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        "molfile": "\n  Marvin  01132103502D          \n\n 45 48  0  0  1  0            999 V2000\n   13.4571  -13.3022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.6726  -13.5571    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   12.4176  -14.3418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.5927  -14.3418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.3377  -13.5571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.0051  -13.0722    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   12.0051  -12.2473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.7196  -11.8347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   11.2906  -11.8347    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n   11.2906  -11.0098    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   12.0051  -10.5972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.0051   -9.7723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   12.7196  -11.0098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.5762  -12.2473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.8618  -11.8347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.1473  -12.2473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4329  -11.8347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4329  -11.0098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7184  -10.5972    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    9.1473  -10.5972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.8618  -11.0098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.6287  -12.4953    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   14.0702  -13.8543    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   14.8548  -13.5994    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   15.4679  -14.1514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.2964  -14.9583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   16.2526  -13.8964    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   16.8656  -14.4485    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   16.6941  -15.2554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.9095  -15.5104    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   17.3072  -15.8074    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   17.6503  -14.1935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   18.2634  -14.7455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   19.0480  -14.4906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   19.6611  -15.0426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   19.4895  -15.8496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   18.7049  -16.1045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   18.0918  -15.5525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.0264  -12.7924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.8110  -12.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   16.4241  -13.0895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.2088  -12.8345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.3802  -12.0276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   16.7671  -11.4755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.9826  -11.7305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  1  6  0  0  0\n  2  3  1  0  0  0  0\n  3  4  1  0  0  0  0\n  5  4  1  0  0  0  0\n  6  5  1  0  0  0  0\n  2  6  1  0  0  0  0\n  6  7  1  0  0  0  0\n  7  8  2  0  0  0  0\n  7  9  1  0  0  0  0\n  9 10  1  6  0  0  0\n 10 11  1  0  0  0  0\n 11 12  2  0  0  0  0\n 11 13  1  0  0  0  0\n  9 14  1  0  0  0  0\n 14 15  1  0  0  0  0\n 15 16  1  0  0  0  0\n 16 17  2  0  0  0  0\n 17 18  1  0  0  0  0\n 18 19  1  0  0  0  0\n 20 18  2  0  0  0  0\n 21 20  1  0  0  0  0\n 15 21  2  0  0  0  0\n  1 22  2  0  0  0  0\n  1 23  1  0  0  0  0\n 23 24  1  0  0  0  0\n 24 25  1  0  0  0  0\n 25 26  2  0  0  0  0\n 25 27  1  0  0  0  0\n 27 28  1  0  0  0  0\n 28 29  1  1  0  0  0\n 29 30  2  0  0  0  0\n 29 31  1  0  0  0  0\n 28 32  1  0  0  0  0\n 32 33  1  0  0  0  0\n 33 34  1  0  0  0  0\n 34 35  2  0  0  0  0\n 35 36  1  0  0  0  0\n 37 36  2  0  0  0  0\n 38 37  1  0  0  0  0\n 33 38  2  0  0  0  0\n 24 39  1  1  0  0  0\n 39 40  1  0  0  0  0\n 40 41  1  0  0  0  0\n 41 42  2  0  0  0  0\n 42 43  1  0  0  0  0\n 44 43  2  0  0  0  0\n 45 44  1  0  0  0  0\n 40 45  2  0  0  0  0\nM  END",
        "smiles": "CC(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](Cc4ccccc4)C(=O)N",
        "formula": "C34H39N5O6",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ABSOLUTE",
        "defined_stereo": 4,
        "ez_centers": 0,
        "molecular_weight": "613.7047",
        "optical_activity": "UNSPECIFIED",
        "references": [
          "7241ebe8-7aef-4ea3-aca4-8ced5c1028c8",
          "cec80a0b-e858-43a2-be0e-c33472cfd0ac"
        ],
        "stereo_centers": 4
      },
      "unii": "6K389LE0MV"
    }
  ]
}