benchmark_csv/qm9_subset.csv

smiles,cv
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CN1C2C3C4C3C2(O)C14,29.684
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COC1COC11CCC1,33.565
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CCC(C)(OC=N)C=O,37.51
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CCC1(C)OC1C,31.318
CC1OC(CC1=O)C=O,31.536
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CC1CC(C)(O)CCO1,37.657
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CC(O)C(C)CCCO,42.73
CN1C2C3C1C2N3C,28.073
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CC(O)C(CO)CCO,41.536
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CC12CC1(C)C1CC1C2,35.24
Cc1cc([nH]c1O)OC,35.394
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CC1OC2C(C#C)C12C,35.014
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CCNc1ncnnn1,29.227
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CC1C2C3CC1(C#C)N23,31.456
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