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      "structure": {
        "id": "1996e5ae-fe60-4702-b361-6f50f450bc61",
        "molfile": "\n  Marvin  01132101312D          \n\n 32 33  0  0  0  0            999 V2000\n    1.5299    0.1130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.5299   -0.7105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.8241   -1.1369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.0852   -0.7441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.0852    0.0795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7836    0.5102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7836    1.3339    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n   -0.6395    0.4803    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n    2.2527   -1.1044    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    2.9590   -0.6791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.9590    0.1427    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6858   -1.0744    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3966   -0.6593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1115   -1.0803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8240   -0.6730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8240    0.1541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1211    0.5698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3966    0.1636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1211    1.3938    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n    5.1115   -1.9070    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.0958   -2.7309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3798   -3.1408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3798   -3.9689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.0947   -4.3812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8107   -3.9668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8107   -3.1491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.0947   -5.2051    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n    3.6656   -2.7280    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n    3.2525   -3.4420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.0786   -2.0136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.9513   -2.3149    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    1.0390   -3.4285    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n  1  2  2  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  2  0  0  0  0\n  4  5  1  0  0  0  0\n  5  6  2  0  0  0  0\n  6  1  1  0  0  0  0\n  6  7  1  0  0  0  0\n  5  8  1  0  0  0  0\n  9  2  1  0  0  0  0\n 10  9  1  0  0  0  0\n 10 11  2  0  0  0  0\n 12 10  1  0  0  0  0\n 12 13  1  0  0  0  0\n 13 14  2  0  0  0  0\n 14 15  1  0  0  0  0\n 15 16  2  0  0  0  0\n 16 17  1  0  0  0  0\n 17 18  2  0  0  0  0\n 18 13  1  0  0  0  0\n 17 19  1  0  0  0  0\n 20 14  1  0  0  0  0\n 21 20  1  0  0  0  0\n 21 22  2  0  0  0  0\n 22 23  1  0  0  0  0\n 23 24  2  0  0  0  0\n 24 25  1  0  0  0  0\n 25 26  2  0  0  0  0\n 26 21  1  0  0  0  0\n 24 27  1  0  0  0  0\n 28 22  1  0  0  0  0\n 28 29  2  0  0  0  0\n 28 30  2  0  0  0  0\n 31 28  1  0  0  0  0\nM  CHG  2  31  -1  32   1\nM  END",
        "smiles": "c1cc(c(cc1Cl)NC(=O)Nc2ccc(c(c2)Cl)Cl)Oc3ccc(cc3S(=O)(=O)[O-])Cl.[Na+]",
        "formula": "C19H11Cl4N2O5S.Na",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "544.1694",
        "optical_activity": "NONE",
        "references": [
          "8892407d-2708-4be9-97b7-0966574b5dfc",
          "0b72d938-c9a7-40fe-986b-bcf0e3530f1c"
        ],
        "stereo_centers": 0
      },
      "unii": "26R1Z8PQVH"
    }
  ]
}