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        "molfile": "\n   JSDraw202032518182D\n\n 29 29  0  0  0  0              0 V2000\n   25.2711   -9.6450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   23.9719  -10.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   22.6207   -9.6450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   22.6207   -8.0858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   23.9719   -7.3062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   25.2711   -8.0858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   26.6225   -7.3062    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0\n   23.9719   -5.7472    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   22.6207   -4.9676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   22.6207   -3.4083    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   21.2695   -5.7472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   21.2695   -7.3062    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0\n   21.2695  -10.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   21.2695  -11.9837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   19.9182   -9.6450    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   18.5668  -10.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.2156   -9.6450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.8644  -10.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.5131   -9.6450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   17.2156   -8.0858    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   23.9719  -11.9837    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0\n   26.6225  -10.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   26.6225  -11.9837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   27.9738   -9.6450    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   29.3250  -10.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   30.6764   -9.6450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   32.0276  -10.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   33.3789   -9.6450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   30.6764   -8.0858    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  1  0  0  0  0\n  2  3  2  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  1  6  2  0  0  0  0\n  6  7  1  0  0  0  0\n  5  8  1  0  0  0  0\n  8  9  1  0  0  0  0\n  9 10  2  0  0  0  0\n  9 11  1  0  0  0  0\n  4 12  1  0  0  0  0\n  3 13  1  0  0  0  0\n 13 14  2  0  0  0  0\n 13 15  1  0  0  0  0\n 15 16  1  0  0  0  0\n 16 17  1  0  0  0  0\n 17 18  1  0  0  0  0\n 18 19  1  0  0  0  0\n 17 20  1  0  0  0  0\n  2 21  1  0  0  0  0\n  1 22  1  0  0  0  0\n 22 23  2  0  0  0  0\n 22 24  1  0  0  0  0\n 24 25  1  0  0  0  0\n 25 26  1  0  0  0  0\n 26 27  1  0  0  0  0\n 27 28  1  0  0  0  0\n 26 29  1  0  0  0  0\nM  END",
        "smiles": "CC(=O)Nc1c(c(c(c(c1I)C(=O)NCC(CO)O)I)C(=O)NCC(CO)O)I",
        "formula": "C16H20I3N3O7",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "MIXED",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "747.06",
        "optical_activity": "UNSPECIFIED",
        "references": [
          "2f3fa3b0-e17a-488c-ba53-8c48e80ff7d0",
          "8e361213-af9a-47df-93ed-b180e591f953"
        ],
        "stereo_centers": 2
      },
      "unii": "BK2UH2P436"
    }
  ]
}