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        "molfile": "\n  Marvin  01132109232D          \n\n 37 38  0  0  0  0            999 V2000\n    4.6712   -9.8266    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n    3.7044   -5.1213    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n    6.1193    1.0176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8304    1.4359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5517    1.0257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5517    0.2020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8450   -0.2163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.1193    0.1893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8450   -1.0400    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5737   -1.4456    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5737   -2.2693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2997   -2.6794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2997   -3.5032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5885   -3.9215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8626   -3.5113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8626   -2.6876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5885   -4.7452    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8873   -5.1635    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8873   -5.9872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.6060   -6.3928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.6060   -7.2165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.9021   -7.6348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.1807   -7.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.1807   -6.4055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.4548   -6.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.7584   -6.4182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.7584   -7.2420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.4769   -7.6475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.0472   -7.6603    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n    4.4654   -8.3715    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6289   -6.9490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.3359   -8.0785    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    5.4548   -5.1762    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n    6.2787   -5.1762    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.6311   -5.1762    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.4548   -4.3479    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    8.3171   -5.9745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  4  3  2  0  0  0  0\n  5  4  1  0  0  0  0\n  6  5  2  0  0  0  0\n  7  6  1  0  0  0  0\n  8  7  2  0  0  0  0\n  3  8  1  0  0  0  0\n  7  9  1  0  0  0  0\n  9 10  2  0  0  0  0\n 10 11  1  0  0  0  0\n 12 11  2  0  0  0  0\n 13 12  1  0  0  0  0\n 14 13  2  0  0  0  0\n 15 14  1  0  0  0  0\n 16 15  2  0  0  0  0\n 11 16  1  0  0  0  0\n 14 17  1  0  0  0  0\n 17 18  2  0  0  0  0\n 18 19  1  0  0  0  0\n 20 19  2  0  0  0  0\n 21 20  1  0  0  0  0\n 22 21  2  0  0  0  0\n 23 22  1  0  0  0  0\n 24 23  2  0  0  0  0\n 19 24  1  0  0  0  0\n 24 25  1  0  0  0  0\n 25 26  2  0  0  0  0\n 26 27  1  0  0  0  0\n 27 28  2  0  0  0  0\n 23 28  1  0  0  0  0\n 27 29  1  0  0  0  0\n 29 30  2  0  0  0  0\n 29 31  2  0  0  0  0\n 29 32  1  0  0  0  0\n 25 33  1  0  0  0  0\n 33 34  2  0  0  0  0\n 33 35  2  0  0  0  0\n 33 36  1  0  0  0  0\n 20 37  1  0  0  0  0\nM  CHG  4   1   1   2   1  32  -1  36  -1\nM  END",
        "smiles": "c1ccc(cc1)/N=N/c2ccc(cc2)/N=N/c3c(ccc4cc(cc(c43)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]",
        "formula": "C22H14N4O7S2.2Na",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 2,
        "molecular_weight": "556.4817",
        "optical_activity": "NONE",
        "references": [
          "3479a431-4e00-4027-9902-a89f6856d7b6",
          "15e05805-cf27-45f9-8de0-2c9c486e1266"
        ],
        "stereo_centers": 0
      },
      "unii": "5PLA82FV3C"
    }
  ]
}