.0948   -2.9326    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n    2.0948   -2.9326    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n    2.0948   -2.9326    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n  3  4  2  0  0  0  0\n  3  5  1  0  0  0  0\n  1  6  1  0  0  0  0\n  6  7  1  0  0  0  0\n  7  8  2  0  0  0  0\n  7  9  1  0  0  0  0\n  1 10  1  0  0  0  0\n 10 11  1  0  0  0  0\n 11 12  2  0  0  0  0\n 11 13  1  0  0  0  0\n  1  2  1  0  0  0  0\n  2  3  1  0  0  0  0\nM  CHG  6   5  -1   9  -1  13  -1  14   1  15   1  16   1\nM  STY  1   1 MUL\nM  SCN  1   1 HT \nM  SAL   1  3  14  15  16\nM  SPA   1  1  14\nM  SDI   1  4    1.6748   -3.3526    1.6748   -2.5126\nM  SDI   1  4    2.5148   -2.5126    2.5148   -3.3526\nM  SMT   1 3\nM  END",
        "smiles": "C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+]",
        "formula": "C6H6NO6.3Na",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "257.0845",
        "optical_activity": "NONE",
        "references": [
          "8f7f87ab-a21f-4997-bfba-f114e2ad204e",
          "a44c0f54-b61a-49b0-8613-2b3406289124"
        ],
        "stereo_centers": 0
      },
      "unii": "E3C8R2M0XD"
    }
  ]
}