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        "molfile": "\n  Marvin  01132108082D          \n\n 31 32  0  0  0  0            999 V2000\n    4.9850   -1.4409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.5666   -0.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.7416   -0.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.3234   -1.4409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.7416   -2.1613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.5666   -2.1613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.3234   -2.8701    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0\n    3.3234    0.0000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0\n    2.4983   -1.4409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.0684   -2.1613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.2434   -2.1613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.8366   -2.8701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.8366   -1.4409    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0\n    0.0000   -2.8701    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0\n    6.6466   -1.4409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0534   -2.1613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.8784   -2.1613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2967   -1.4409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.8784   -0.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0534   -0.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2967    0.0000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0\n    8.3083   -2.8701    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0\n    9.1217   -1.4409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    9.5516   -0.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.3766   -0.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.7834    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.7834   -1.4409    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0\n   11.6200    0.0000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0\n    5.8100   -1.4409    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8100   -2.2659    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8100   -0.6159    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  2  0  0  0  0\n  1  6  1  0  0  0  0\n  1 29  1  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  2  0  0  0  0\n  3  8  1  0  0  0  0\n  4  5  1  0  0  0  0\n  4  9  1  0  0  0  0\n  5  6  2  0  0  0  0\n  5  7  1  0  0  0  0\n  9 10  1  0  0  0  0\n 10 11  1  0  0  0  0\n 11 12  1  0  0  0  0\n 11 13  1  0  0  0  0\n 12 14  1  0  0  0  0\n 15 16  2  0  0  0  0\n 15 20  1  0  0  0  0\n 15 29  1  0  0  0  0\n 16 17  1  0  0  0  0\n 17 18  2  0  0  0  0\n 17 22  1  0  0  0  0\n 18 19  1  0  0  0  0\n 18 23  1  0  0  0  0\n 19 20  2  0  0  0  0\n 19 21  1  0  0  0  0\n 23 24  1  0  0  0  0\n 24 25  1  0  0  0  0\n 25 26  1  0  0  0  0\n 25 27  1  0  0  0  0\n 26 28  1  0  0  0  0\n 29 30  2  0  0  0  0\n 29 31  2  0  0  0  0\nM  END",
        "smiles": "c1c(cc(c(c1Br)OCC(CBr)Br)Br)S(=O)(=O)c2cc(c(c(c2)Br)OCC(CBr)Br)Br",
        "formula": "C18H14Br8O4S",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "MIXED",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "965.5963",
        "optical_activity": "UNSPECIFIED",
        "references": [
          "6173aa2a-a4a9-4ca8-a4c5-61247a38f0e4",
          "02202492-5741-4fc0-8a1e-7f85c3c7169c"
        ],
        "stereo_centers": 2
      },
      "unii": "00U7T33ZVU"
    }
  ]
}