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        "molfile": "\n  Marvin  01132106362D          \n\n 23 26  0  0  0  0            999 V2000\n   15.2944  -10.1178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.5766  -10.8930    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   16.3696  -11.1204    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   16.3983  -11.9449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.6231  -12.2272    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   15.1152  -11.5770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.8247   -9.4858    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   16.5392   -9.8983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.2536   -9.4858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.9681   -9.8983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.9681  -10.7233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   18.6825  -11.1358    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0\n   17.2536  -11.1358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   16.5392  -10.7233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   16.1069   -8.7106    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   15.2944   -8.8538    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   14.5799   -9.2663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.5799  -10.0913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.8655  -10.5038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.1510  -10.0913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.1510   -9.2663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.8655   -8.8538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.8655   -8.0288    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  1  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  2  0  0  0  0\n  5  4  1  0  0  0  0\n  6  5  2  0  0  0  0\n  2  6  1  0  0  0  0\n  1  7  1  0  0  0  0\n  7  8  1  6  0  0  0\n  8  9  1  0  0  0  0\n  9 10  2  0  0  0  0\n 10 11  1  0  0  0  0\n 11 12  1  0  0  0  0\n 13 11  2  0  0  0  0\n 14 13  1  0  0  0  0\n  8 14  2  0  0  0  0\n  7 15  1  0  0  0  0\n 16 15  1  0  0  0  0\n  7 16  1  0  0  0  0\n 16 17  1  1  0  0  0\n 17 18  1  0  0  0  0\n 18 19  2  0  0  0  0\n 19 20  1  0  0  0  0\n 21 20  2  0  0  0  0\n 22 21  1  0  0  0  0\n 17 22  2  0  0  0  0\n 22 23  1  0  0  0  0\nM  END",
        "smiles": "c1ccc(c(c1)[C@@H]2[C@@](Cn3cncn3)(c4ccc(cc4)F)O2)Cl",
        "formula": "C17H13ClFN3O",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "RACEMIC",
        "defined_stereo": 2,
        "ez_centers": 0,
        "molecular_weight": "329.7566",
        "optical_activity": "( + / - )",
        "references": [
          "015cc987-4acc-4e5c-941b-95cdd17f0d89",
          "dad46537-e6f2-437c-b210-4c43787be93a"
        ],
        "stereo_centers": 2
      },
      "unii": "U80T84L776"
    }
  ]
}