Index	SMILES	Probability	Label
Compound_1	Brc1cc(Br)cc(c1Oc1nc(nc(n1)Oc1c(Br)cc(cc1Br)Br)Oc1c(Br)cc(cc1Br)Br)Br	0.92	1.0
Compound_2	Clc1c2C3/N=C/4\N=C(c5c4c(Cl)c(c(c5Cl)Cl)Cl)/N=c/4\n5[Cu]N3/C(=N\C3N=C(/N=c\5/c5c4c(Cl)c(c(c5Cl)Cl)Cl)c4c3c(Cl)cc(c4Cl)Cl)/c2c(c(c1Cl)Cl)Cl	0.28	0.0
Compound_3	CCN(c1ccc(cc1)[C+](c1ccc(cc1)N(CC)CC)c1ccc(cc1)N(CC)CC)CC	0.55	1.0
Compound_4	OC(=O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O	0.01	0.0
Compound_5	ClC1C2C3[N-]C(C2C(C(C1Cl)Cl)Cl)NC1NC(C2C1C(Cl)C(C(C2Cl)Cl)Cl)NC1NC([N-]C2NC(N3)C3C2C(Cl)C(C(C3Cl)Cl)Cl)C2C1C(Cl)C(C(C2Cl)Cl)Cl	0.18	0.0
Compound_6	ClC1=C(Cl)C2(C(C1(Cl)C1C2CCC2C(CC1)C1(Cl)C(=C(C2(C1(Cl)Cl)Cl)Cl)Cl)(Cl)Cl)Cl	0.95	1.0
Compound_7	ClC12C(Cl)(Cl)C3(C4(C1(Cl)C1(C2(Cl)C3(C4(C1(Cl)Cl)Cl)Cl)Cl)Cl)Cl	0.95	1.0
Compound_8	O=C(OOC(=O)CCC(=O)O)CCC(=O)O	0.08	0.0
Compound_9	Brc1c(Oc2c(Br)c(Br)c(c(c2Br)Br)Br)c(Br)c(c(c1Br)Br)Br	1.0	1.0
Compound_10	O=C1C(c2ccc3c(n2)c(ccc3)N2C(=O)c3c(C2=O)c(Cl)c(c(c3Cl)Cl)Cl)C(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl	0.66	1.0