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        "molfile": "\n  Marvin  01132109222D          \n\n 16 15  0  0  0  0            999 V2000\n    5.4198   -5.2819    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    6.1343   -4.8694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8488   -5.2819    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5632   -4.8694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2777   -5.2819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.9922   -4.8694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.9922   -4.0444    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n    9.7066   -5.2819    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n    8.2777   -6.1069    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n    6.1343   -4.0444    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.7054   -4.8694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.9909   -5.2819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.7054   -4.0444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.4198   -6.1069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.7054   -6.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.1343   -6.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  1  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  1  0  0  0  0\n  4  5  1  0  0  0  0\n  5  6  2  0  0  0  0\n  6  7  1  0  0  0  0\n  6  8  1  0  0  0  0\n  5  9  1  0  0  0  0\n  2 10  2  0  0  0  0\n  1 11  1  0  0  0  0\n 11 12  1  0  0  0  0\n 11 13  1  0  0  0  0\n  1 14  1  0  0  0  0\n 14 15  1  0  0  0  0\n 14 16  1  0  0  0  0\nM  END",
        "smiles": "CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl",
        "formula": "C10H16Cl3NOS",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "304.6654",
        "optical_activity": "NONE",
        "references": [
          "e0b4038f-577c-4afd-bd76-69771d94c3b0",
          "4630ae27-7d4d-461a-82aa-0484f1bb8ab1"
        ],
        "stereo_centers": 0
      },
      "unii": "A9S097HS99"
    }
  ]
}