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        "molfile": "\n  Marvin  01132109512D          \n\n 16 16  0  0  0  0            999 V2000\n    1.3165    0.1585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.6161    0.5602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.0547    0.5674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.3165   -0.6666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.0919    0.1514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.7698    0.1585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.0367   -1.0823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.7958   -0.2576    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.5026    0.8679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.3224   -0.5621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.7698   -0.6733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.5129    0.1514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.2204   -0.2576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.5129    0.9760    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.9283    0.1567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.6413   -0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  1  0  0  0  0\n  1  3  2  0  0  0  0\n  1  4  1  0  0  0  0\n  2  5  1  0  0  0  0\n  3  6  1  0  0  0  0\n  4  7  2  0  0  0  0\n  5  8  1  0  0  0  0\n  5  9  1  0  0  0  0\n  5 10  1  0  0  0  0\n  6 11  2  0  0  0  0\n  8 12  1  0  0  0  0\n 12 13  1  0  0  0  0\n 12 14  2  0  0  0  0\n 13 15  1  0  0  0  0\n 15 16  1  0  0  0  0\n  7 11  1  0  0  0  0\nM  END",
        "smiles": "CCCC(=O)OC(C)(C)Cc1ccccc1",
        "formula": "C14H20O2",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "220.3079",
        "optical_activity": "NONE",
        "references": [
          "5483cab6-8d3f-4b7d-8ddf-33721e15ef5d",
          "0b345fdd-7e22-49ab-b5dc-f7662a37f5b6"
        ],
        "stereo_centers": 0
      },
      "unii": "3Q0C60547R"
    }
  ]
}