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        "molfile": "\n  Marvin  01132106382D          \n\n 25 25  0  0  0  0            999 V2000\n    4.3627  -10.9932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.6354  -11.4039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.3483  -10.9932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.0859  -11.4039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3627  -12.6360    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.6354   -9.7508    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6498  -11.4039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.0801  -10.9932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.3483  -10.1641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.0859  -12.2175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6498  -12.2175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.0801  -10.1641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7988  -10.9932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.0612  -11.4039    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    1.5137  -10.9932    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n    2.2188  -11.4039    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n    4.3627  -10.1641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.6354  -12.2175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.9317  -10.9932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.8007  -11.4039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.6498   -9.7508    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    0.0801  -12.6360    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.0612   -9.7508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7988  -12.6360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8242  -10.9932    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n  2  8  1  0  0  0  0\n  3  2  2  0  0  0  0\n  4  1  2  0  0  0  0\n  5 11  1  0  0  0  0\n  6 12  1  0  0  0  0\n  7  1  1  0  0  0  0\n  8 20  1  0  0  0  0\n  9  6  2  0  0  0  0\n 10  4  1  0  0  0  0\n 11  7  2  0  0  0  0\n 12  8  2  0  0  0  0\n 13  4  1  0  0  0  0\n 14  3  1  0  0  0  0\n 15 16  1  0  0  0  0\n 16 19  1  0  0  0  0\n 17  1  1  0  0  0  0\n 18  2  1  0  0  0  0\n 19  7  1  0  0  0  0\n 20 15  1  0  0  0  0\n 21 17  1  0  0  0  0\n 22 18  1  0  0  0  0\n 23  9  1  0  0  0  0\n 24 10  1  0  0  0  0\n 10  5  2  0  0  0  0\n  9  3  1  0  0  0  0\nM  END",
        "smiles": "Cc1c(c(CO)c(cn1)CSSCc2cnc(C)c(c2CO)O)O.Cl",
        "formula": "C16H20N2O4S2.ClH",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "404.9347",
        "optical_activity": "NONE",
        "references": [
          "3a30b4e5-f468-4d62-8b34-32d7305b13ae",
          "cf70dc67-b0dc-4108-a04a-a014da85fbfc"
        ],
        "stereo_centers": 0
      },
      "unii": "CFA914331M"
    }
  ]
}