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          "molfile": "\n  Marvin  01132107272D          \n\n 10 10  0  0  0  0            999 V2000\n    8.6176   -3.2233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9013   -2.8079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1850   -3.2233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1850   -4.0458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4804   -4.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4804   -5.2811    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7635   -4.0512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.0472   -4.4621    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7635   -3.2244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4756   -2.8095    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  1  0  0  0  0\n  3  2  1  0  0  0  0\n  4  3  2  0  0  0  0\n  3 10  1  0  0  0  0\n  5  4  1  0  0  0  0\n  5  6  2  0  0  0  0\n  7  5  1  0  0  0  0\n  7  8  1  0  0  0  0\n  9  7  2  0  0  0  0\n  9 10  1  0  0  0  0\nM  END",
          "smiles": "c1c(CO)occ(c1=O)O",
          "formula": "C6H6O4",
          "atropisomerism": "No",
          "charge": 0,
          "count": 1,
          "stereochemistry": "ACHIRAL",
          "count_amount": {
            "type": "MOL RATIO",
            "average": 1,
            "units": "MOL RATIO",
            "uuid": "03d5ca82-3dff-4533-812a-3f23c0b48154"
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          "molecular_weight": "142.1097",
          "optical_activity": "NONE",
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      "definition_level": "COMPLETE",
      "uuid": "d66b55b8-e731-40c1-9236-018ee1e5566d",
      "version": "15",
      "structure": {
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        "molfile": "\n  Marvin  01132103482D          \n\n 10 10  0  0  0  0            999 V2000\n    5.0472   -4.4621    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7635   -4.0512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4804   -4.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4804   -5.2811    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1850   -4.0458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1850   -3.2233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9013   -2.8079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.6176   -3.2233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4756   -2.8095    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7635   -3.2244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  1  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  2  0  0  0  0\n  3  5  1  0  0  0  0\n  5  6  2  0  0  0  0\n  6  7  1  0  0  0  0\n  7  8  1  0  0  0  0\n  6  9  1  0  0  0  0\n 10  9  1  0  0  0  0\n 10  2  2  0  0  0  0\nM  END",
        "smiles": "c1c(CO)occ(c1=O)O",
        "formula": "C6H6O4",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "142.1097",
        "optical_activity": "NONE",
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}