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path: root/test/data/EPAFHM.mini.csv
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"STRUCTURE_SMILES","LC50_mmol"
"C1=CC(C=O)=CC(OC)=C1OCCCCCC",1.13E-02
"C1(OC)=C([N+]([O-])=O)C(C=O)=CC(Br)=C1O",2.66E-01
"CCCCCCCCOC(=O)C1=CC=CC(C(=O)OCCCCCCCC)=C1",
"C1=CC(Cl)=CC=C1OC2=C([N+](=O)[O-])C=CC=C2",7.69E-03
"CC1=C(NC=O)C=CC=C1Cl",2.75E-01
"CCCCOC(=O)C1=CC=CC(C(=O)OCCCC)=C1",3.23E-03
"C(C1=CC=CC=C1)(C2=CC=CC=C2)(O)C#C",5.33E-02
"CCCSCCSCCC",4.22E-02
"CCCCCCCCOC(=O)C1=CC=C(C(=O)OCCCCCCCC)C=C1",
"OCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCOC(=O)C2=CC=CC=C2C(=O)OCCCCO",
"CCCSCCCCSCCC",1.45E-02
"C1([N+](=O)[O-])=CC=C(C)C=C1OP(=O)(OC2=C([N+](=O)[O-])C=CC(C)=C2)OC3=C([N+]([O-])=O)C=CC(C)=C3",
"C1=C([N+]([O-])=O)C=CC=C1P(=O)(C2=CC([N+](=O)[O-])=CC=C2)C3=CC([N+](=O)[O-])=CC=C3",
"ClCCOC(=O)NC1CCCCC1",1.70E-01
"O=C1C(C2=CC=CC=C2)(C(=O)NC(=O)N1)CC",2.08E+00
"OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]",5.92E-02
"NC(=O)OCC",5.88E+01
"[O-]C(C1=CC=CC=C1O)=O.[Na+]",1.25E+01
"C1=CC=CC=C1C(=O)N",5.46E+00
"CC[N+](CC)(CC)CC1(=CC=CC=C1).[Cl-]",7.07E-01