Index SMILES Probability Label Compound_1 CCCCCCCCN(C)C 0.61 1.0 Compound_2 CCCCC#CCCC 0.93 1.0 Compound_3 CCCCCOCCCCC 0.88 1.0 Compound_4 CCCCCN(CCCCC)C 0.71 1.0 Compound_5 CCCCCCCC 0.98 1.0 Compound_6 CCCCC#CCCCC 0.93 1.0 Compound_7 CCCCCC#CCCC 0.98 1.0 Compound_8 [CH2-]CCCCCCC 0.93 1.0 Compound_9 CCCC/C=C/CCCC 0.88 1.0 Compound_10 CCCC[C@@H](CCC)C 0.88 1.0 Compound_11 CCCC/C=C\CCCC 0.88 1.0 Compound_12 CCCC[C@H](CCC)C 0.88 1.0 Compound_13 CCCC/C=C/CCC 0.88 1.0 Compound_14 CCCCC/C=C/CCC 0.92 1.0 Compound_15 CCCCC/C=C\CCC 0.92 1.0 Compound_16 CCCC/C=C\CCC 0.88 1.0 Compound_17 CCCCC(CC)CC 0.88 1.0 Compound_18 CCCCCCCC=C 0.89 1.0 Compound_19 CCCCCCCC(=C)C 0.78 1.0 Compound_20 CCCCCCCCC 0.98 1.0 Compound_21 CCCCCCCCC=C 0.89 1.0 Compound_22 CCCCCCC/C=C\C 0.92 1.0 Compound_23 CCCCCCC/C=C/C 0.92 1.0 Compound_24 CCCCCCCCCF 0.91 1.0 Compound_25 CCCCCC/C=C/CC 0.92 1.0 Compound_26 CCCCCC/C=C\CC 0.92 1.0 Compound_27 CCCCCC[C@H](CC)C 0.88 1.0 Compound_28 CCCCCC[C@@H](CC)C 0.88 1.0 Compound_29 CCCCC[C@@H](CCC)C 0.88 1.0 Compound_30 CCCCC[C@H](CCC)C 0.88 1.0 Compound_31 CCCCCC(CC)CC 0.88 1.0 Compound_32 CCCCCCCC(C)C 0.81 1.0 Compound_33 CCCCCCCCCC 0.98 1.0 Compound_34 CCCCCCCCC(C)C 0.81 1.0 Compound_35 CCCCCCCCCC=C 0.89 1.0 Compound_36 C=CCCCCCCC(=C)C 0.78 1.0 Compound_37 CCCCCCCCC(=C)C 0.78 1.0 Compound_38 CCCCCCCCCC(=C)C 0.78 1.0 Compound_39 CCCCCCCCCCC 0.98 1.0 Compound_40 CCCCCCCCCC(C)C 0.81 1.0 Compound_41 CCCCC[C@@H](CCCC(C)C)C 0.81 1.0 Compound_42 CCCCC[C@H](CCCC(C)C)C 0.81 1.0 Compound_43 CCCCCCCC[C@@H](CCC)C 0.88 1.0 Compound_44 CCCCCCCC[C@H](CCC)C 0.88 1.0 Compound_45 CCCCCCCCCCC(C)C 0.81 1.0 Compound_46 CCCCCC(OC(C)C)OC(C)C 0.77 1.0 Compound_47 CCCC(OCCCC)OCCCC 0.82 1.0 Compound_48 C[C@@H]([BH-]([C@@H](C(C)C)C)[C@@H](C(C)C)C)C(C)C 0.82 1.0 Compound_49 C[C@@H](CCCC(C)C)CCCCC(C)C 0.73 1.0 Compound_50 C[C@H](CCCC(C)C)CCCCC(C)C 0.73 1.0 Compound_51 CN1CC(=O)OB(OC(=O)C1)C(=C)[Si](C)(C)C 0.33 0.0 Compound_52 CCCCCC(=O)OCCCC(F)(F)F 0.82 1.0 Compound_53 FC(CCCNCCCC(F)(F)F)(F)F 0.54 1.0 Compound_54 C=CC[Si](N[Si](CC=C)(C)C)(C)C 0.47 0.0 Compound_55 CCCC(OCCCC)OCCCC 0.82 1.0 Compound_56 C[Si]1(C)C[Si](C)(C)C[Si](C1)(C)C 0.74 1.0 Compound_57 CCCCCCCC[Si](N(C)C)(C)C 0.55 1.0 Compound_58 CC[C@H](CCC[C@H](CCCC(C)C)C)C 0.81 1.0 Compound_59 CC[C@@H](CCC[C@H](CCCC(C)C)C)C 0.81 1.0 Compound_60 CC[C@@H](CCC[C@@H](CCCC(C)C)C)C 0.81 1.0 Compound_61 CC[C@H](CCC[C@@H](CCCC(C)C)C)C 0.81 1.0 Compound_62 CCCCCCCCCCC(F)(F)F 0.77 1.0 Compound_63 CCCCCCC/C=C\C(C(F)(F)F)(F)F 0.75 1.0 Compound_64 CCCCCCCCCC(C(F)(F)F)(F)F 0.77 1.0 Compound_65 CCCCCCCCCC[Si](C)(C)C 0.8 1.0 Compound_66 CCCCCCCCCCCCC(F)(F)F 0.77 1.0 Compound_67 CC(=C)CCCCCC(=C)C[Si](C)(C)C 0.67 1.0 Compound_68 CCCCCCC/C=C/C(C(F)(F)F)(F)F 0.75 1.0 Compound_69 CCCCCCCCCCCC(F)(F)F 0.77 1.0 Compound_70 CC(CCOB(OCCC(C)C)OCCC(C)C)C 0.9 1.0 Compound_71 CC(COP(OCC(C)C)OCC(C)C)C 0.8 1.0 Compound_72 CCCCCOB(OCCCCC)OCCCCC 0.84 1.0 Compound_73 CCCCCCCCCCC/C=C\C(F)(F)F 0.75 1.0 Compound_74 CCCCCCCCCCC/C=C/C(F)(F)F 0.75 1.0 Compound_75 C=CC[Sn](CC=C)(CC)CC 0.85 1.0 Compound_76 CCCC[SnH2+](CCCC)CCCC 0.88 1.0 Compound_77 CCCC[Sn](CC)(CC)CC 0.96 1.0 Compound_78 FC(CCCCOCCCCC(F)(F)F)(F)F 0.86 1.0 Compound_79 CCCCCCC(C(Br)(F)F)(F)F 0.78 1.0 Compound_80 CCCC[SnH](CCCC)CCCC 0.97 1.0 Compound_81 CCCC[Sn](CCCC)CCCC 0.97 1.0 Compound_82 CCCC[Sn+2](CCCC)CCCC 0.88 1.0 Compound_83 C=CCC(C(C(C(CC=C)(F)F)(F)F)(F)F)(F)F 0.67 1.0 Compound_84 CCCCC/C=C\C(C(C(F)(F)F)(F)F)(F)F 0.68 1.0 Compound_85 CCC/C=C\C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.68 1.0 Compound_86 CCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_87 CCC/C=C/C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.68 1.0 Compound_88 CCCC/C=C/C(C(F)(F)F)(C(F)(F)F)F 0.65 1.0 Compound_89 CCCC/C=C\C(C(C(F)(F)F)(F)F)(F)F 0.63 1.0 Compound_90 CCCCC/C=C/C(C(C(F)(F)F)(F)F)(F)F 0.68 1.0 Compound_91 CCCC/C=C\C(C(F)(F)F)(C(F)(F)F)F 0.65 1.0 Compound_92 CCCC/C=C/C(C(C(F)(F)F)(F)F)(F)F 0.63 1.0 Compound_93 CCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.66 1.0 Compound_94 CCC[Sn](CCC)(CCC)CCC 0.94 1.0 Compound_95 CCCC[Sn](CCCC)(CC)CC 0.96 1.0 Compound_96 FC(CCCCCCCCCCC(F)(F)F)(F)F 0.72 1.0 Compound_97 FC(CCCCCCCCC(F)(F)F)(F)F 0.72 1.0 Compound_98 FC(CCCCCCCCCCCC(F)(F)F)(F)F 0.72 1.0 Compound_99 FC(CCCCCCCCCC(F)(F)F)(F)F 0.72 1.0 Compound_100 CCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.71 1.0 Compound_101 CC[Si](C#C[Si](CC)(CC)CC)(CC)CC 0.78 1.0 Compound_102 CCCCCCCCCC/C=C\C(C(F)(F)F)(F)F 0.75 1.0 Compound_103 CCCCCCCC/C=C/C(C(F)(F)F)(F)F 0.75 1.0 Compound_104 CCCCCCCC/C=C\C(C(F)(F)F)(F)F 0.75 1.0 Compound_105 CCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_106 CCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_107 CCCCCCCCCCC/C=C\C(F)(F)F 0.75 1.0 Compound_108 CCCCCCC/C=C\C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_109 CCCCCC/C=C/C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_110 CCCCCCC/C=C/C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_111 C=C(C[Si](C)(C)C)CCCCCC(=C)C[Si](C)(C)C 0.64 1.0 Compound_112 CCCCCCCCCCCC(C(F)(F)F)(F)F 0.77 1.0 Compound_113 CCCCCC/C=C\C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_114 CCCCCCCCCCCCC(C(F)(F)F)(F)F 0.77 1.0 Compound_115 CCCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_116 CCCCCCCCC/C=C\C(C(F)(F)F)(F)F 0.75 1.0 Compound_117 CCCCCCCCC/C=C/C(C(F)(F)F)(F)F 0.75 1.0 Compound_118 CCCCCCCCCCC(C(F)(F)F)(F)F 0.77 1.0 Compound_119 CCCCCCCCCC/C=C/C(C(F)(F)F)(F)F 0.75 1.0 Compound_120 CCCCCCCCCCC/C=C/C(F)(F)F 0.75 1.0 Compound_121 C[C@@H](CC(C)C)OB(O[C@H](CC(C)C)C)O[C@H](CC(C)C)C 0.79 1.0 Compound_122 C[C@H](CC(C)C)OB(O[C@H](CC(C)C)C)O[C@@H](CC(C)C)C 0.79 1.0 Compound_123 C[C@H](CC(C)C)OB(O[C@@H](CC(C)C)C)O[C@@H](CC(C)C)C 0.79 1.0 Compound_124 C[C@H](CC(C)C)OB(O[C@H](CC(C)C)C)O[C@H](CC(C)C)C 0.79 1.0 Compound_125 C=CC1(C(F)(F)F)C(F)(F)C(C(C1(F)F)(F)F)(F)F 0.73 1.0 Compound_126 BrC([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C 0.68 1.0 Compound_127 CCCC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.7 1.0 Compound_128 CC([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)(C)C 0.55 1.0 Compound_129 C[Si]([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)(C)C 0.56 1.0 Compound_130 CCCC[Sn](CCCC)(CCCC)CC 0.96 1.0 Compound_131 CCCC[Sn](CCCC)(CCCC)C 0.88 1.0 Compound_132 FC(CCCCCCCCCCCCC(F)(F)F)(F)F 0.72 1.0 Compound_133 C[Si](C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)(C)C 0.65 1.0 Compound_134 CCCCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.77 1.0 Compound_135 CC/C=C/C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.63 1.0 Compound_136 CCCCCCCC/C=C/C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_137 CCCCCCCCC/C=C/C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_138 CCCCCCCCCCCCCC(C(F)(F)F)(F)F 0.77 1.0 Compound_139 CC/C=C\C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.63 1.0 Compound_140 CCCCC/C=C/C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.68 1.0 Compound_141 FC(C(F)(F)F)(CCCCCCC(C(F)(F)F)(F)F)F 0.72 1.0 Compound_142 CCCC/C=C/C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.63 1.0 Compound_143 CCCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.77 1.0 Compound_144 CCCCCCCCC/C=C\C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_145 CCCCCCCC/C=C\C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_146 CCCCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_147 CCCCCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_148 FC(C(F)(F)F)(CCCCCC(C(F)(F)F)(F)F)F 0.72 1.0 Compound_149 CCCCC/C=C\C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.68 1.0 Compound_150 CCCC/C=C\C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.63 1.0 Compound_151 C=C[Si]1(C)N[Si](C)(C=C)N[Si](N[Si](N1)(C)C=C)(C)C=C 0.53 1.0 Compound_152 O=C(C(F)(F)F)OB(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F 0.62 1.0 Compound_153 CCO[C@](C(F)(F)F)(NC(=O)C(C(F)(F)F)C(F)(F)F)O 0.36 0.0 Compound_154 CCO[C@@](C(F)(F)F)(NC(=O)C(C(F)(F)F)C(F)(F)F)O 0.36 0.0 Compound_155 OC(C(C(F)(F)F)(C(F)(F)F)O)(C(F)(F)F)C(F)(F)F 0.6 1.0 Compound_156 FC1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(Cl)Cl)(F)F 0.51 1.0 Compound_157 FC1(F)C(F)(F)C(F)(F)[C@@]([C@](C1(F)F)(F)Cl)(F)Cl 0.51 1.0 Compound_158 FC1(F)C(F)(F)C(F)(F)[C@@]([C@@](C1(F)F)(F)Cl)(F)Cl 0.51 1.0 Compound_159 FC1(F)C(F)(F)C(F)(F)[C@]([C@@](C1(F)F)(F)Cl)(F)Cl 0.51 1.0 Compound_160 CCCC[Sn](N(C)C)(CCCC)CCCC 0.59 1.0 Compound_161 O=C(C(Cl)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F 0.82 1.0 Compound_162 CC[N+](CCC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(CC)CC 0.63 1.0 Compound_163 Cc1cccc(c1)C(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.82 1.0 Compound_164 Cc1ccccc1C(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.8 1.0 Compound_165 CC[N+](CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(CC)CC 0.66 1.0 Compound_166 O=C(C(Cl)(F)F)c1cc(ccc1C(F)(F)F)C(F)(F)F 0.77 1.0 Compound_167 CC(Cc1ccc(cc1)C(=O)C(C(C(F)(F)F)(F)F)(F)F)C 0.81 1.0 Compound_168 O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)c1ccc(cc1)C 0.82 1.0 Compound_169 O=C(C(Cl)(F)F)c1ccc(cc1C(F)(F)F)C(F)(F)F 0.77 1.0 Compound_170 C[Si](C(=C=C([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)(C)C 0.6 1.0 Compound_171 CCCC[Sn](C=C=C)(CCCC)CCCC 0.87 1.0 Compound_172 FC(CCCCCCCCCCCCCCC(F)(F)F)(F)F 0.72 1.0 Compound_173 CCCCCCCCCC/C=C/C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_174 OCCCCCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.86 1.0 Compound_175 CCCCCCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.77 1.0 Compound_176 CCCCCCCCCC/C=C\C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_177 CCCCCCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_178 FC(C(F)(F)F)(CCCCCCCC(C(F)(F)F)(F)F)F 0.72 1.0 Compound_179 COC(=O)C(OC(C(OC(C(=O)OC)(F)F)(F)F)(F)F)(F)F 0.58 1.0 Compound_180 FC([C@]1(N)N[C@@](N)(C(F)(F)F)C(C(C1(F)F)(F)F)(F)F)(F)F 0.33 0.0 Compound_181 FC([C@@]1(N)N[C@](N)(C(F)(F)F)C(C(C1(F)F)(F)F)(F)F)(F)F 0.33 0.0 Compound_182 FC([C@]1(N)N[C@](N)(C(F)(F)F)C(C(C1(F)F)(F)F)(F)F)(F)F 0.33 0.0 Compound_183 O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)N1CCN2[C@H](C1)CCC2 0.07 0.0 Compound_184 O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)N1CCN2[C@@H](C1)CCC2 0.07 0.0 Compound_185 CCC(=O)CC(=O)C(C(C(C(C(=O)OC)(F)F)(F)F)(F)F)(F)F 0.62 1.0 Compound_186 CC(O[Sn](OC(C)C)(OC(C)C)OC(C)C)C 0.72 1.0 Compound_187 O=C([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)OS(=O)(=O)C 0.56 1.0 Compound_188 CC(NC(=O)C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F)C 0.62 1.0 Compound_189 O=C(C(F)(F)F)CC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.69 1.0 Compound_190 CC(=O)N1C[C@H](C(=C)C1)CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.4 0.0 Compound_191 CC(=O)CC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.69 1.0 Compound_192 C=CC(=O)OCC1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F 0.75 1.0 Compound_193 C[Si](C#Cc1nc(C#C[Si](C)(C)C)nc(n1)C#C[Si](C)(C)C)(C)C 0.48 0.0 Compound_194 CC(=O)N1C[C@@H](C(=C)C1)CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.4 0.0 Compound_195 O=C(C([C@]1(F)OC(C(C1(F)F)(F)F)(F)F)(F)F)N1CCCCCC1 0.26 0.0 Compound_196 O=C(C([C@@]1(F)OC(C(C1(F)F)(F)F)(F)F)(F)F)N1CCCCCC1 0.26 0.0 Compound_197 CC(C(C(C)C)OB(OC(C(C)C)C(C)C)OC(C(C)C)C(C)C)C 0.7 1.0 Compound_198 FC(CC(C(F)(F)F)(C(F)(F)F)I)(F)F 0.92 1.0 Compound_199 FC(C(F)(F)F)(N(C(C(F)(F)F)(F)F)C(C(F)(F)F)(F)F)F 0.52 1.0 Compound_200 FC(C(F)(F)F)(C(F)(F)F)c1ccc(cc1)I 0.94 1.0 Compound_201 CCCC[Sn]([Si](C)(C)C)(CCCC)CCCC 0.85 1.0 Compound_202 CCCC[Sn](CC=C(C)C)(CCCC)CCCC 0.79 1.0 Compound_203 CCCC[Sn](C(=C)OCC)(CCCC)CCCC 0.84 1.0 Compound_204 CCCC[Sn](OC(=O)CC)(CCCC)CCCC 0.93 1.0 Compound_205 C[Si](C(=C=CC=C=C([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)(C)C 0.6 1.0 Compound_206 CC(N(P(OCC[Si](C)(C)C)OCC[Si](C)(C)C)C(C)C)C 0.55 1.0 Compound_207 CC([Si]([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)(C)C)(C)C 0.55 1.0 Compound_208 CCCC[Sn](C(F)(F)F)(CCCC)CCCC 0.89 1.0 Compound_209 CC[Si](c1cc(c(c(c1F)F)F)[Si](CC)(CC)CC)(CC)CC 0.71 1.0 Compound_210 CCCC[Sn](/C(=C/F)/F)(CCCC)CCCC 0.8 1.0 Compound_211 C[Si](N([Si](C)(C)C)SN([Si](C)(C)C)[Si](C)(C)C)(C)C 0.59 1.0 Compound_212 CCCC[Sn](CCCC)(CCCC)COCC=C 0.83 1.0 Compound_213 FC(/C=C/C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.59 1.0 Compound_214 CCCCCCCCCCC/C=C/C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_215 FC(C(/C=C\C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.59 1.0 Compound_216 FC(C(F)(F)F)(CCCCCCCCC(C(F)(F)F)(F)F)F 0.72 1.0 Compound_217 CCCCCCCCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.77 1.0 Compound_218 FC(/C=C\C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.59 1.0 Compound_219 CCCCCCCCCCCC/C=C/C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_220 CCCCCCCCCCC/C=C\C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_221 FC(=C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F)F 0.71 1.0 Compound_222 FC(CCC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.63 1.0 Compound_223 CCCCCCCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.77 1.0 Compound_224 FC(C(C(F)(F)F)(F)F)(/C=C/C(C(C(F)(F)F)(F)F)(F)F)F 0.59 1.0 Compound_225 CCCCCCCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_226 FC(C(CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.63 1.0 Compound_227 FC(C(/C=C/C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.59 1.0 Compound_228 FC(C(F)(F)F)(CCCCCCCCCC(C(F)(F)F)(F)F)F 0.72 1.0 Compound_229 CCCC[Sn](C#CC1CC1)(CCCC)CCCC 0.89 1.0 Compound_230 FC(C(C(F)(F)F)(F)F)(/C=C\C(C(C(F)(F)F)(F)F)(F)F)F 0.59 1.0 Compound_231 FC(C(C(F)(F)F)(F)F)(CCC(C(C(F)(F)F)(F)F)(F)F)F 0.63 1.0 Compound_232 CCCCCCCCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_233 CCCCCCCCCCCC/C=C\C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_234 FC(C(C(F)(F)F)(F)F)(CNCC(C(C(F)(F)F)(F)F)(F)F)F 0.63 1.0 Compound_235 FC(C(C(C(C(I)(F)F)(F)F)(F)F)(F)F)(F)F 0.96 1.0 Compound_236 NCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.61 1.0 Compound_237 OCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.91 1.0 Compound_238 N#CC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.59 1.0 Compound_239 OCCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.85 1.0 Compound_240 FC(C(C(C(F)(F)F)(C(F)(F)F)C[C@@H]1OC1)(F)F)(C(F)(F)F)F 0.6 1.0 Compound_241 FC(C(C(C(F)(F)F)(C(F)(F)F)C[C@H]1OC1)(F)F)(C(F)(F)F)F 0.6 1.0 Compound_242 CCCC[Sn](C[Si](C)(C)C)(CCCC)CCCC 0.83 1.0 Compound_243 C[Si]([Si]([Si](C)(C)C)([Si](C)(C)C)NC12CC3CC(C2)CC(C1)C3)(C)C 0.29 0.0 Compound_244 CCCC[Sn](C#CC(F)(F)F)(CCCC)CCCC 0.88 1.0 Compound_245 FC(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F 0.5 0.0 Compound_246 CCCC[Sn](C#C[Si](C)(C)C)(CCCC)CCCC 0.82 1.0 Compound_247 CCc1cc(ccc1Cl)C(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.8 1.0 Compound_248 O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)c1ccc(cc1)C(F)(F)F 0.78 1.0 Compound_249 O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)c1cc(C)c(c(c1)C)Cl 0.8 1.0 Compound_250 O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)c1ccccc1C(F)(F)F 0.75 1.0 Compound_251 FC(C(F)(F)F)(CCCCCCCCCCC(C(F)(F)F)(F)F)F 0.72 1.0 Compound_252 O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)c1cccc(c1)C(F)(F)F 0.78 1.0 Compound_253 OCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(C(F)(F)F)C(F)(F)F 0.81 1.0 Compound_254 N#CCCC(C(C(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.6 1.0 Compound_255 CCCCCCCCCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_256 FC(C(F)(F)F)(CCCCCCCCCCCC(C(F)(F)F)(F)F)F 0.72 1.0 Compound_257 CCCCCCCCCCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_258 CCCCCCCCCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.77 1.0 Compound_259 FC(CCCOB(OCCCC(F)(F)F)OCCCC(F)(F)F)(F)F 0.95 1.0 Compound_260 CCCC[Sn](C(=C)C(F)(F)F)(CCCC)CCCC 0.8 1.0 Compound_261 O=C([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)C12CC3CC(C2)CC(C1)C3 0.71 1.0 Compound_262 C[C@@H]([C@H](O[Si](C(C)(C)C)(C)C)CCCCO[Si](C(C)(C)C)(C)C)C(=O)O 0.62 1.0 Compound_263 C[Si](N([Si](C)(C)C)CCCCCCN([Si](C)(C)C)[Si](C)(C)C)(C)C 0.48 0.0 Compound_264 CCCCC[Sn](CCCCC)(CCCCC)CCCCC 0.96 1.0 Compound_265 CCCCCCCCCCCCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_266 FC(C(F)(F)F)(CCCCCCCCCCCCCC(C(F)(F)F)(F)F)F 0.72 1.0 Compound_267 CCCCCCCCCCCCCCC/C=C\C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_268 CCCCCCCCCCCCCCC/C=C/C(C(C(F)(F)F)(F)F)(F)F 0.75 1.0 Compound_269 CCCCCCCCC/C=C/C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.75 1.0 Compound_270 CCCCCC/C=C\[Sn](CCCC)(CCCC)CCCC 0.9 1.0 Compound_271 CCCCCCCC/C=C/C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.75 1.0 Compound_272 CCCCCCCCCCCCCCCCCC(C(C(F)(F)F)(F)F)(F)F 0.77 1.0 Compound_273 F/C(=C(\C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)/F)/C(F)(F)F 0.69 1.0 Compound_274 CCCCCCCCC/C=C\C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.75 1.0 Compound_275 FC(=C(C(C(C(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)F 0.82 1.0 Compound_276 CCCCCCCC/C=C\C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.75 1.0 Compound_277 FC(C(F)(F)F)(CCCCCCCCCCCCC(C(F)(F)F)(F)F)F 0.72 1.0 Compound_278 FC(C(C(F)(F)F)(F)F)(CCCCCC(C(C(F)(F)F)(F)F)(F)F)F 0.72 1.0 Compound_279 FC(C(C(F)(F)F)(F)F)(CCCCCCC(C(C(F)(F)F)(F)F)(F)F)F 0.72 1.0 Compound_280 BrC(=C)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.76 1.0 Compound_281 C[Si](C#C[Si](C#C[Si](C)(C)C)(C#C[Si](C)(C)C)C#C[Si](C)(C)C)(C)C 0.58 1.0 Compound_282 FC(COCCOB(OCCOCC(F)(F)F)OCCOCC(F)(F)F)(F)F 0.9 1.0 Compound_283 C[C@H]1CN(CCN1CC(F)(F)F)CC1(CCC1)CN1CCN([C@H](C1)C)CC(F)(F)F 0.07 0.0 Compound_284 C[C@@H]1CN(CCN1CC(F)(F)F)CC1(CCC1)CN1CCN([C@@H](C1)C)CC(F)(F)F 0.07 0.0 Compound_285 C[C@@H]1CN(CCN1CC(F)(F)F)CC1(CCC1)CN1CCN([C@H](C1)C)CC(F)(F)F 0.07 0.0 Compound_286 C[Si](N([Si](C)(C)C)[Sn]N([Si](C)(C)C)[Si](C)(C)C)(C)C 0.59 1.0 Compound_287 F[C@@]1(OC1(F)F)C(C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F)(F)F 0.59 1.0 Compound_288 F[C@]1(OC1(F)F)C(C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F)(F)F 0.59 1.0 Compound_289 CCCCCCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.77 1.0 Compound_290 CCCCCCCCCC/C=C\C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.75 1.0 Compound_291 FC(C(F)(F)F)(CCCCCCCCCCCCCCC(C(F)(F)F)(F)F)F 0.72 1.0 Compound_292 FC(C(C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(F)(F)F)(F)F 0.52 1.0 Compound_293 CCCCCCCCCCCCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.77 1.0 Compound_294 CCCCCCCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.77 1.0 Compound_295 FC(C(C(F)(F)F)(F)F)(CCCCCCCC(C(C(F)(F)F)(F)F)(F)F)F 0.72 1.0 Compound_296 CCCCCCCCCCCCC/C=C/C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.75 1.0 Compound_297 CCCCCCCCCC/C=C/C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.75 1.0 Compound_298 FC(CCCCOC(OCCCCC(F)(F)F)OCCCCC(F)(F)F)(F)F 0.82 1.0 Compound_299 CCCCCCC/C=C/C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.75 1.0 Compound_300 CCCCCCC/C=C\C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 0.75 1.0 Compound_301 FC(CCCCOB(OCCCCC(F)(F)F)OCCCCC(F)(F)F)(F)F 0.93 1.0 Compound_302 CCCCCCCCCCCCC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F 0.77 1.0 Compound_303 CCCCCCCCCCCCC/C=C\C(C(C(C(F)(F)F)(F)F)(F)F)(F)F 0.75 1.0 Compound_304 O=C(C(C(C(F)(F)F)(F)F)(F)F)NCCCNC(=O)C(C(C(F)(F)F)(F)F)(F)F 0.31 0.0 Compound_305 CN(CC[Sn](Cl)(C)C)CC[Sn](Cl)(C)C 0.53 1.0 Compound_306 O=C(C(C(C(F)(F)F)(F)F)(F)F)NCCCCNC(=O)C(C(C(F)(F)F)(F)F)(F)F 0.29 0.0