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          "smiles": "C(=C/C(=O)O)/C(=O)O",
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          "stereochemistry": "ABSOLUTE",
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      "version": "36",
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        "molfile": "\n  Marvin  01132109132D          \n\n 35 35  0  0  1  0            999 V2000\n    8.5195   -3.7433    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.8152   -4.1616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.3390   -3.7561    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n    6.3896   -4.1701    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0854   -3.7518    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n   10.0646   -4.1275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.6640   -2.9110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.6853   -3.7561    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n    7.8152   -4.9982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   10.0817   -4.9598    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3811   -2.4841    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9811   -4.1659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2762   -2.9707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.7732   -3.6921    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9470   -2.5012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2683   -3.7689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.6036   -2.9622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.5597   -4.1915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.9506   -2.4969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0811   -2.9366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9470   -1.6817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.8342   -3.8030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.5512   -5.0110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2043   -1.2848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.8470   -5.4207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1213   -4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1171   -5.0323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7153   -6.0738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1878   -6.9146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1750   -6.0738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4451   -5.6512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4707   -7.3500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7110   -6.9189    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9811   -5.6512    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    8.0073   -7.1323    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  4  5  1  0  0  0  0\n  5  2  1  0  0  0  0\n  3  6  1  1  0  0  0\n  8  7  1  1  0  0  0\n  8  4  1  0  0  0  0\n  9  2  2  0  0  0  0\n 10  6  2  0  0  0  0\n 11  7  2  0  0  0  0\n 12  8  1  0  0  0  0\n 13  1  1  0  0  0  0\n 14  6  1  0  0  0  0\n 15  7  1  0  0  0  0\n 16 12  1  0  0  0  0\n 17  3  1  0  0  0  0\n 18 16  1  0  0  0  0\n 19 13  1  0  0  0  0\n  5 20  1  1  0  0  0\n 21 15  1  0  0  0  0\n 22 18  2  0  0  0  0\n 23 18  1  0  0  0  0\n 24 21  1  0  0  0  0\n 25 23  2  0  0  0  0\n 26 22  1  0  0  0  0\n 27 25  1  0  0  0  0\n 17 19  1  0  0  0  0\n 26 27  2  0  0  0  0\n  2  1  1  0  0  0  0\n  3  1  1  0  0  0  0\n 29 30  1  0  0  0  0\n 30 31  2  0  0  0  0\n 31 28  1  0  0  0  0\n 32 29  2  0  0  0  0\n 33 28  2  0  0  0  0\n 34 28  1  0  0  0  0\n 35 29  1  0  0  0  0\nM  END",
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