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      "structure": {
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        "molfile": "\n  Marvin  01132113132D          \n\n 25 26  0  0  0  0            999 V2000\n    9.1325   -6.8161    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    9.8470   -6.4035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.5615   -6.8161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.2760   -6.4035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.2760   -5.5785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.9905   -5.1661    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   12.7050   -5.5785    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   13.4195   -5.1660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.1340   -5.5785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.8484   -5.1660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.8484   -4.3410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.5629   -3.9285    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0\n   16.2775   -4.3410    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   15.5629   -3.1034    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   14.1340   -3.9285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.4195   -4.3410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.5615   -5.1661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.5615   -4.3410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.8470   -5.5785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.1325   -7.6411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4180   -8.0536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7035   -7.6411    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4180   -6.4035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7035   -6.8161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.9891   -6.4036    0.0000 O   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  4  5  1  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  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 12 13  2  0  0  0  0\n 12 14  1  0  0  0  0\n 15 11  2  0  0  0  0\n 16 15  1  0  0  0  0\n  8 16  2  0  0  0  0\n 17  5  2  0  0  0  0\n 17 18  1  0  0  0  0\n 19 17  1  0  0  0  0\n  2 19  2  0  0  0  0\n  1 20  1  0  0  0  0\n 20 21  1  0  0  0  0\n 21 22  1  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\nM  CHG  2  12   1  14  -1\nM  END",
        "smiles": "Cc1cc(ccc1/N=N/c2ccc(cc2)[N+](=O)[O-])N(CCO)CCO",
        "formula": "C17H20N4O4",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 1,
        "molecular_weight": "344.3658",
        "optical_activity": "NONE",
        "references": [
          "31b54820-5be5-47f4-a368-b87394c38dee",
          "45951185-5fc5-4040-a8cf-82f59b704669"
        ],
        "stereo_centers": 0
      },
      "unii": "HHG9JOS5G7"
    }
  ]
}