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      "structure": {
        "id": "cfa11c90-ccd8-4944-8cc0-8b4105f578c7",
        "molfile": "\n  Symyx   04271719162D 1   1.00000     0.00000     0\n\n 10  4  0  0  0  0            999 V2000\n   10.3896   -7.2180    0.0000 O   0  0  0  0  0  0           0  0  0\n   10.3896   -7.9698    0.0000 C   0  0  0  0  0  0           0  0  0\n   11.0390   -8.3499    0.0000 O   0  0  0  0  0  0           0  0  0\n    9.6809   -8.2221    0.0000 C   0  0  0  0  0  0           0  0  0\n    9.0517   -7.8355    0.0000 N   0  0  0  0  0  0           0  0  0\n    7.9019   -4.7250    0.0000 Al  0  1  0  0  0  0           0  0  0\n   10.0332   -4.6708    0.0000 Zr  0  0  0  0  0  0           0  0  0\n   12.6270   -4.6000    0.0000 O   0  5  0  0  0  0           0  0  0\n   14.8665   -4.7250    0.0000 Cl  0  5  0  0  0  0           0  0  0\n   17.4832   -4.6978    0.0000 O   0  0  0  0  0  0           0  0  0\n  4  2  1  0     0  0\n  5  4  1  0     0  0\n  2  1  2  0     0  0\n  2  3  1  0     0  0\nM  CHG  4   6   3   7   4   8  -1   9  -1\nM  STY  8   1 GEN   2 DAT   3 GEN   4 GEN   5 GEN   6 GEN   7 GEN   8 DAT\nM  STY  2   9 DAT  10 DAT\nM  SLB  8   1   1   2   2   3   3   4   4   5   5   6   6   7   7   8   8\nM  SLB  2   9   9  10  10\nM  SAL   1  1   7\nM  SDI   1  4    9.6000   -5.0839    9.6000   -4.0839\nM  SDI   1  4   10.9500   -4.0839   10.9500   -5.0839\nM  SDT   2 FDAREG_SGROUP\nM  SDD   2    10.9500   -5.8039    DA    ALL  1       5\nM  SED   2 A\nM  SAL   3  1   8\nM  SDI   3  4   12.3500   -5.0639   12.3500   -4.0239\nM  SDI   3  4   13.4000   -4.0239   13.4000   -5.0639\nM  SAL   4  5   6   7   8   9  10\nM  SDI   4  4    7.1000   -5.5739    7.1000   -3.7239\nM  SDI   4  4   18.3000   -3.7239   18.3000   -5.5739\nM  SAL   5  1   9\nM  SDI   5  4   14.4500   -5.1739   14.4500   -4.1739\nM  SDI   5  4   15.5500   -4.1739   15.5500   -5.1739\nM  SAL   6  1   6\nM  SDI   6  4    7.4900   -5.1739    7.4900   -4.1739\nM  SDI   6  4    8.8000   -4.1739    8.8000   -5.1739\nM  SAL   7  1  10\nM  SDI   7  4   17.1600   -5.1239   17.1600   -4.1839\nM  SDI   7  4   18.0500   -4.1839   18.0500   -5.1239\nM  SAL   8  1   8\nM  SDT   8 FDAREG_SGROUP\nM  SDD   8    13.1600   -5.9039    DA    ALL  1       5\nM  SED   8 D\nM  SAL   9  1   6\nM  SDT   9 FDAREG_SGROUP\nM  SDD   9     8.9500   -5.8039    DA    ALL  1       5\nM  SED   9 C\nM  SAL  10  1   9\nM  SDT  10 FDAREG_SGROUP\nM  SDD  10    15.8000   -5.7039    DA    ALL  1       5\nM  SED  10 B\nM  SPL  1   2   1\nM  END",
        "smiles": "C(C(=O)O)N.[Al+3].[Cl-].O.[OH-].[Zr+4]",
        "formula": "C2H5NO2.Al.Cl.Zr.HO.H2O",
        "atropisomerism": "No",
        "charge": 5,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "263.7474",
        "optical_activity": "NONE",
        "references": [
          "43aef199-a600-4ca2-8d70-4a701abdddf3",
          "b60628fb-0fbc-4aa9-8ed5-a62547a4f5f4"
        ],
        "stereo_centers": 0
      },
      "unii": "P9D3YP29MY"
    }
  ]
}