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        "molfile": "\n  Marvin  01132102132D          \n\n 15 12  0  0  0  0            999 V2000\n    5.6525   -4.5561    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n   12.3508   -6.0640    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   12.7633   -6.7785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.5883   -6.7785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.0008   -6.0640    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   14.0008   -7.4930    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   11.5258   -6.0640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.1133   -5.3496    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   10.2883   -5.3496    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0\n   10.0748   -4.5527    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    9.7050   -4.7662    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    9.8758   -6.0640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   11.1133   -6.7785    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   12.7633   -5.3496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.6525   -4.5561    0.0000 Na  0  3  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  1  0  0  0  0\n  4  6  2  0  0  0  0\n  2  7  1  0  0  0  0\n  7  8  1  0  0  0  0\n  8  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  2  0  0  0  0\n  7 13  2  0  0  0  0\n  2 14  1  0  0  0  0\nM  CHG  4   1   1   5  -1  11  -1  15   1\nM  STY  1   1 MUL\nM  SCN  1   1 HT \nM  SAL   1  2   1  15\nM  SPA   1  1   1\nM  SDI   1  4    5.2325   -4.9761    5.2325   -4.1361\nM  SDI   1  4    6.0725   -4.1361    6.0725   -4.9761\nM  SMT   1 2\nM  END",
        "smiles": "CN(CC(=O)[O-])C(=N)NP(=O)(O)[O-].[Na+].[Na+]",
        "formula": "C4H8N3O5P.2Na",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "255.0769",
        "optical_activity": "NONE",
        "references": [
          "e137458f-37e8-4acf-a619-8f489083becb",
          "b0620917-3384-4a28-ab3c-9b218be42bd9"
        ],
        "stereo_centers": 0
      },
      "unii": "79577SJY6E"
    }
  ]
}