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        "molfile": "\n  Marvin  01132107272D          \n\n 41 42  0  0  0  0            999 V2000\n    7.4200   -5.7836    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n    8.6257   -5.8636    0.0000 Fe  0  2  0  0  0  0  0  0  0  0  0  0\n    5.5072   -6.6836    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    4.6822   -6.6836    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2697   -5.9692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.4447   -5.9692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.0322   -6.6836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2072   -6.6836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.7947   -5.9692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2072   -5.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.0322   -5.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.4447   -4.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2697   -4.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.6822   -5.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.5072   -5.2547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.5072   -6.6836    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    4.6822   -6.6836    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2697   -5.9692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.4447   -5.9692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.0322   -6.6836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2072   -6.6836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.7947   -5.9692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2072   -5.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.0322   -5.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.4447   -4.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2697   -4.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.6822   -5.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.5072   -5.2547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.5072   -6.6836    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    4.6822   -6.6836    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2697   -5.9692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.4447   -5.9692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.0322   -6.6836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2072   -6.6836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.7947   -5.9692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2072   -5.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.0322   -5.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.4447   -4.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2697   -4.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.6822   -5.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.5072   -5.2547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  3  4  1  0  0  0  0\n  4  5  2  0  0  0  0\n  5  6  1  0  0  0  0\n  6  7  1  0  0  0  0\n  7  8  2  0  0  0  0\n  8  9  1  0  0  0  0\n 10  9  2  0  0  0  0\n  6 11  2  0  0  0  0\n 11 10  1  0  0  0  0\n 12 11  1  0  0  0  0\n 13 12  2  0  0  0  0\n 14  5  1  0  0  0  0\n 14 13  1  0  0  0  0\n 15 14  2  0  0  0  0\n 29 30  1  0  0  0  0\n 30 31  2  0  0  0  0\n 31 32  1  0  0  0  0\n 40 31  1  0  0  0  0\n 32 33  1  0  0  0  0\n 32 37  2  0  0  0  0\n 33 34  2  0  0  0  0\n 34 35  1  0  0  0  0\n 36 35  2  0  0  0  0\n 37 36  1  0  0  0  0\n 38 37  1  0  0  0  0\n 39 38  2  0  0  0  0\n 40 39  1  0  0  0  0\n 41 40  2  0  0  0  0\n 16 17  1  0  0  0  0\n 17 18  2  0  0  0  0\n 18 19  1  0  0  0  0\n 27 18  1  0  0  0  0\n 19 20  1  0  0  0  0\n 19 24  2  0  0  0  0\n 20 21  2  0  0  0  0\n 21 22  1  0  0  0  0\n 23 22  2  0  0  0  0\n 24 23  1  0  0  0  0\n 25 24  1  0  0  0  0\n 26 25  2  0  0  0  0\n 27 26  1  0  0  0  0\n 28 27  2  0  0  0  0\nM  CHG  5   1   1   2   2   3  -1  16  -1  29  -1\nM  STY  1   1 MUL\nM  SCN  1   1 HT \nM  SAL   1 15   3   4   5   6   7   8   9  10  11  12  13  14  15  16  17\nM  SAL   1 15  18  19  20  21  22  23  24  25  26  27  28  29  30  31  32\nM  SAL   1  9  33  34  35  36  37  38  39  40  41\nM  SPA   1 13   3   4   5   6   7   8   9  10  11  12  13  14  15\nM  SDI   1  4    1.3747   -7.1036    1.3747   -4.1203\nM  SDI   1  4    5.9272   -4.1203    5.9272   -7.1036\nM  SMT   1 3\nM  END",
        "smiles": "c1ccc/2c(c1)C=CC(=O)\\C2=N/[O-].c1ccc/2c(c1)C=CC(=O)\\C2=N/[O-].c1ccc/2c(c1)C=CC(=O)\\C2=N/[O-].[Fe+2].[Na+]",
        "formula": "3C10H6NO2.Fe.Na",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 3,
        "molecular_weight": "595.3165",
        "optical_activity": "NONE",
        "references": [
          "15d2a09a-0bef-4308-96c3-957e16b8e55e",
          "555626dc-1871-48da-9701-8e87bf33c788"
        ],
        "stereo_centers": 0
      },
      "unii": "200BKZ0W4W"
    }
  ]
}