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        "molfile": "\n  Marvin  01132111432D          \n\n 25 26  0  0  0  0            999 V2000\n    2.8579   -0.7697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.8579   -0.7697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.1434   -0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.1434    0.4678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.4289    0.8803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.7145    0.4678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.7145   -0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.4289   -0.7697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.0000    0.8803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.4125    1.5947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.4125    1.5947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7145    0.4678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.4289    0.8803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1434    0.4678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1434   -0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.4289   -0.7697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7145   -0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.5724   -0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2868   -0.7697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.0013   -0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2868   -1.5947    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.5724   -0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -4.2868   -0.7697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -5.0013   -0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -4.2868   -1.5947    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  2  3  1  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  6  7  2  0  0  0  0\n  7  8  1  0  0  0  0\n  3  8  2  0  0  0  0\n  6  9  1  0  0  0  0\n  9 10  1  0  0  0  0\n  9 11  1  0  0  0  0\n  9 12  1  0  0  0  0\n 12 13  1  0  0  0  0\n 13 14  2  0  0  0  0\n 14 15  1  0  0  0  0\n  1 15  1  0  0  0  0\n 15 16  2  0  0  0  0\n 16 17  1  0  0  0  0\n 12 17  2  0  0  0  0\n 18 19  1  0  0  0  0\n 19 20  1  0  0  0  0\n 19 21  1  0  0  0  0\n  1 18  1  0  0  0  0\n 22 23  1  0  0  0  0\n 23 24  1  0  0  0  0\n 23 25  1  0  0  0  0\n  2 22  1  0  0  0  0\nM  END",
        "smiles": "CC(COc1ccc(cc1)C(C)(C)c2ccc(cc2)OCC(C)O)O",
        "formula": "C21H28O4",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "MIXED",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "344.4454",
        "optical_activity": "UNSPECIFIED",
        "references": [
          "38e43bac-b015-403b-b716-17baf36d1ccf",
          "5f84b448-80af-4ed4-b099-2187430b3014"
        ],
        "stereo_centers": 2
      },
      "unii": "S5K2510L3D"
    }
  ]
}