Index	SMILES	Probability	Label
Compound_1	OC(=O)C(C(C(F)(F)F)(F)F)(F)F	0.99	1.0
Compound_2	OC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_3	FC(C(C(S(=O)(=O)O)(F)F)(F)F)(C(F)(F)F)F	0.99	1.0
Compound_4	OC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_5	OC(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_6	FC(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_7	OC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_8	FC(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F	0.99	1.0
Compound_9	OC(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_10	FC(C(C(C(C(S(=O)(=O)N)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F	0.98	1.0
Compound_11	FC(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F	0.98	1.0
Compound_12	OC(=O)C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_13	OC(=O)C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_14	FC(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F	0.98	1.0
Compound_15	OC(=O)C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_16	OC(=O)C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_17	OC(=O)C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_18	OC(=O)C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_19	OC(=O)C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_20	OC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F	0.79	1.0
Compound_21	COP(=O)(OC)OC	0.93	1.0
Compound_22	CCOP(=O)(OCC)OCC	0.96	1.0
Compound_23	CCCCOP(=O)(OCCCC)O	0.88	1.0
Compound_24	O=[P+]1Oc2ccccc2c2c1cccc2	0.98	1.0
Compound_25	CCCOP(=O)(OCCC)OCCC	0.96	1.0
Compound_26	OP(=O)(Oc1ccccc1)Oc1ccccc1	0.85	1.0
Compound_27	ClCC(OP(=O)(OC(CCl)C)O)C	0.76	1.0
Compound_28	CC(COP(=O)(OCC(C)C)OCC(C)C)C	0.96	1.0
Compound_29	ClCCOP(=O)(OCCCl)OCCCl	0.98	1.0
Compound_30	O=P(c1ccccc1)(Oc1ccccc1)Oc1ccccc1	1.0	1.0
Compound_31	Oc1ccc(c(c1)P1(=O)Oc2ccccc2c2c1cccc2)O	0.9	1.0
Compound_32	O=P(Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1	0.99	1.0
Compound_33	ClCC(OP(=O)(OC(CCl)C)OC(CCl)C)C	0.98	1.0
Compound_34	Cc1ccccc1OP(=O)(Oc1ccccc1)Oc1ccccc1	0.98	1.0
Compound_35	OC(=O)CC(C(=O)O)CP1(=O)Oc2ccccc2c2c1cccc2	0.17	0.0
Compound_36	CCCCC(COP(=O)(Oc1ccccc1)Oc1ccccc1)CC	0.98	1.0
Compound_37	Cc1ccc(cc1)OP(=O)(Oc1ccc(cc1)C)Oc1ccc(cc1)C	0.99	1.0
Compound_38	Cc1ccccc1OP(=O)(Oc1ccccc1C)Oc1ccccc1C	0.99	1.0
Compound_39	O=P(Oc1ccccc1C(C)(C)C)(Oc1ccccc1)Oc1ccccc1	0.98	1.0
Compound_40	CCP(=O)(CC)[O-]	0.81	1.0
Compound_41	CCCCOCCOP(=O)(OCCOCCCC)OCCOCCCC	0.98	1.0
Compound_42	ClCC(OP(=O)(OC(CCl)CCl)OC(CCl)CCl)CCl	0.99	1.0
Compound_43	CCCCC(COP(=O)(OCC(CCCC)CC)OCC(CCCC)CC)CC	0.98	1.0
Compound_44	CC(c1ccc(cc1)OP(=O)(Oc1ccc(cc1)C(C)(C)C)Oc1ccc(cc1)C(C)(C)C)(C)C	0.98	1.0
Compound_45	O=P(Oc1ccccc1)(Oc1ccccc1)Oc1cccc(c1)OP(=O)(Oc1ccccc1)Oc1ccccc1	0.98	1.0
Compound_46	CC(c1ccc(cc1)OP(=O)(Oc1ccccc1)Oc1ccccc1)(c1ccc(cc1)OP(=O)(Oc1ccccc1)Oc1ccccc1)C	0.98	1.0
Compound_47	BrCC(COP(=O)(OCC(CBr)Br)OCC(CBr)Br)Br	0.97	1.0
Compound_48	Brc1cc(Br)c(c(c1)Br)O	0.99	1.0
Compound_49	BrC[C@H]([C@H](CBr)Br)Br	0.63	1.0
Compound_50	Cc1c(Br)c(Br)c(c(c1Br)Br)O	0.99	1.0
Compound_51	Brc1c(C)c(Br)c(c(c1Br)Br)Br	0.98	1.0
Compound_52	Brc1cc(cc(c1O)Br)S(=O)(=O)c1cc(Br)c(c(c1)Br)O	0.95	1.0
Compound_53	C=CCOc1c(Br)cc(cc1Br)C(c1cc(Br)c(c(c1)Br)OCC=C)(C)C	0.95	1.0
Compound_54	OCCOc1c(Br)cc(cc1Br)C(c1cc(Br)c(c(c1)Br)OCCO)(C)C	0.35	0.0
Compound_55	BrC1CCC(Br)C(Br)CCC(C(CCC1Br)Br)Br	1.0	1.0
Compound_56	BrCC(Cn1c(=O)n(CC(CBr)Br)c(=O)n(c1=O)CC(CBr)Br)Br	0.01	0.0
Compound_57	BrCC(COc1c(Br)cc(cc1Br)C(c1cc(Br)c(c(c1)Br)OCC(CBr)Br)(C)C)Br	0.99	1.0