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CCCCCCCOC[C@H]1COCCO1 34a_100009875890_100000210614 [1,0,0,0,0,0|2,0,1]=4 128 B15R1.35 CCCCCCCSCC1CCCCC1 62a_100000210614_100000211423 [1,0,0,0,0,0|2,0,1]=4 129 B15R1.35 CCCCCCCSCC1CCCCC1 62a_100000211423_100000210316 [1,0,0,0,0,0|2,0,1]=4 130 B15R1.35 CCCCCCCSCC1CCCCO1 62a_100000210614_100000211543 [1,0,0,0,0,0|1,0,1]=3 131 B15R1.35 CCCCCCCSCC1CCCCO1 62a_100000211543_100000210316 [1,0,0,0,0,0|1,0,1]=3 132 B15R1.35 CCCCCCCSCC1CCCOC1 62a_100000210614_100000741521 [1,0,0,0,0,0|3,0,0]=4 133 B15R1.35 CCCCCCCSCC1CCCOC1 62a_100000741521_100000210316 [1,0,0,0,0,0|3,0,0]=4 134 B15R1.35 CCCCCCNCCC1CCCCC1 2230a_100000210581_100012355289 [1,0,0,0,0,0|2,0,1]=4 135 B15R1.35 CCCCCCNCCC1CCCCC1 2230a_100000738074_100000210314 [1,0,0,0,0,0|2,0,1]=4 136 B15R1.35 CCCCCCNCCC1CCCCC1 270004a_100000210581_100011713444 [1,0,0,0,0,0|2,0,1]=4 137 B15R1.35 CCCCCCNCCC1CCCCC1 34a_100000738074_100000210314 [1,0,0,0,0,0|2,0,1]=4 138 B15R1.35 CCCCCCNCCC1CCCCO1 2230a_100015183643_100000210314 [1,0,0,0,0,0|1,0,1]=3 139 B15R1.35 CCCCCCNCCC1CCCCO1 34a_100015183643_100000210314 [1,0,0,0,0,0|1,0,1]=3 140 B15R1.35 CCCCCCNCCC1OCCCO1 2230a_100000210581_100000764188 [1,0,0,0,0,0|2,0,1]=4 141 B15R1.35 CCCCCCOCCC1CCCCC1 34a_100000210259_100011209188 [1,0,0,0,0,0|2,0,1]=4 142 B15R1.35 CCCCCCOCCC1CCCCC1 34a_100011217863_100000210314 [1,0,0,0,0,0|2,0,1]=4 143 B15R1.35 CCCCCCOCCC1CCCCC1 7a_100000210259_100011273959 [1,0,0,0,0,0|2,0,1]=4 144 B15R1.35 CCCCCCOCCC1CCCCC1 7a_100011217863_100000210314 [1,0,0,0,0,0|2,0,1]=4 145 B15R1.35 CCCCCCOCCC1CCCCN1 34a_100000211664_100000210314 [1,0,0,0,0,0|2,0,1]=4 146 B15R1.35 CCCCCCOCCC1CCCNC1 34a_100000752241_100000210314 [1,0,0,0,0,0|3,0,0]=4 147 B15R1.35 CCCCCCOCCC1OCCCO1 34a_100000210259_100000764188 [1,0,0,0,0,0|2,0,1]=4 148 B15R1.35 CCCCCCOCCC1OCCCO1 7a_100000210259_100000764188 [1,0,0,0,0,0|2,0,1]=4 149 B15R1.35 CCCCCCSCCC1CCCCC1 62a_100000210314_100012355289 [1,0,0,0,0,0|2,0,1]=4 150 B15R1.35 CCCCCCSCCC1CCCCC1 62a_100012355289_100000210757 [1,0,0,0,0,0|2,0,1]=4 151 B15R1.35 CCCCCCSCCC1OCCCO1 62a_100000210314_100000764188 [1,0,0,0,0,0|2,0,1]=4 152 B15R1.35 CCCCCCSCCC1OCCCO1 62a_100000764188_100000210757 [1,0,0,0,0,0|2,0,1]=4 153 B15R1.35 CCCCCNCCCC1CCCCC1 2230a_100000209983_100011713725 [1,0,0,0,0,0|2,0,1]=4 154 B15R1.35 CCCCCNCCCC1CCCCC1 2230a_100011211642_100000210326 [1,0,0,0,0,0|2,0,1]=4 155 B15R1.35 CCCCCNCCCC1CCCCC1 34a_100011211642_100000718602 [1,0,0,0,0,0|2,0,1]=4 156 B15R1.35 CCCCCNCCOC1CCCCO1 2230a_100000209983_100000744793 [1,0,0,0,0,0|2,0,1]=4 157 B15R1.35 CCCCCOCCCC1CCCCC1 34a_100000198086_100000718602 [1,0,0,0,0,0|2,0,1]=4 158 B15R1.35 CCCCCOCCCC1CCCCC1 34a_100000210253_100011713725 [1,0,0,0,0,0|2,0,1]=4 159 B15R1.35 CCCCCOCCCC1CCCCC1 7a_100000198086_100000210326 [1,0,0,0,0,0|2,0,1]=4 160 B15R1.35 CCCCCOCCCC1CCCCC1 7a_100000210253_100011713725 [1,0,0,0,0,0|2,0,1]=4 161 B15R1.35 CCCCCOCCCC1CCCCN1 34a_100011934581_100000718602 [1,0,0,0,0,0|2,0,1]=4 162 B15R1.35 CCCCCOCCCC1CCCNC1 34a_100150707839_100000718602 [1,0,0,0,0,0|3,0,0]=4 163 B15R1.35 CCCCCOCCOC1C=CCCC1 7a_100011215259_100000751183 [1,0,0,0,0,0|3,0,0]=4 164 B15R1.35 CCCCCOCCOC1CCCCO1 34a_100000034223_100000718602 [1,0,0,0,0,0|2,0,1]=4 165 B15R1.35 CCCCCOCCOC1CCCCO1 34a_100000210253_100000744793 [1,0,0,0,0,0|2,0,1]=4 166 B15R1.35 CCCCCOCCOC1CCCCO1 7a_100000034223_100000210326 [1,0,0,0,0,0|2,0,1]=4 167 B15R1.35 CCCCCOCCOC1CCCCO1 7a_100000210253_100000744793 [1,0,0,0,0,0|2,0,1]=4 168 B15R1.35 CCCCCSCCCC1CCCCC1 62a_100000210326_100011713725 [1,0,0,0,0,0|2,0,1]=4 169 B15R1.35 CCCCCSCCCC1CCCCC1 62a_100011713725_100000210326 [1,0,0,0,0,0|2,0,1]=4 170 B15R1.35 CCCCCSCCOC1CCCCO1 62a_100000210326_100000744793 [1,0,0,0,0,0|2,0,1]=4 171 B15R1.35 CCCCCSCCOC1CCCCO1 62a_100000744793_100000210326 [1,0,0,0,0,0|2,0,1]=4 172 B15R1.35 CCCCNCCCOC1CCCCO1 2230a_100000102301_100000700653 [1,0,0,0,0,0|2,0,1]=4 173 B15R1.35 CCCCNCCCOC1CCCCO1 7a_106832991798_100000700653 [1,0,0,0,0,0|2,0,1]=4 174 B15R1.35 CCCCOCCCCC1CCCCC1 34a_100011215267_100000210210 [1,0,0,0,0,0|2,0,1]=4 175 B15R1.35 CCCCOCCCCC1CCCCC1 7a_100011215267_100000210211 [1,0,0,0,0,0|2,0,1]=4 176 B15R1.35 CCCCOCCCNC1C=CCCC1 2230a_200000211371_100000751183 [1,0,0,0,0,0|3,0,0]=4 177 B15R1.35 CCCCOCCCOC1C=CCCC1 7a_200011215613_100000751183 [1,0,0,0,0,0|3,0,0]=4 178 B15R1.35 CCCCOCCCOC1CCCCO1 34a_100000210227_100000700653 [1,0,0,0,0,0|2,0,1]=4 179 B15R1.35 CCCCOCCCOC1CCCCO1 7a_100000210227_100000700653 [1,0,0,0,0,0|2,0,1]=4 180 B15R1.35 CCCCOCCNCC1CCCCO1 2230a_100000174945_100000743108 [1,0,0,0,0,0|2,0,1]=4 181 B15R1.35 CCCCOCCNCC1CCCCO1 34a_100000174945_100000743108 [1,0,0,0,0,0|2,0,1]=4 182 B15R1.35 CCCCOCCOCC1CCC=CO1 34a_100011217868_100000743108 [1,0,0,0,0,0|2,0,1]=4 183 B15R1.35 CCCCOCCOCC1CCCCO1 34a_100000210238_100000211543 [1,0,0,0,0,0|2,0,1]=4 184 B15R1.35 CCCCOCCOCC1CCCCO1 34a_100000211370_100000743108 [1,0,0,0,0,0|2,0,1]=4 185 B15R1.35 CCCCOCCOCC1CCCCO1 7a_100000210238_100000211543 [1,0,0,0,0,0|2,0,1]=4 186 B15R1.35 CCCCOCCOCC1CCCCO1 7a_100000211370_100000743108 [1,0,0,0,0,0|2,0,1]=4 187 B15R1.35 CCCCOCCSCC1CCCCO1 62a_100000211543_100000743108 [1,0,0,0,0,0|2,0,1]=4 188 B15R1.35 CCCCOCCSCC1CCCCO1 62a_100000743108_100000211543 [1,0,0,0,0,0|2,0,1]=4 189 B15R1.35 CCCCOCNCCC1CCCCO1 2230a_100015183643_100011995733 [1,0,0,0,0,0|2,0,1]=4 190 B15R1.35 CCCCOCNCCC1CCCCO1 34a_100015183643_100011995733 [1,0,0,0,0,0|2,0,1]=4 191 B15R1.35 CCCCSCCCOC1CCCCO1 62a_100000210211_100000700653 [1,0,0,0,0,0|2,0,1]=4 192 B15R1.35 CCCCSCCCOC1CCCCO1 62a_100000700653_100000210210 [1,0,0,0,0,0|2,0,1]=4 193 B15R1.35 CCCCSCCNCC1CCCCO1 2230a_100025743550_100000211543 [1,0,0,0,0,0|2,0,1]=4 194 B15R1.35 CCCCSCCOCC1CCCCO1 34a_200000230436_100000211543 [1,0,0,0,0,0|2,0,1]=4 195 B15R1.35 CCCCSCCOCC1CCCCO1 7a_200000230436_100000211543 [1,0,0,0,0,0|2,0,1]=4 196 B15R1.35 CCCOCCCCOC1CCCCO1 34a_100000210258_100000031530 [1,0,0,0,0,0|2,0,1]=4 197 B15R1.35 CCCOCCCNCC1CCCCO1 2230a_100011217757_100000211543 [1,0,0,0,0,0|2,0,1]=4 198 B15R1.35 CCCOCCCNCC1CCCCO1 34a_100011217757_100000211543 [1,0,0,0,0,0|2,0,1]=4 199 B15R1.35 CCCOCCNCCC1CCCCO1 2230a_100015183643_100011215938 [1,0,0,0,0,0|2,0,1]=4 200 B15R1.35 CCCOCCNCCC1CCCCO1 34a_100015183643_100011215938 [1,0,0,0,0,0|2,0,1]=4 201 B15R1.35 CCCSCCCCOC1CCCCO1 62a_100000031530_100000210303 [1,0,0,0,0,0|2,0,1]=4 202 B15R1.35 CCCSCCCCOC1CCCCO1 62a_100000210303_100000031530 [1,0,0,0,0,0|2,0,1]=4 203 B15R1.35 CCOCCCNCCC1CCCCO1 2230a_100015183643_100012232248 [1,0,0,0,0,0|2,0,1]=4 204 B15R1.35 CCOCCCNCCC1CCCCO1 34a_100015183643_100012232248 [1,0,0,0,0,0|2,0,1]=4 205 B15R1.35 CNCCCCCCOC1CCCCO1 2230a_106832991635_100000033462 [1,0,0,0,0,0|2,0,1]=4 206 B15R1.35 CNCCCCCCOC1CCCCO1 34a_100102657272_100000033462 [1,0,0,0,0,0|2,0,1]=4 207 B15R1.35 CNCCCCCCOC1CCCCO1 7a_106832991635_100000033462 [1,0,0,0,0,0|2,0,1]=4 208 B15R1.35 CNCCCCCOCC1CCCCO1 34a_100000722520_100000211543 [1,0,0,0,0,0|2,0,1]=4 209 B15R1.35 COCCCCCCOC1C=CCCC1 34a_100011215024_100011998445 [1,0,0,0,0,0|3,0,0]=4 210 B15R1.35 COCCCCCCOC1C=CCCC1 7a_200012092642_100000751183 [1,0,0,0,0,0|3,0,0]=4 211 B15R1.35 COCCCCCCOC1CCCCO1 34a_100000033831_100011998445 [1,0,0,0,0,0|2,0,1]=4 212 B15R1.35 COCCCCCCOC1CCCCO1 34a_100138415774_100000033462 [1,0,0,0,0,0|2,0,1]=4 213 B15R1.35 COCCCCCCSC1C=CCCC1 62a_100000751183_100011998445 [1,0,0,0,0,0|3,0,0]=4 214 B15R1.35 COCCCCCCSC1C=CCCC1 62a_100011998445_100000751183 [1,0,0,0,0,0|3,0,0]=4 215 B15R1.35 COCCCCCNCC1CCCCO1 2230a_100000747528_100000211543 [1,0,0,0,0,0|2,0,1]=4 216 B15R1.35 COCCCCCNCC1CCCCO1 34a_100000747528_100000211543 [1,0,0,0,0,0|2,0,1]=4 217 B15R1.35 COCCCCNCCC1CCCCO1 2230a_100015183643_100000730899 [1,0,0,0,0,0|2,0,1]=4 218 B15R1.35 COCCCCNCCC1CCCCO1 34a_100015183643_100000755781 [1,0,0,0,0,0|2,0,1]=4 219 B15R1.35 CSCCCCCCOC1CCCCO1 62a_100000033462_200000210301 [1,0,0,0,0,0|2,0,1]=4 220 B15R1.35 CSCCCCCCOC1CCCCO1 62a_200000210301_100000033462 [1,0,0,0,0,0|2,0,1]=4 221 B15R1.35 ClCCCCCCOCC1CCCCO1 34a_100000766143_100000211543 [1,0,0,0,0,0|2,0,1]=4 222 B15R1.35 ClCCCCCCOCC1CCCCO1 7a_100000766143_100000211543 [1,0,0,0,0,0|2,0,1]=4 223 B15R1.35 FCCCCCCNCC1CCCCO1 2230a_100000174945_100015922095 [1,0,0,0,0,0|2,0,1]=4 224 B15R1.35 FCCCCCCNCC1CCCCO1 34a_100000174945_100015922095 [1,0,0,0,0,0|2,0,1]=4 225 B15R1.35 FCCCCCCOCC1CCC=CO1 34a_100011217868_100015922095 [1,0,0,0,0,0|2,0,1]=4 226 B15R1.35 FCCCCCCOCC1CCCCO1 34a_100000211370_100015922095 [1,0,0,0,0,0|2,0,1]=4 227 B15R1.35 FCCCCCCOCC1CCCCO1 34a_100000732779_100000211543 [1,0,0,0,0,0|2,0,1]=4 228 B15R1.35 FCCCCCCOCC1CCCCO1 7a_100000211370_100015922095 [1,0,0,0,0,0|2,0,1]=4 229 B15R1.35 FCCCCCCOCC1CCCCO1 7a_100000732779_100000211543 [1,0,0,0,0,0|2,0,1]=4 230 B15R1.35 FCCCCCCSCC1CCCCO1 62a_100000211543_100015922095 [1,0,0,0,0,0|2,0,1]=4 231 B15R1.35 FCCCCCCSCC1CCCCO1 62a_100015922095_100000211543 [1,0,0,0,0,0|2,0,1]=4 232 B15R1.35 FCCCCCNCCC1CCCCO1 2230a_100015183643_100000729378 [1,0,0,0,0,0|2,0,1]=4 233 B15R1.35 FCCCCCNCCC1CCCCO1 34a_100015183643_100000729378 [1,0,0,0,0,0|2,0,1]=4 234 B15R1.35 NCCCCCCOCC1CCCCO1 34a_100000686447_100000211543 [1,0,0,0,0,0|2,0,1]=4 235 B15R1.35 OCCCCCCCNC1C=CCCC1 2230a_100011996573_100000751183 [1,0,0,0,0,0|3,0,0]=4 236 B15R1.35 OCCCCCCCOC1C=CCCC1 34a_100011215024_100000760002 [1,0,0,0,0,0|3,0,0]=4 237 B15R1.35 OCCCCCCCOC1CCCCO1 34a_100000033831_100000760002 [1,0,0,0,0,0|2,0,1]=4 238 B15R1.35 OCCCCCCCSC1C=CCCC1 62a_100000751183_100000760002 [1,0,0,0,0,0|3,0,0]=4 239 B15R1.35 OCCCCCCCSC1C=CCCC1 62a_100000760002_100000751183 [1,0,0,0,0,0|3,0,0]=4 240 B15R1.35 OCCCCCCNCC1CCCCO1 2230a_100000174945_100000766143 [1,0,0,0,0,0|2,0,1]=4 241 B15R1.35 OCCCCCCNCC1CCCCO1 2230a_100000686447_100000211543 [1,0,0,0,0,0|2,0,1]=4 242 B15R1.35 OCCCCCCNCC1CCCCO1 34a_100000174945_100000766143 [1,0,0,0,0,0|2,0,1]=4 243 B15R1.35 OCCCCCCNCC1CCCCO1 34a_100000686447_100000211543 [1,0,0,0,0,0|2,0,1]=4 244 B15R1.35 OCCCCCCOCC1CCC=CO1 34a_100011217868_100000766143 [1,0,0,0,0,0|2,0,1]=4 245 B15R1.35 OCCCCCCOCC1CCCCO1 34a_100000211370_100000766143 [1,0,0,0,0,0|2,0,1]=4 246 B15R1.35 OCCCCCCOCC1CCCCO1 7a_100000211370_100000766143 [1,0,0,0,0,0|2,0,1]=4 247 B15R1.35 OCCCCCCSCC1CCCCO1 62a_100000211543_100000766143 [1,0,0,0,0,0|2,0,1]=4 248 B15R1.35 OCCCCCCSCC1CCCCO1 62a_100000766143_100000211543 [1,0,0,0,0,0|2,0,1]=4 249 B15R1.35 OCCCCCNCCC1CCCCO1 2230a_100015183643_100000746330 [1,0,0,0,0,0|2,0,1]=4 250 B15R1.35 OCCCCCNCCC1CCCCO1 34a_100015183643_100000746330 [1,0,0,0,0,0|2,0,1]=4 251 B15R1.35 [13CH3]SCCCCCCOC1CCCCO1 62a_100000033462_200025704644 [1,0,0,0,0,0|2,0,1]=4 252 B15R1.35 [13CH3]SCCCCCCOC1CCCCO1 62a_200025704644_100000033462 [1,0,0,0,0,0|2,0,1]=4 253 B15R1.106 CCCCCCCCN1CCNC(=O)C1 2230a_100000184651_100000210759 [1,0,0,0,0,0|3,0,0]=4 254 B15R1.106 CCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100000210759 [1,0,0,0,0,0|3,0,0]=4 255 B15R1.106 CCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210681 [1,0,0,0,0,0|3,0,0]=4 256 B15R1.106 CCCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210614 [1,0,0,0,0,0|3,0,0]=4 257 B15R1.106 CCCCCCCOC1C=C(CCC1)C 34a_100011218613_100000210614 [1,0,0,0,0,0|3,0,0]=4 258 B15R1.106 CCCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210614 [1,0,0,0,0,0|2,0,0]=3 259 B15R1.106 CCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210614 [1,0,0,0,0,0|3,0,0]=4 260 B15R1.106 CCCCCCOCC1CCCC(=O)N1 34a_200000102386_100000210314 [1,0,0,0,0,0|2,0,0]=3 261 B15R1.106 CCCCCCOCC1CCNC(=O)C1 34a_100009886756_100000210314 [1,0,0,0,0,0|3,0,0]=4 262 B15R1.106 CCCCCCOCC1COCC(=O)N1 34a_200000101122_100000210314 [1,0,0,0,0,0|3,0,0]=4 263 B15R1.106 CCCCOCCOC1CCCC(=O)C1 34a_100012613340_100000743108 [1,0,0,0,0,0|3,0,0]=4 264 B15R1.106 CCCCOCOCC1CCCC(=O)N1 34a_200000102386_100011995733 [1,0,0,0,0,0|3,0,0]=4 265 B15R1.106 CCCOCCOCC1CCCC(=O)N1 34a_200000102386_100011215938 [1,0,0,0,0,0|3,0,0]=4 266 B15R1.106 CCOCCCOCC1CCCC(=O)N1 34a_200000102386_100012232248 [1,0,0,0,0,0|3,0,0]=4 267 B15R1.106 COCCCCOCC1CCCC(=O)N1 34a_200000102386_100000755781 [1,0,0,0,0,0|3,0,0]=4 268 B15R1.106 O=C1CCCC(C1)OCCCCCCF 34a_100012613340_100015922095 [1,0,0,0,0,0|3,0,0]=4 269 B15R1.106 O=C1CCCC(C1)OCCCCCCO 34a_100012613340_100000766143 [1,0,0,0,0,0|3,0,0]=4 270 B15R1.106 O=C1CCCC(N1)COCCCCCF 34a_200000102386_100000729378 [1,0,0,0,0,0|3,0,0]=4 271 B15R1.106 O=C1CCCC(N1)COCCCCCO 34a_200000102386_100000746330 [1,0,0,0,0,0|3,0,0]=4 272 B17R1.23 CCCCCCCCCN1CCNC(=O)C1C 2230a_100000750721_100011214924 [0,1,0,0,0,0|3,0,0]=4 273 B17R1.23 CCCCCCCCCN1CCNC(=O)C1C 269982a_100000750721_100000210670 [0,1,0,0,0,0|3,0,0]=4 274 B17R1.23 CCCCCCCCCN1CCNC(=O)C1C 34a_100000750721_100011214924 [0,1,0,0,0,0|3,0,0]=4 275 B17R1.23 CCCCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210681 [0,1,0,0,0,0|2,0,0]=3 276 B17R1.23 CCCCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210614 [0,1,0,0,0,0|2,0,0]=3 277 B17R1.23 CCCCOCCNCC1CCCC(=O)N1C 2230a_200010383782_100000743108 [0,1,0,0,0,0|3,0,0]=4 278 B17R1.23 CCCCOCCNCC1CCCC(=O)N1C 34a_200010383782_100000743108 [0,1,0,0,0,0|3,0,0]=4 279 B17R1.23 CN1C(=O)CCCC1CNCCCCCCF 2230a_200010383782_100015922095 [0,1,0,0,0,0|3,0,0]=4 280 B17R1.23 CN1C(=O)CCCC1CNCCCCCCF 34a_200010383782_100015922095 [0,1,0,0,0,0|3,0,0]=4 281 B17R1.23 CN1C(=O)CCCC1CNCCCCCCO 2230a_200010383782_100000766143 [0,1,0,0,0,0|3,0,0]=4 282 B17R1.23 CN1C(=O)CCCC1CNCCCCCCO 34a_200010383782_100000766143 [0,1,0,0,0,0|3,0,0]=4 283 B17R1.40 CCCCCCCCC(=O)C1CCNC(=O)C1 1458a_100000132800_100000210759 [0,1,0,0,0,0|2,0,1]=4 284 B17R1.40 CCCCCCCCC(=O)C1CSCC(=O)N1 1458a_100000045068_100000210759 [0,1,0,0,0,0|2,0,1]=4 285 B17R1.40 CCCCCCCCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000210759 [0,1,0,0,0,0|1,0,1]=3 286 B17R1.40 CCCCCCCCC(C)N1CCNC(=O)C1 270004a_100000184651_100011216694 [0,1,0,0,0,0|3,0,0]=4 287 B17R1.40 CCCCCCCCC(C)N1CCOC(=O)C1 270004a_100000131268_100011216694 [0,1,0,0,0,0|3,0,0]=4 288 B17R1.40 CCCCCCCNC(=O)[C@H]1CCCC(=O)N1 240690a_100000229938_100000705292 [0,1,0,0,0,0|2,0,1]=4 289 B17R1.40 CCCCCCCNC(=O)[C@H]1CCCC(=O)N1 527a_100000229938_100000705292 [0,1,0,0,0,0|2,0,1]=4 290 B17R1.40 COCCCCCCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100011998445 [0,1,0,0,0,0|2,0,1]=4 291 B17R1.40 O=C1CCC[C@@H](N1)C(=O)CCCCCCCO 1458a_100000705292_100000760002 [0,1,0,0,0,0|2,0,1]=4 292 B17R1.716 C#CCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100153394163 [0,1,0,0,0,0|1,0,2]=4 293 B17R1.716 C#CCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100012276617 [0,1,0,0,0,0|1,0,2]=4 294 B17R1.716 C=CCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100012355270 [0,1,0,0,0,0|1,0,2]=4 295 B17R1.716 C=CCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100011215473 [0,1,0,0,0,0|1,0,2]=4 296 B17R1.716 CC1=CC(CCC1)OCCCCCCCCO 34a_100011218613_100000033203 [0,1,0,0,0,0|3,0,0]=4 297 B17R1.716 CCCCC#CCCCOC1CCCC(=O)C1 34a_100012613340_200000047210 [0,1,0,0,0,0|1,0,2]=4 298 B17R1.716 CCCCCC#CCOCC1CCCC(=O)N1 34a_200000102386_100009816472 [0,1,0,0,0,0|1,0,2]=4 299 B17R1.716 CCCCCCCCCCN1CCNC(=O)C1 2230a_100000184651_100000210320 [0,1,0,0,0,0|3,0,0]=4 300 B17R1.716 CCCCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100000210320 [0,1,0,0,0,0|3,0,0]=4 301 B17R1.716 CCCCCCCCCNC1CCCC(C1)C 2230a_100011194320_100011214924 [0,1,0,0,0,0|2,0,1]=4 302 B17R1.716 CCCCCCCCCNC1CCCC(C1)C 270004a_100000212291_100000183594 [0,1,0,0,0,0|2,0,1]=4 303 B17R1.716 CCCCCCCCCNC1CCCC(C1)C 34a_100011194320_100011214924 [0,1,0,0,0,0|2,0,1]=4 304 B17R1.716 CCCCCCCCCNC1CCCC(C1)O 2230a_100015190357_100011214924 [0,1,0,0,0,0|1,0,2]=4 305 B17R1.716 CCCCCCCCCNC1CCCC(C1)O 270004a_100000212291_100012613340 [0,1,0,0,0,0|1,0,2]=4 306 B17R1.716 CCCCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100011214924 [0,1,0,0,0,0|2,0,0]=3 307 B17R1.716 CCCCCCCCCNC1CCNC(=O)C1 34a_100016994916_100011214924 [0,1,0,0,0,0|2,0,0]=3 308 B17R1.716 CCCCCCCCCOC1C=C(CCC1)C 34a_100011218613_100011214924 [0,1,0,0,0,0|2,0,0]=3 309 B17R1.716 CCCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100011214924 [0,1,0,0,0,0|1,0,0]=2 310 B17R1.716 CCCCCCCCCOC1CCCC(C1)C 34a_100000211399_100011214924 [0,1,0,0,0,0|2,0,1]=4 311 B17R1.716 CCCCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100011214924 [0,1,0,0,0,0|2,0,0]=3 312 B17R1.716 CCCCCCCCNCC1CCCC(C1)O 2230a_100011254705_100000210759 [0,1,0,0,0,0|1,0,2]=4 313 B17R1.716 CCCCCCCCNCC1CCCN(C1)C 34a_100000229939_100015183302 [0,1,0,0,0,0|3,0,0]=4 314 B17R1.716 CCCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100000210759 [0,1,0,0,0,0|1,0,0]=2 315 B17R1.716 CCCCCCCCOCC1CCCN(C1)C 34a_100000210232_100015183302 [0,1,0,0,0,0|3,0,0]=4 316 B17R1.716 CCCCCCCCOCC1CCCN(C1)C 7a_100000210232_100000752043 [0,1,0,0,0,0|3,0,0]=4 317 B17R1.716 CCCCCCCCOCC1CCNC(=O)C1 34a_100009886756_100000210759 [0,1,0,0,0,0|2,0,0]=3 318 B17R1.716 CCCCCCCCOCC1COCC(=O)N1 34a_200000101122_100000210759 [0,1,0,0,0,0|2,0,0]=3 319 B17R1.716 CCCCCCCCSCC1CCCN(C1)C 62a_100000210759_100000752043 [0,1,0,0,0,0|3,0,0]=4 320 B17R1.716 CCCCCCCCSCC1CCCN(C1)C 62a_100000752043_100000210317 [0,1,0,0,0,0|3,0,0]=4 321 B17R1.716 CCCCCCNCCCN1CCNC(=O)C1 2230a_100000757908_100000210314 [0,1,0,0,0,0|3,0,0]=4 322 B17R1.716 CCOCCOCCOCC1CCCC(=O)N1 34a_200000102386_100011211534 [0,1,0,0,0,0|3,0,0]=4 323 B17R1.716 COCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100011998445 [0,1,0,0,0,0|2,0,0]=3 324 B17R1.716 COCCCCCCOCC1CCNC(=O)C1 34a_100009886756_100011998445 [0,1,0,0,0,0|3,0,0]=4 325 B17R1.716 COCCCCCCOCC1COCC(=O)N1 34a_200000101122_100011998445 [0,1,0,0,0,0|3,0,0]=4 326 B17R1.716 COCCOCCCOCC1CCCC(=O)N1 34a_200000102386_100011216529 [0,1,0,0,0,0|3,0,0]=4 327 B17R1.716 O=C1CC(CCN1)COCCCCCCCO 34a_100009886756_100000760002 [0,1,0,0,0,0|3,0,0]=4 328 B17R1.716 O=C1CC(CCN1)NCCCCCCCCO 2230a_100016994916_100000033203 [0,1,0,0,0,0|3,0,0]=4 329 B17R1.716 O=C1CC(CCN1)NCCCCCCCCO 34a_100016994916_100000033203 [0,1,0,0,0,0|3,0,0]=4 330 B17R1.716 O=C1CCCC(C1)OCCCCCCCCO 34a_100012613340_100000033203 [0,1,0,0,0,0|2,0,0]=3 331 B17R1.716 O=C1CCCC(N1)COCCCCCCCO 34a_200000102386_100000760002 [0,1,0,0,0,0|2,0,0]=3 332 B17R1.716 O=C1CN(CCN1)CCCCCCCCCO 2230a_100000184651_100009813782 [0,1,0,0,0,0|3,0,0]=4 333 B17R1.716 O=C1CN(CCO1)CCCCCCCCCO 2230a_100000131268_100009813782 [0,1,0,0,0,0|3,0,0]=4 334 B17R1.716 O=C1COCC(N1)COCCCCCCCO 34a_200000101122_100000760002 [0,1,0,0,0,0|3,0,0]=4 335 B17R1.716 O=C1C[C@@H](CCN1)OCCCCCCCCO 34a_100015189427_100000033203 [0,1,0,0,0,0|3,0,0]=4 336 B17R1.742 CCCCCCC(C)OCC1CCCC(=O)N1 34a_200000102386_100011215978 [0,1,0,0,0,0|2,0,0]=3 337 B17R1.742 CCCCCCC(C)OCC1CCNC(=O)C1 34a_100009886756_100011215978 [0,1,0,0,0,0|3,0,0]=4 338 B17R1.742 CCCCCCC(C)OCC1COCC(=O)N1 34a_200000101122_100011215978 [0,1,0,0,0,0|3,0,0]=4 339 B17R1.745 CCCCCCCC(C)NC1CCNC(=O)C1 2230a_100016994916_200011218727 [0,1,0,0,0,0|3,0,0]=4 340 B17R1.745 CCCCCCCC(C)NC1CCNC(=O)C1 34a_100016994916_200011218727 [0,1,0,0,0,0|3,0,0]=4 341 B17R1.745 CCCCCCCC(C)OC1C=C(CCC1)C 34a_100011218613_200011218727 [0,1,0,0,0,0|3,0,0]=4 342 B17R1.745 CCCCCCCC(C)OC1CCCC(=O)C1 34a_100012613340_200011218727 [0,1,0,0,0,0|2,0,0]=3 343 B17R1.745 CCCCCCCC(C)O[C@@H]1CCNC(=O)C1 34a_100015189427_200011218727 [0,1,0,0,0,0|3,0,0]=4 344 B17R1.1832 CCCCCC(=O)COCC1CCCC(=O)N1 34a_200000102386_200012276598 [0,1,0,0,0,0|2,0,1]=4 345 B17R1.10852 CCCCCCCCCN1CCN(C(=O)C1)C 2230a_100000187256_100011214924 [0,1,0,0,0,0|3,0,0]=4 346 B17R1.10852 CCCCCCCCCN1CCN(C(=O)C1)C 269982a_100000187256_100000210670 [0,1,0,0,0,0|3,0,0]=4 347 B17R1.10852 CCCCCCCCNC1CCN(C(=O)C1)C 2230a_100000126938_100000210759 [0,1,0,0,0,0|3,0,0]=4 348 B17R1.10852 CCCCCCCCNC1CCN(C(=O)C1)C 34a_100000126938_100000210759 [0,1,0,0,0,0|3,0,0]=4 349 B17R1.14399 CC(C)CCCCCOCC1CCCC(=O)N1 34a_200000102386_100000210682 [0,1,0,0,0,0|2,0,0]=3 350 B17R1.14399 CC(C)CCCCCOCC1CCNC(=O)C1 34a_100009886756_100000210682 [0,1,0,0,0,0|3,0,0]=4 351 B17R1.14399 CC(C)CCCCCOCC1COCC(=O)N1 34a_200000101122_100000210682 [0,1,0,0,0,0|3,0,0]=4 352 B15R0.164 C=C(Br)CCOCCCCCCCCCC 34a_100009813270_100000210320 [0,0,1,0,0,0|3,0,0]=4 353 B15R0.164 C=C(C)CCNCCCCCCCCCC 2230a_100000684558_100000730704 [0,0,1,0,0,0|3,0,0]=4 354 B15R0.164 C=C(C)CCNCCCCCCCCCC 34a_100000684558_100000730704 [0,0,1,0,0,0|3,0,0]=4 355 B15R0.164 C=C(C)CCOCCCCCCCCCC 34a_100000210711_100000730704 [0,0,1,0,0,0|3,0,0]=4 356 B15R0.164 C=C(C)CCOCCCCCCCCCC 34a_100000764851_100000210320 [0,0,1,0,0,0|3,0,0]=4 357 B15R0.164 C=C(C)CCOCCCCCCCCCC 7a_100000210711_100000730704 [0,0,1,0,0,0|3,0,0]=4 358 B15R0.164 C=C(C)CCSCCCCCCCCCC 62a_100000730704_100000210320 [0,0,1,0,0,0|3,0,0]=4 359 B15R0.164 C=C(C)CNCCCCCCCCCCC 2230a_200011215754_100000748629 [0,0,1,0,0,0|3,0,0]=4 360 B15R0.164 C=C(C)CNCCCCCCCCCCC 34a_200011215754_100000748629 [0,0,1,0,0,0|3,0,0]=4 361 B15R0.164 C=C(C)COCCCCCCCCCCC 34a_100000210245_100011215454 [0,0,1,0,0,0|3,0,0]=4 362 B15R0.164 C=C(C)COCCCCCCCCCCC 34a_100000210809_100000748629 [0,0,1,0,0,0|3,0,0]=4 363 B15R0.164 C=C(C)COCCCCCCCCCCC 7a_100000210809_100000748629 [0,0,1,0,0,0|3,0,0]=4 364 B15R0.164 C=C(C)CSCCCCCCCCCCC 62a_100000748629_100011215454 [0,0,1,0,0,0|3,0,0]=4 365 B15R0.164 C=C(F)CNCCCCCCCCCCC 2230a_200011215754_100009893438 [0,0,1,0,0,0|3,0,0]=4 366 B15R0.164 C=C(F)CNCCCCCCCCCCC 34a_200011215754_100009893438 [0,0,1,0,0,0|3,0,0]=4 367 B15R0.164 C=C(F)COCCCCCCCCCCC 34a_100000210809_100009893438 [0,0,1,0,0,0|3,0,0]=4 368 B15R0.164 C=C(F)COCCCCCCCCCCC 34a_200010262243_100011215454 [0,0,1,0,0,0|3,0,0]=4 369 B15R0.164 C=C(F)COCCCCCCCCCCC 7a_100000210809_100000042424 [0,0,1,0,0,0|3,0,0]=4 370 B15R0.164 C=C(F)CSCCCCCCCCCCC 62a_100000042424_100011215454 [0,0,1,0,0,0|3,0,0]=4 371 B15R0.164 C=CCCCCCCCCCCCC(=O)C 1458a_100000070787_102130925996 [0,0,1,0,0,0|1,0,2]=4 372 B15R0.164 C=CCCCCCCCCCNCC(=O)O 269956a_100016091260_100009814027 [0,0,1,0,0,0|1,0,2]=4 373 B15R0.164 CC(=O)CCCCCCCCCCCCO 1458a_100000070787_100009813331 [0,0,1,0,0,0|2,0,0]=3 374 B15R0.164 CC(=O)CCCCCCOCCCCCO 1458a_100000070787_200132310570 [0,0,1,0,0,0|3,0,0]=4 375 B15R0.164 CC(=O)CCCCNCCCCCCCO 34a_100011996573_100009817362 [0,0,1,0,0,0|3,0,0]=4 376 B15R0.164 CC(=O)CCCCOCCCCCCCBr 34a_100000760002_100009817362 [0,0,1,0,0,0|3,0,0]=4 377 B15R0.164 CC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000735457 [0,0,1,0,0,0|3,0,0]=4 378 B15R0.164 CC(=O)CCCCOCCCCCCCN 34a_100011996573_100009817362 [0,0,1,0,0,0|3,0,0]=4 379 B15R0.164 CC(=O)CCCCSCCCCCCCO 62a_100000735457_100000760002 [0,0,1,0,0,0|3,0,0]=4 380 B15R0.164 CC(=O)CCCCSCCCCCCCO 62a_100000760002_100000735457 [0,0,1,0,0,0|3,0,0]=4 381 B15R0.164 CC(=O)CCCNCCCCCCCCO 34a_102515433106_100000685027 [0,0,1,0,0,0|3,0,0]=4 382 B15R0.164 CC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000685027 [0,0,1,0,0,0|3,0,0]=4 383 B15R0.164 CC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011215641 [0,0,1,0,0,0|3,0,0]=4 384 B15R0.164 CC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000685027 [0,0,1,0,0,0|3,0,0]=4 385 B15R0.164 CC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011215641 [0,0,1,0,0,0|3,0,0]=4 386 B15R0.164 CC(=O)CCCOCCCCCCCCN 34a_102515433106_100000685027 [0,0,1,0,0,0|3,0,0]=4 387 B15R0.164 CC(=O)CCCOCCCCCCCCO 34a_100000759063_100000033203 [0,0,1,0,0,0|3,0,0]=4 388 B15R0.164 CC(=O)CCCOCCCCCCCCO 7a_100000759063_100000033203 [0,0,1,0,0,0|3,0,0]=4 389 B15R0.164 CC(=O)CCCSCCCCCCCCO 62a_100000033203_100011215641 [0,0,1,0,0,0|3,0,0]=4 390 B15R0.164 CC(=O)CCCSCCCCCCCCO 62a_100011215641_100000033203 [0,0,1,0,0,0|3,0,0]=4 391 B15R0.164 CC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000053229 [0,0,1,0,0,0|3,0,0]=4 392 B15R0.164 CC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000053229 [0,0,1,0,0,0|3,0,0]=4 393 B15R0.164 CC(=O)CCOCCCCCCCCCO 34a_100000759926_100009813782 [0,0,1,0,0,0|3,0,0]=4 394 B15R0.164 CC(=O)CCOCCCCCCCCCO 7a_100000759926_100009813782 [0,0,1,0,0,0|3,0,0]=4 395 B15R0.164 CC(=O)CCSCCCCCCCCCO 62a_100000053229_100009813782 [0,0,1,0,0,0|3,0,0]=4 396 B15R0.164 CC(=O)CCSCCCCCCCCCO 62a_100009813782_100000053229 [0,0,1,0,0,0|3,0,0]=4 397 B15R0.164 CC(=O)COCCCCCCCCCCO 34a_100000211253_100009813290 [0,0,1,0,0,0|3,0,0]=4 398 B15R0.164 CCCCCCCCCCCCCC(=O)C 1458a_100000070787_100000210684 [0,0,1,0,0,0|1,0,0]=2 399 B15R0.164 CCCCCCCCCCCCCC(=O)C 1458a_100000756256_200000210301 [0,0,1,0,0,0|1,0,0]=2 400 B15R0.164 CCCCCCCCCCCCCC(=O)[13CH3] 1458a_100000756256_200025704644 [0,0,1,0,0,0|1,0,0]=2 401 B15R0.164 CCCCCCCCCCCCCN(C)C 2230a_100102631434_100000210684 [0,0,1,0,0,0|3,0,0]=4 402 B15R0.164 CCCCCCCCCCCCCN(C)C 269982a_100102631434_100000210684 [0,0,1,0,0,0|3,0,0]=4 403 B15R0.164 CCCCCCCCCCCCCN(C)C 270004a_100102631434_200011215488 [0,0,1,0,0,0|3,0,0]=4 404 B15R0.164 CCCCCCCCCCCCNC(=O)C 11a_100000210451_100015343762 [0,0,1,0,0,0|2,0,0]=3 405 B15R0.164 CCCCCCCCCCCCNC(=O)C 1626a_100000210451_100015343762 [0,0,1,0,0,0|2,0,0]=3 406 B15R0.164 CCCCCCCCCCCCNC(=O)C 240690a_100000210451_100015343762 [0,0,1,0,0,0|2,0,0]=3 407 B15R0.164 CCCCCCCCCCCCNC(=O)C 527a_100000210451_100103153847 [0,0,1,0,0,0|2,0,0]=3 408 B15R0.164 CCCCCCCCCCCNCC(=O)N 2230a_100000711301_100011215454 [0,0,1,0,0,0|2,0,0]=3 409 B15R0.164 CCCCCCCCCCCNCC(=O)N 2230a_200011215754_100000747473 [0,0,1,0,0,0|2,0,0]=3 410 B15R0.164 CCCCCCCCCCCNCC(=O)N 34a_200011215754_100000187820 [0,0,1,0,0,0|2,0,0]=3 411 B15R0.164 CCCCCCCCCCCNCC(=O)O 269956a_100016091260_100011215454 [0,0,1,0,0,0|1,0,0]=2 412 B15R0.164 CCCCCCCCCCCNCC(=O)[O-] 34a_200011215754_100020667443 [0,0,1,0,0,0|1,0,1]=3 413 B15R0.164 CCCCCCCCCCCNCC(C)O 2230a_100000210904_100011215454 [0,0,1,0,0,0|2,0,1]=4 414 B15R0.164 CCCCCCCCCCCNCC(C)O 2230a_200011215754_100011218427 [0,0,1,0,0,0|2,0,1]=4 415 B15R0.164 CCCCCCCCCCCNCC(C)O 34a_100000210904_100011215454 [0,0,1,0,0,0|2,0,1]=4 416 B15R0.164 CCCCCCCCCCCNCC(C)O 34a_200011215754_100011218427 [0,0,1,0,0,0|2,0,1]=4 417 B15R0.164 CCCCCCCCCCCNC[C@@H](C)O 2230a_200011215754_100009817552 [0,0,1,0,0,0|2,0,1]=4 418 B15R0.164 CCCCCCCCCCCNC[C@@H](C)O 34a_200011215754_100009817552 [0,0,1,0,0,0|2,0,1]=4 419 B15R0.164 CCCCCCCCCCCNC[N+](=O)[O-] 34a_200011215754_100000761209 [0,0,1,0,0,0|2,0,1]=4 420 B15R0.164 CCCCCCCCCCCOCC(=O)C 34a_100000211253_100011215454 [0,0,1,0,0,0|2,0,0]=3 421 B15R0.164 CCCCCCCCCCCOCC(=O)N 34a_100000210809_100000187820 [0,0,1,0,0,0|2,0,0]=3 422 B15R0.164 CCCCCCCCCCCOCC(=O)N 7a_100000210809_100000187820 [0,0,1,0,0,0|2,0,0]=3 423 B15R0.164 CCCCCCCCCCCOCC(=O)[O-] 34a_100000210809_100020667443 [0,0,1,0,0,0|1,0,1]=3 424 B15R0.164 CCCCCCCCCCCOCC(C)O 34a_100000210809_100011218427 [0,0,1,0,0,0|2,0,1]=4 425 B15R0.164 CCCCCCCCCCCOCC(C)O 7a_100000210809_100011218427 [0,0,1,0,0,0|2,0,1]=4 426 B15R0.164 CCCCCCCCCCCOC[C@@H](C)O 34a_100000210809_100009817552 [0,0,1,0,0,0|2,0,1]=4 427 B15R0.164 CCCCCCCCCCCOC[C@@H](C)O 7a_100000210809_100009817552 [0,0,1,0,0,0|2,0,1]=4 428 B15R0.164 CCCCCCCCCCCOC[N+](=O)[O-] 34a_100000210809_100000761209 [0,0,1,0,0,0|2,0,1]=4 429 B15R0.164 CCCCCCCCCCCSCC(=O)N 62a_100000747473_100011215454 [0,0,1,0,0,0|2,0,0]=3 430 B15R0.164 CCCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100011215454 [0,0,1,0,0,0|1,0,1]=3 431 B15R0.164 CCCCCCCCCCCSCC(C)O 62a_100011218427_100011215454 [0,0,1,0,0,0|2,0,1]=4 432 B15R0.164 CCCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100011215454 [0,0,1,0,0,0|2,0,1]=4 433 B15R0.164 CCCCCCCCCCNCCC(=O)N 2230a_100000684558_100000744528 [0,0,1,0,0,0|2,0,0]=3 434 B15R0.164 CCCCCCCCCCNCCC(=O)N 34a_100000684558_100000731001 [0,0,1,0,0,0|2,0,0]=3 435 B15R0.164 CCCCCCCCCCNCCC(C)O 2230a_100000684558_100012276601 [0,0,1,0,0,0|2,0,1]=4 436 B15R0.164 CCCCCCCCCCNCCC(C)O 2230a_200000755665_100000210320 [0,0,1,0,0,0|2,0,1]=4 437 B15R0.164 CCCCCCCCCCNCCC(C)O 34a_100000684558_100012276601 [0,0,1,0,0,0|2,0,1]=4 438 B15R0.164 CCCCCCCCCCNCOC(=O)C 34a_100000684558_100009813279 [0,0,1,0,0,0|3,0,0]=4 439 B15R0.164 CCCCCCCCCCNOCC(=O)O 269956a_100000106656_100000210320 [0,0,1,0,0,0|2,0,0]=3 440 B15R0.164 CCCCCCCCCCOCCC(=O)C 34a_100000759926_100000210320 [0,0,1,0,0,0|2,0,0]=3 441 B15R0.164 CCCCCCCCCCOCCC(=O)C 7a_100000210711_100000053229 [0,0,1,0,0,0|2,0,0]=3 442 B15R0.164 CCCCCCCCCCOCCC(=O)C 7a_100000759926_100000210320 [0,0,1,0,0,0|2,0,0]=3 443 B15R0.164 CCCCCCCCCCOCCC(=O)N 34a_100000210711_100000731001 [0,0,1,0,0,0|2,0,0]=3 444 B15R0.164 CCCCCCCCCCOCCC(=O)N 34a_100000757172_100000210320 [0,0,1,0,0,0|2,0,0]=3 445 B15R0.164 CCCCCCCCCCOCCC(=O)N 7a_100000210711_100000744528 [0,0,1,0,0,0|2,0,0]=3 446 B15R0.164 CCCCCCCCCCOCCC(=O)N 7a_100000757172_100000210320 [0,0,1,0,0,0|2,0,0]=3 447 B15R0.164 CCCCCCCCCCOCCC(C)O 34a_100000210711_100012276601 [0,0,1,0,0,0|2,0,1]=4 448 B15R0.164 CCCCCCCCCCOCCC(C)O 7a_100000210711_100012276601 [0,0,1,0,0,0|2,0,1]=4 449 B15R0.164 CCCCCCCCCCOCOC(=O)C 34a_100000210711_100009813279 [0,0,1,0,0,0|3,0,0]=4 450 B15R0.164 CCCCCCCCCCSCCC(=O)C 62a_100000053229_100000210320 [0,0,1,0,0,0|2,0,0]=3 451 B15R0.164 CCCCCCCCCCSCCC(=O)N 62a_100000744528_100000210320 [0,0,1,0,0,0|2,0,0]=3 452 B15R0.164 CCCCCCCCCCSCCC(C)O 62a_100012276601_100000210320 [0,0,1,0,0,0|2,0,1]=4 453 B15R0.164 CCCCCCCCCCSCOC(=O)C 62a_100000076356_100000210320 [0,0,1,0,0,0|3,0,0]=4 454 B15R0.164 CCCCCCCCCNCCCC(=O)C 34a_100000212291_100000685027 [0,0,1,0,0,0|2,0,0]=3 455 B15R0.164 CCCCCCCCCNCCCC(=O)N 34a_100000212291_100102525003 [0,0,1,0,0,0|2,0,0]=3 456 B15R0.164 CCCCCCCCCNCCCC(=O)N 34a_100000739312_100011214924 [0,0,1,0,0,0|2,0,0]=3 457 B15R0.164 CCCCCCCCCNCCCC(C)O 2230a_100000212291_200000718107 [0,0,1,0,0,0|2,0,1]=4 458 B15R0.164 CCCCCCCCCNCCCC(C)O 34a_100000212291_200000718107 [0,0,1,0,0,0|2,0,1]=4 459 B15R0.164 CCCCCCCCCNCCCS(=O)C 2230a_200000753449_100011214924 [0,0,1,0,0,0|3,0,0]=4 460 B15R0.164 CCCCCCCCCNCCNC(=O)C 2230a_100000209853_100011214924 [0,0,1,0,0,0|3,0,0]=4 461 B15R0.164 CCCCCCCCCNCCNC(=O)C 2230a_100000212291_100000189650 [0,0,1,0,0,0|3,0,0]=4 462 B15R0.164 CCCCCCCCCNCCNC(=O)N 2230a_100000212291_200000034859 [0,0,1,0,0,0|3,0,0]=4 463 B15R0.164 CCCCCCCCCNCCNC(=O)N 34a_100020590234_100011214924 [0,0,1,0,0,0|3,0,0]=4 464 B15R0.164 CCCCCCCCCNCCOC(=O)C 34a_100000212291_100009814007 [0,0,1,0,0,0|3,0,0]=4 465 B15R0.164 CCCCCCCCCNCCOC(=O)N 34a_100000212291_200011214921 [0,0,1,0,0,0|3,0,0]=4 466 B15R0.164 CCCCCCCCCOCCCC(=O)C 34a_100000210712_100000685027 [0,0,1,0,0,0|2,0,0]=3 467 B15R0.164 CCCCCCCCCOCCCC(=O)C 34a_100000759063_100011214924 [0,0,1,0,0,0|2,0,0]=3 468 B15R0.164 CCCCCCCCCOCCCC(=O)C 7a_100000210712_100011215641 [0,0,1,0,0,0|2,0,0]=3 469 B15R0.164 CCCCCCCCCOCCCC(=O)C 7a_100000759063_100000210328 [0,0,1,0,0,0|2,0,0]=3 470 B15R0.164 CCCCCCCCCOCCCC(=O)N 34a_100000210712_100102525003 [0,0,1,0,0,0|2,0,0]=3 471 B15R0.164 CCCCCCCCCOCCCC(=O)N 7a_100000210712_100102525003 [0,0,1,0,0,0|2,0,0]=3 472 B15R0.164 CCCCCCCCCOCCCC(C)O 34a_100000210712_200000718107 [0,0,1,0,0,0|2,0,1]=4 473 B15R0.164 CCCCCCCCCOCCCC(C)O 7a_100000210712_200000718107 [0,0,1,0,0,0|2,0,1]=4 474 B15R0.164 CCCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100011214924 [0,0,1,0,0,0|2,0,1]=4 475 B15R0.164 CCCCCCCCCOCCNC(=O)C 34a_100000158858_100011214924 [0,0,1,0,0,0|3,0,0]=4 476 B15R0.164 CCCCCCCCCOCCNC(=O)C 7a_100000210712_100000189650 [0,0,1,0,0,0|3,0,0]=4 477 B15R0.164 CCCCCCCCCOCCNC(=O)N 34a_100000181757_100011214924 [0,0,1,0,0,0|3,0,0]=4 478 B15R0.164 CCCCCCCCCOCCNC(=O)N 7a_100000210712_200000034859 [0,0,1,0,0,0|3,0,0]=4 479 B15R0.164 CCCCCCCCCOCCOC(=O)C 34a_100000210712_100009814007 [0,0,1,0,0,0|3,0,0]=4 480 B15R0.164 CCCCCCCCCOCCOC(=O)C 7a_100000210712_100009814007 [0,0,1,0,0,0|3,0,0]=4 481 B15R0.164 CCCCCCCCCOCCOC(=O)N 34a_100000210712_200011214921 [0,0,1,0,0,0|3,0,0]=4 482 B15R0.164 CCCCCCCCCOCCOC(=O)N 7a_100000210712_200011214921 [0,0,1,0,0,0|3,0,0]=4 483 B15R0.164 CCCCCCCCCOCCOC(=O)N 7a_100000766696_100000210328 [0,0,1,0,0,0|3,0,0]=4 484 B15R0.164 CCCCCCCCCSCCCC(=O)C 62a_100011215641_100000210670 [0,0,1,0,0,0|2,0,0]=3 485 B15R0.164 CCCCCCCCCSCCCC(=O)N 62a_100102525003_100000210670 [0,0,1,0,0,0|2,0,0]=3 486 B15R0.164 CCCCCCCCCSCCCC(C)O 62a_200000718107_100000210670 [0,0,1,0,0,0|2,0,1]=4 487 B15R0.164 CCCCCCCCCSCCNC(=O)C 62a_100000189650_100000210670 [0,0,1,0,0,0|3,0,0]=4 488 B15R0.164 CCCCCCCCCSCCNC(=O)N 62a_200000034859_100000210670 [0,0,1,0,0,0|3,0,0]=4 489 B15R0.164 CCCCCCCCCSCCOC(=O)C 62a_100009814007_100000210670 [0,0,1,0,0,0|3,0,0]=4 490 B15R0.164 CCCCCCCCCSCCOC(=O)N 62a_200011214921_100000210670 [0,0,1,0,0,0|3,0,0]=4 491 B15R0.164 CCCCCCCCNCCCCB(O)O 2230a_100000229939_200009817182 [0,0,1,0,0,0|2,0,1]=4 492 B15R0.164 CCCCCCCCNCCCCB(O)O 34a_100000229939_200009817182 [0,0,1,0,0,0|2,0,1]=4 493 B15R0.164 CCCCCCCCNCCCCC(=O)C 34a_100000229939_100009817362 [0,0,1,0,0,0|2,0,0]=3 494 B15R0.164 CCCCCCCCNCCCCC(=O)N 34a_100000696515_100000210759 [0,0,1,0,0,0|2,0,0]=3 495 B15R0.164 CCCCCCCCNCCCNC(=O)C 34a_100000736810_100000210759 [0,0,1,0,0,0|3,0,0]=4 496 B15R0.164 CCCCCCCCNCCCOC(=O)C 34a_100000229939_100000042594 [0,0,1,0,0,0|3,0,0]=4 497 B15R0.164 CCCCCCCCNCCCSC(=O)C 2230a_100000229939_100000038929 [0,0,1,0,0,0|3,0,0]=4 498 B15R0.164 CCCCCCCCNCCCSC(=O)C 34a_100000229939_100000038929 [0,0,1,0,0,0|3,0,0]=4 499 B15R0.164 CCCCCCCCNCCOCC(=O)N 2230a_100000229939_100000076697 [0,0,1,0,0,0|3,0,0]=4 500 B15R0.164 CCCCCCCCNCCOCC(=O)N 34a_100000229939_100000076697 [0,0,1,0,0,0|3,0,0]=4 501 B15R0.164 CCCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210759 [0,0,1,0,0,0|2,0,0]=3 502 B15R0.164 CCCCCCCCOCCCCB(O)O 34a_100000210232_200009817182 [0,0,1,0,0,0|2,0,1]=4 503 B15R0.164 CCCCCCCCOCCCCB(O)O 7a_100000210232_200009817182 [0,0,1,0,0,0|2,0,1]=4 504 B15R0.164 CCCCCCCCOCCCCC(=O)C 34a_100000210232_100009817362 [0,0,1,0,0,0|2,0,0]=3 505 B15R0.164 CCCCCCCCOCCCCC(=O)C 7a_100000210232_100000735457 [0,0,1,0,0,0|2,0,0]=3 506 B15R0.164 CCCCCCCCOCCCCC(=O)N 34a_100012022536_100000210759 [0,0,1,0,0,0|2,0,0]=3 507 B15R0.164 CCCCCCCCOCCCCC(=O)N 7a_100012022536_100000210759 [0,0,1,0,0,0|2,0,0]=3 508 B15R0.164 CCCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210759 [0,0,1,0,0,0|2,0,1]=4 509 B15R0.164 CCCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210759 [0,0,1,0,0,0|2,0,1]=4 510 B15R0.164 CCCCCCCCOCCCNC(=O)C 34a_100000752032_100000210759 [0,0,1,0,0,0|3,0,0]=4 511 B15R0.164 CCCCCCCCOCCCOC(=O)C 34a_100000210232_100000042594 [0,0,1,0,0,0|3,0,0]=4 512 B15R0.164 CCCCCCCCOCCCOC(=O)C 7a_100000210232_100000042594 [0,0,1,0,0,0|3,0,0]=4 513 B15R0.164 CCCCCCCCOCCCSC(=O)C 34a_100000210232_100000038929 [0,0,1,0,0,0|3,0,0]=4 514 B15R0.164 CCCCCCCCOCCCSC(=O)C 7a_100000210232_100000038929 [0,0,1,0,0,0|3,0,0]=4 515 B15R0.164 CCCCCCCCOCCOCC(=O)N 34a_100000210232_100000076697 [0,0,1,0,0,0|3,0,0]=4 516 B15R0.164 CCCCCCCCOCCOCC(=O)N 7a_100000210232_100000076697 [0,0,1,0,0,0|3,0,0]=4 517 B15R0.164 CCCCCCCCSCCCCB(O)O 62a_100000210759_200009817182 [0,0,1,0,0,0|2,0,1]=4 518 B15R0.164 CCCCCCCCSCCCCB(O)O 62a_200009817182_100000210317 [0,0,1,0,0,0|2,0,1]=4 519 B15R0.164 CCCCCCCCSCCCCC(=O)C 62a_100000210759_100000735457 [0,0,1,0,0,0|2,0,0]=3 520 B15R0.164 CCCCCCCCSCCCCC(=O)C 62a_100000735457_100000210317 [0,0,1,0,0,0|2,0,0]=3 521 B15R0.164 CCCCCCCCSCCCOC(=O)C 62a_100000042594_100000210317 [0,0,1,0,0,0|3,0,0]=4 522 B15R0.164 CCCCCCCCSCCCOC(=O)C 62a_100000210759_100000042594 [0,0,1,0,0,0|3,0,0]=4 523 B15R0.164 CCCCCCCCSCCCSC(=O)C 62a_100000038929_100000210317 [0,0,1,0,0,0|3,0,0]=4 524 B15R0.164 CCCCCCCCSCCCSC(=O)C 62a_100000210759_100000038929 [0,0,1,0,0,0|3,0,0]=4 525 B15R0.164 CCCCCCCCSCCOCC(=O)N 62a_100000076697_100000210317 [0,0,1,0,0,0|3,0,0]=4 526 B15R0.164 CCCCCCCCSCCOCC(=O)N 62a_100000210759_100000076697 [0,0,1,0,0,0|3,0,0]=4 527 B15R0.164 CCCCCCCNCCCCCB(O)O 2230a_100000229938_200009817188 [0,0,1,0,0,0|2,0,1]=4 528 B15R0.164 CCCCCCCNCCCCCC(=O)N 2230a_100000229938_100009817443 [0,0,1,0,0,0|2,0,0]=3 529 B15R0.164 CCCCCCCNCCCCNC(=O)C 2230a_200011368371_100000210681 [0,0,1,0,0,0|3,0,0]=4 530 B15R0.164 CCCCCCCNCCCCNC(=O)C 34a_200011368371_100000210614 [0,0,1,0,0,0|3,0,0]=4 531 B15R0.164 CCCCCCCNCCCCSC(=O)C 2230a_100000229938_200010402107 [0,0,1,0,0,0|3,0,0]=4 532 B15R0.164 CCCCCCCOCCCCCB(O)O 34a_100000210272_200009817188 [0,0,1,0,0,0|2,0,1]=4 533 B15R0.164 CCCCCCCOCCCCCB(O)O 7a_100000210272_200009817188 [0,0,1,0,0,0|2,0,1]=4 534 B15R0.164 CCCCCCCOCCCCCC(=O)N 34a_100000123541_100000210614 [0,0,1,0,0,0|2,0,0]=3 535 B15R0.164 CCCCCCCOCCCCCC(=O)N 34a_100000210272_100009817443 [0,0,1,0,0,0|2,0,0]=3 536 B15R0.164 CCCCCCCOCCCCCC(=O)N 7a_100000123541_100000210614 [0,0,1,0,0,0|2,0,0]=3 537 B15R0.164 CCCCCCCOCCCCCC(=O)N 7a_100000210272_100009817443 [0,0,1,0,0,0|2,0,0]=3 538 B15R0.164 CCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210614 [0,0,1,0,0,0|1,0,1]=3 539 B15R0.164 CCCCCCCOCCCCOC(=O)C 34a_100000073216_100000210614 [0,0,1,0,0,0|3,0,0]=4 540 B15R0.164 CCCCCCCOCCCCOC(=O)C 34a_100000210272_100000033659 [0,0,1,0,0,0|3,0,0]=4 541 B15R0.164 CCCCCCCOCCCCOC(=O)C 7a_100000073216_100000210614 [0,0,1,0,0,0|3,0,0]=4 542 B15R0.164 CCCCCCCOCCCCOC(=O)C 7a_100000210272_100000033659 [0,0,1,0,0,0|3,0,0]=4 543 B15R0.164 CCCCCCCOCCCCSC(=O)C 34a_100000210272_200010402107 [0,0,1,0,0,0|3,0,0]=4 544 B15R0.164 CCCCCCCOCCCCSC(=O)C 7a_100000210272_200010402107 [0,0,1,0,0,0|3,0,0]=4 545 B15R0.164 CCCCCCCSCCCCCB(O)O 62a_100000210614_200009817188 [0,0,1,0,0,0|2,0,1]=4 546 B15R0.164 CCCCCCCSCCCCCB(O)O 62a_200009817188_100000210316 [0,0,1,0,0,0|2,0,1]=4 547 B15R0.164 CCCCCCCSCCCCCC(=O)N 62a_100000210614_100009817443 [0,0,1,0,0,0|2,0,0]=3 548 B15R0.164 CCCCCCCSCCCCCC(=O)N 62a_100009817443_100000210316 [0,0,1,0,0,0|2,0,0]=3 549 B15R0.164 CCCCCCCSCCCCOC(=O)C 62a_100000033659_100000210316 [0,0,1,0,0,0|3,0,0]=4 550 B15R0.164 CCCCCCCSCCCCOC(=O)C 62a_100000210614_100000033659 [0,0,1,0,0,0|3,0,0]=4 551 B15R0.164 CCCCCCCSCCCCSC(=O)C 62a_100000210614_200010402107 [0,0,1,0,0,0|3,0,0]=4 552 B15R0.164 CCCCCCCSCCCCSC(=O)C 62a_200010402107_100000210316 [0,0,1,0,0,0|3,0,0]=4 553 B15R0.164 CCCCCCNCCCCCCB(O)O 2230a_100000210581_100009817187 [0,0,1,0,0,0|2,0,1]=4 554 B15R0.164 CCCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210314 [0,0,1,0,0,0|3,0,0]=4 555 B15R0.164 CCCCCCNCCCCCNC(=O)C 34a_200012022750_100000210314 [0,0,1,0,0,0|3,0,0]=4 556 B15R0.164 CCCCCCNCCCCCOC(=O)C 2230a_100000210581_100009813381 [0,0,1,0,0,0|3,0,0]=4 557 B15R0.164 CCCCCCOCCCCCCB(O)O 34a_100000210259_100009817187 [0,0,1,0,0,0|2,0,1]=4 558 B15R0.164 CCCCCCOCCCCCCB(O)O 7a_100000210259_100009817187 [0,0,1,0,0,0|2,0,1]=4 559 B15R0.164 CCCCCCOCCCCCOC(=O)C 34a_100000210259_100000033007 [0,0,1,0,0,0|3,0,0]=4 560 B15R0.164 CCCCCCOCCCCCOC(=O)C 7a_100000210259_100000033007 [0,0,1,0,0,0|3,0,0]=4 561 B15R0.164 CCCCCCOCCOCCCC(=O)C 34a_100000691444_100000685027 [0,0,1,0,0,0|3,0,0]=4 562 B15R0.164 CCCCCCOCCOCCCC(=O)C 7a_100000691444_100011215641 [0,0,1,0,0,0|3,0,0]=4 563 B15R0.164 CCCCCCOCCOCCCC(=O)N 34a_100000691444_100102525003 [0,0,1,0,0,0|3,0,0]=4 564 B15R0.164 CCCCCCOCCOCCCC(=O)N 7a_100000691444_100102525003 [0,0,1,0,0,0|3,0,0]=4 565 B15R0.164 CCCCCCSCCCCCCB(O)O 62a_100000210314_100009817187 [0,0,1,0,0,0|2,0,1]=4 566 B15R0.164 CCCCCCSCCCCCCB(O)O 62a_100009817187_100000210757 [0,0,1,0,0,0|2,0,1]=4 567 B15R0.164 CCCCCCSCCCCCOC(=O)C 62a_100000033007_100000210757 [0,0,1,0,0,0|3,0,0]=4 568 B15R0.164 CCCCCCSCCCCCOC(=O)C 62a_100000210314_100000033007 [0,0,1,0,0,0|3,0,0]=4 569 B15R0.164 CCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210326 [0,0,1,0,0,0|3,0,0]=4 570 B15R0.164 CCCCCNCCCCCCNC(=O)C 34a_200011996284_100000718602 [0,0,1,0,0,0|3,0,0]=4 571 B15R0.164 CCCCCNCCOCCCCC(=O)C 34a_100000224656_100009817362 [0,0,1,0,0,0|3,0,0]=4 572 B15R0.164 CCCCCNCCOCCOCC(=O)O 269956a_100009854275_100000210326 [0,0,1,0,0,0|3,0,0]=4 573 B15R0.164 CCCCCOCCOCCCCC(=O)C 34a_100011215259_100009817362 [0,0,1,0,0,0|3,0,0]=4 574 B15R0.164 CCCCCOCCOCCCCC(=O)C 7a_100011215259_100000735457 [0,0,1,0,0,0|3,0,0]=4 575 B15R0.164 CCCCNCCCCOCCCC(=O)C 34a_200011216965_100000685027 [0,0,1,0,0,0|3,0,0]=4 576 B15R0.164 CCCCNCCCCOCCCC(=O)N 34a_200011216965_100102525003 [0,0,1,0,0,0|3,0,0]=4 577 B15R0.164 CCCCOCCCCOCCCC(=O)C 34a_200000760531_100000685027 [0,0,1,0,0,0|3,0,0]=4 578 B15R0.164 CCCCOCCCCOCCCC(=O)C 7a_200000760531_100011215641 [0,0,1,0,0,0|3,0,0]=4 579 B15R0.164 CCCCOCCCCOCCCC(=O)N 34a_200000760531_100102525003 [0,0,1,0,0,0|3,0,0]=4 580 B15R0.164 CCCCOCCCCOCCCC(=O)N 7a_200000760531_100102525003 [0,0,1,0,0,0|3,0,0]=4 581 B15R0.164 CCCCOCCCNCCCCC(=O)C 34a_200000211371_100009817362 [0,0,1,0,0,0|3,0,0]=4 582 B15R0.164 CCCCOCCCOCCCCC(=O)C 34a_200011215613_100009817362 [0,0,1,0,0,0|3,0,0]=4 583 B15R0.164 CCCCOCCCOCCCCC(=O)C 7a_200011215613_100000735457 [0,0,1,0,0,0|3,0,0]=4 584 B15R0.164 CCCCOCCOCCCCCC(=O)N 34a_100000123541_100000743108 [0,0,1,0,0,0|3,0,0]=4 585 B15R0.164 CCCCOCCOCCCCCC(=O)N 34a_100000210238_100009817443 [0,0,1,0,0,0|3,0,0]=4 586 B15R0.164 CCCCOCCOCCCCCC(=O)N 7a_100000123541_100000743108 [0,0,1,0,0,0|3,0,0]=4 587 B15R0.164 CCCCOCCOCCCCCC(=O)N 7a_100000210238_100009817443 [0,0,1,0,0,0|3,0,0]=4 588 B15R0.164 CCCCOCCOCCCCCC(=O)[O-] 7a_100102619762_100000743108 [0,0,1,0,0,0|2,0,1]=4 589 B15R0.164 CCCCOCCSCCCCCC(=O)N 62a_100000743108_100009817443 [0,0,1,0,0,0|3,0,0]=4 590 B15R0.164 CCCCOCCSCCCCCC(=O)N 62a_100009817443_100000743108 [0,0,1,0,0,0|3,0,0]=4 591 B15R0.164 CCCCSCCNCCCCCC(=O)N 2230a_100025743550_100009817443 [0,0,1,0,0,0|3,0,0]=4 592 B15R0.164 CCCCSCCOCCCCCC(=O)N 34a_200000230436_100009817443 [0,0,1,0,0,0|3,0,0]=4 593 B15R0.164 CCCCSCCOCCCCCC(=O)N 7a_200000230436_100009817443 [0,0,1,0,0,0|3,0,0]=4 594 B15R0.164 CCCOCCCNCCCCCC(=O)N 2230a_100011217757_100009817443 [0,0,1,0,0,0|3,0,0]=4 595 B15R0.164 CCCOCCCNCCCCCC(=O)N 34a_100011217757_100009817443 [0,0,1,0,0,0|3,0,0]=4 596 B15R0.164 CCNCCCCCCCCCCC(=O)N 2230a_100015525214_200010167045 [0,0,1,0,0,0|2,0,0]=3 597 B15R0.164 CCOCCCCCCCCCCC(=O)N 34a_100121572206_200010167045 [0,0,1,0,0,0|2,0,0]=3 598 B15R0.164 CCSCCCCCCCCCCC(=O)N 62a_100000210202_200010167045 [0,0,1,0,0,0|2,0,0]=3 599 B15R0.164 CCSCCCCCCCCCCC(=O)N 62a_200010167045_100000210202 [0,0,1,0,0,0|2,0,0]=3 600 B15R0.164 CNCCCCCOCCCCCC(=O)N 34a_100000722520_100009817443 [0,0,1,0,0,0|3,0,0]=4 601 B15R0.164 COCCCCCCNCCCCC(=O)N 34a_100000696515_100011998445 [0,0,1,0,0,0|3,0,0]=4 602 B15R0.164 COCCCCCCNCCOCC(=O)O 269956a_100000700818_100011998445 [0,0,1,0,0,0|3,0,0]=4 603 B15R0.164 COCCCCCCOCCCCC(=O)C 34a_200012092642_100009817362 [0,0,1,0,0,0|3,0,0]=4 604 B15R0.164 COCCCCCCOCCCCC(=O)C 7a_200012092642_100000735457 [0,0,1,0,0,0|3,0,0]=4 605 B15R0.164 COCCCCCCOCCCCC(=O)N 34a_100012022536_100011998445 [0,0,1,0,0,0|3,0,0]=4 606 B15R0.164 COCCCCCCOCCCCC(=O)N 7a_100012022536_100011998445 [0,0,1,0,0,0|3,0,0]=4 607 B15R0.164 COCCCCCCSCCCCC(=O)C 62a_100000735457_100011998445 [0,0,1,0,0,0|3,0,0]=4 608 B15R0.164 COCCCCCCSCCCCC(=O)C 62a_100011998445_100000735457 [0,0,1,0,0,0|3,0,0]=4 609 B15R0.164 COCCCCCNCCCCCC(=O)N 2230a_100000747528_100009817443 [0,0,1,0,0,0|3,0,0]=4 610 B15R0.164 COCCCCCNCCCCCC(=O)N 34a_100000747528_100009817443 [0,0,1,0,0,0|3,0,0]=4 611 B15R0.164 NC(=O)CCCCCCCCCCSCF 62a_100015361967_200010167045 [0,0,1,0,0,0|3,0,0]=4 612 B15R0.164 NC(=O)CCCCCCCCCCSCF 62a_200010167045_100015361967 [0,0,1,0,0,0|3,0,0]=4 613 B15R0.164 NC(=O)CCCCCNCCCCCCO 2230a_100000686447_100009817443 [0,0,1,0,0,0|3,0,0]=4 614 B15R0.164 NC(=O)CCCCCNCCCCCCO 34a_100000686447_100009817443 [0,0,1,0,0,0|3,0,0]=4 615 B15R0.164 NC(=O)CCCCCOCCCCCCBr 34a_100011215345_100009817443 [0,0,1,0,0,0|3,0,0]=4 616 B15R0.164 NC(=O)CCCCCOCCCCCCBr 7a_100011215345_100009817443 [0,0,1,0,0,0|3,0,0]=4 617 B15R0.164 NC(=O)CCCCCOCCCCCCCl 34a_100000766143_100009817443 [0,0,1,0,0,0|3,0,0]=4 618 B15R0.164 NC(=O)CCCCCOCCCCCCCl 7a_100000766143_100009817443 [0,0,1,0,0,0|3,0,0]=4 619 B15R0.164 NC(=O)CCCCCOCCCCCCF 34a_100000123541_100015922095 [0,0,1,0,0,0|3,0,0]=4 620 B15R0.164 NC(=O)CCCCCOCCCCCCF 34a_100000732779_100009817443 [0,0,1,0,0,0|3,0,0]=4 621 B15R0.164 NC(=O)CCCCCOCCCCCCF 7a_100000123541_100015922095 [0,0,1,0,0,0|3,0,0]=4 622 B15R0.164 NC(=O)CCCCCOCCCCCCF 7a_100000732779_100009817443 [0,0,1,0,0,0|3,0,0]=4 623 B15R0.164 NC(=O)CCCCCOCCCCCCO 34a_100000123541_100000766143 [0,0,1,0,0,0|3,0,0]=4 624 B15R0.164 NC(=O)CCCCCOCCCCCCO 7a_100000123541_100000766143 [0,0,1,0,0,0|3,0,0]=4 625 B15R0.164 NC(=O)CCCCCSCCCCCCF 62a_100009817443_100015922095 [0,0,1,0,0,0|3,0,0]=4 626 B15R0.164 NC(=O)CCCCCSCCCCCCF 62a_100015922095_100009817443 [0,0,1,0,0,0|3,0,0]=4 627 B15R0.164 NC(=O)CCCCCSCCCCCCO 62a_100000766143_100009817443 [0,0,1,0,0,0|3,0,0]=4 628 B15R0.164 NC(=O)CCCCCSCCCCCCO 62a_100009817443_100000766143 [0,0,1,0,0,0|3,0,0]=4 629 B15R0.164 NC(=O)CCCCNCCCCCCCO 34a_100000696515_100000760002 [0,0,1,0,0,0|3,0,0]=4 630 B15R0.164 NC(=O)CCCCOCCCCCCCO 34a_100012022536_100000760002 [0,0,1,0,0,0|3,0,0]=4 631 B15R0.164 NC(=O)CCCCOCCCCCCCO 7a_100012022536_100000760002 [0,0,1,0,0,0|3,0,0]=4 632 B15R0.164 NC(=O)CCCNCCCCCCCCO 34a_100000739312_100000033203 [0,0,1,0,0,0|3,0,0]=4 633 B15R0.164 NC(=O)CCCNCCCCCCCCO 34a_102515433106_100102525003 [0,0,1,0,0,0|3,0,0]=4 634 B15R0.164 NC(=O)CCCOCCCCCCCCBr 34a_100009813846_100102525003 [0,0,1,0,0,0|3,0,0]=4 635 B15R0.164 NC(=O)CCCOCCCCCCCCBr 7a_100009813846_100102525003 [0,0,1,0,0,0|3,0,0]=4 636 B15R0.164 NC(=O)CCCOCCCCCCCCCl 34a_100000033203_100102525003 [0,0,1,0,0,0|3,0,0]=4 637 B15R0.164 NC(=O)CCCOCCCCCCCCCl 7a_100000033203_100102525003 [0,0,1,0,0,0|3,0,0]=4 638 B15R0.164 NC(=O)CCCSCCCCCCCCO 62a_100000033203_100102525003 [0,0,1,0,0,0|3,0,0]=4 639 B15R0.164 NC(=O)CCCSCCCCCCCCO 62a_100102525003_100000033203 [0,0,1,0,0,0|3,0,0]=4 640 B15R0.164 NC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000744528 [0,0,1,0,0,0|3,0,0]=4 641 B15R0.164 NC(=O)CCNCCCCCCCCCO 34a_100000078944_100000731001 [0,0,1,0,0,0|3,0,0]=4 642 B15R0.164 NC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000731001 [0,0,1,0,0,0|3,0,0]=4 643 B15R0.164 NC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000744528 [0,0,1,0,0,0|3,0,0]=4 644 B15R0.164 NC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000731001 [0,0,1,0,0,0|3,0,0]=4 645 B15R0.164 NC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000744528 [0,0,1,0,0,0|3,0,0]=4 646 B15R0.164 NC(=O)CCOCCCCCCCCCO 34a_100000757172_100009813782 [0,0,1,0,0,0|3,0,0]=4 647 B15R0.164 NC(=O)CCOCCCCCCCCCO 7a_100000757172_100009813782 [0,0,1,0,0,0|3,0,0]=4 648 B15R0.164 NC(=O)CCSCCCCCCCCCO 62a_100000744528_100009813782 [0,0,1,0,0,0|3,0,0]=4 649 B15R0.164 NC(=O)CCSCCCCCCCCCO 62a_100009813782_100000744528 [0,0,1,0,0,0|3,0,0]=4 650 B15R0.164 NC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747473 [0,0,1,0,0,0|3,0,0]=4 651 B15R0.164 NC(=O)CNCCCCCCCCCCO 2230a_100000711301_100009813290 [0,0,1,0,0,0|3,0,0]=4 652 B15R0.164 NC(=O)CNCCCCCCCCCCO 34a_100000066964_100000187820 [0,0,1,0,0,0|3,0,0]=4 653 B15R0.164 NC(=O)COCCCCCCCCCCBr 34a_100009813290_100000187820 [0,0,1,0,0,0|3,0,0]=4 654 B15R0.164 NC(=O)COCCCCCCCCCCBr 7a_100009813290_100000187820 [0,0,1,0,0,0|3,0,0]=4 655 B15R0.164 NC(=O)COCCCCCCCCCCCl 34a_200000033068_100000187820 [0,0,1,0,0,0|3,0,0]=4 656 B15R0.164 NC(=O)COCCCCCCCCCCCl 7a_200000033068_100000187820 [0,0,1,0,0,0|3,0,0]=4 657 B15R0.164 NC(=O)CSCCCCCCCCCCO 62a_100000747473_200000033068 [0,0,1,0,0,0|3,0,0]=4 658 B15R0.164 NC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747473 [0,0,1,0,0,0|3,0,0]=4 659 B15R0.164 NCCCCCCCCCCOCC(=O)N 34a_100000066964_100000187820 [0,0,1,0,0,0|3,0,0]=4 660 B15R0.164 NCCCCCCCCCCOCC(=O)[O-] 34a_100000066964_100020667443 [0,0,1,0,0,0|2,0,1]=4 661 B15R0.164 NCCCCCCCCCOCCC(=O)N 34a_100000078944_100000731001 [0,0,1,0,0,0|3,0,0]=4 662 B15R0.164 NCCCCCCCCOCCCC(=O)N 34a_102515433106_100102525003 [0,0,1,0,0,0|3,0,0]=4 663 B15R0.164 NCCCCCCOCCCCCC(=O)N 34a_100000686447_100009817443 [0,0,1,0,0,0|3,0,0]=4 664 B15R0.164 O=C(O)CNCCCCCCCCCCO 269956a_100016091260_100009813290 [0,0,1,0,0,0|2,0,0]=3 665 B15R0.164 O=C(O)COCCNCCCCCCCO 269956a_100000700818_100000760002 [0,0,1,0,0,0|3,0,0]=4 666 B15R0.164 O=C(O)CONCCCCCCCCCO 269956a_100000106656_100009813782 [0,0,1,0,0,0|3,0,0]=4 667 B15R0.164 O=C([O-])CCCCCOCCCCCCF 7a_100102619762_100015922095 [0,0,1,0,0,0|2,0,1]=4 668 B15R0.164 O=C([O-])CCCCCOCCCCCCO 7a_100102619762_100000766143 [0,0,1,0,0,0|2,0,1]=4 669 B15R0.164 O=C([O-])CNCCCCCCCCCCO 34a_100000066964_100020667443 [0,0,1,0,0,0|2,0,1]=4 670 B15R0.164 O=C([O-])COCCCCCCCCCCBr 34a_100009813290_100020667443 [0,0,1,0,0,0|2,0,1]=4 671 B15R0.164 O=C([O-])COCCCCCCCCCCCl 34a_200000033068_100020667443 [0,0,1,0,0,0|2,0,1]=4 672 B15R0.164 O=C([O-])CSCCCCCCCCCCO 62a_100009813290_100020667443 [0,0,1,0,0,0|2,0,1]=4 673 B15R0.164 O=C([O-])CSCCCCCCCCCCO 62a_100020667443_200000033068 [0,0,1,0,0,0|2,0,1]=4 674 B15R0.322 C=CCCCC(=O)CCCCCCCCC 1458a_100000210558_100000757094 [0,0,1,0,0,0|1,0,2]=4 675 B15R0.322 C=CCCCC(=O)CCCCCCCCC 1458a_100000766728_100000210670 [0,0,1,0,0,0|1,0,2]=4 676 B15R0.322 C=CCCCN(C)CCCCCCCCC 2230a_100000232482_100011713584 [0,0,1,0,0,0|3,0,0]=4 677 B15R0.322 C=CCCCN(C)CCCCCCCCC 269982a_100000232482_100000757094 [0,0,1,0,0,0|3,0,0]=4 678 B15R0.322 C=CCCNC(C)CCCCCCCCC 270004a_100015191253_100011215753 [0,0,1,0,0,0|3,0,0]=4 679 B15R0.322 C=CCCOC(C)CCCCCCCCC 34a_100011218016_100000754431 [0,0,1,0,0,0|3,0,0]=4 680 B15R0.322 C=CCCOC(C)CCCCCCCCC 7a_100011218016_100000754431 [0,0,1,0,0,0|3,0,0]=4 681 B15R0.322 C=CCNCC(C)CCCCCCCCC 270004a_100020586998_200011218516 [0,0,1,0,0,0|3,0,0]=4 682 B15R0.322 CCCCCCCCCN(C)CCCC=O 2230a_100000232482_200011292268 [0,0,1,0,0,0|2,0,0]=3 683 B15R0.322 CCCCCCCCCN(C)CCCC=O 269982a_100000232482_200011292268 [0,0,1,0,0,0|2,0,0]=3 684 B15R0.366 C#CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000184674 [0,0,1,0,0,0|1,0,2]=4 685 B15R0.366 C#CCC(=O)CCCCCCCCCCC 1458a_100011220946_100011215454 [0,0,1,0,0,0|1,0,2]=4 686 B15R0.366 C#CCC(=O)NCCCCCCCCCC 1626a_100000684558_100011220946 [0,0,1,0,0,0|1,0,2]=4 687 B15R0.366 C#CCC(=O)NCCCCCCCCCC 527a_100000684558_100011220946 [0,0,1,0,0,0|1,0,2]=4 688 B15R0.366 C#CCCCCCCOCOC(=O)CCC 34a_100011217361_100000034017 [0,0,1,0,0,0|1,0,2]=4 689 B15R0.366 C#CCCCCCCSCOC(=O)CCC 62a_100012276617_100000034017 [0,0,1,0,0,0|1,0,2]=4 690 B15R0.366 C=CCC(=O)CCCCCCCCCCC 1458a_100000210193_100011215454 [0,0,1,0,0,0|1,0,2]=4 691 B15R0.366 C=CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000210623 [0,0,1,0,0,0|1,0,2]=4 692 B15R0.366 C=CCC(=O)NCCCCCCCCCC 11a_100000684558_100000210193 [0,0,1,0,0,0|1,0,2]=4 693 B15R0.366 C=CCC(=O)NCCCCCCCCCC 1626a_100000684558_100000210193 [0,0,1,0,0,0|1,0,2]=4 694 B15R0.366 C=CCC(=O)NCCCCCCCCCC 240690a_100000684558_100000210193 [0,0,1,0,0,0|1,0,2]=4 695 B15R0.366 C=CCC(=O)NCCCCCCCCCC 527a_100000684558_100000210193 [0,0,1,0,0,0|1,0,2]=4 696 B15R0.366 C=CCCCCCCCCCC(=O)CCC 1458a_100000211992_100009814027 [0,0,1,0,0,0|1,0,2]=4 697 B15R0.366 C=CCCCCCCOCOC(=O)CCC 34a_200011216477_100000034017 [0,0,1,0,0,0|1,0,2]=4 698 B15R0.366 C=CCCCCCCSCOC(=O)CCC 62a_100011215473_100000034017 [0,0,1,0,0,0|1,0,2]=4 699 B15R0.366 CC#CC(=O)CCCCCCCCCCC 1458a_100000763181_100011215454 [0,0,1,0,0,0|1,0,2]=4 700 B15R0.366 CC/C=C\CCCCOCOC(=O)CCC 34a_100016287862_100000034017 [0,0,1,0,0,0|1,0,2]=4 701 B15R0.366 CC=CC(=O)CCCCCCCCCCC 1458a_100000210699_100011215454 [0,0,1,0,0,0|1,0,2]=4 702 B15R0.366 CC=CC(=O)NCCCCCCCCCC 11a_100000684558_100000210699 [0,0,1,0,0,0|1,0,2]=4 703 B15R0.366 CC=CC(=O)NCCCCCCCCCC 1626a_100000684558_100000210699 [0,0,1,0,0,0|1,0,2]=4 704 B15R0.366 CC=CC(=O)NCCCCCCCCCC 240690a_100000684558_100000210699 [0,0,1,0,0,0|1,0,2]=4 705 B15R0.366 CCCC(=O)CCCCCCCCCCO 1458a_100000211992_100009813290 [0,0,1,0,0,0|2,0,0]=3 706 B15R0.366 CCCC(=O)CNCCCCCCCCO 2230a_102515433106_100000747444 [0,0,1,0,0,0|3,0,0]=4 707 B15R0.366 CCCC(=O)COCCCCCCCCBr 7a_100009813846_100000747444 [0,0,1,0,0,0|3,0,0]=4 708 B15R0.366 CCCC(=O)COCCCCCCCCCl 7a_100000033203_100000747444 [0,0,1,0,0,0|3,0,0]=4 709 B15R0.366 CCCC(=O)CSCCCCCCCCO 62a_100000033203_100000747444 [0,0,1,0,0,0|3,0,0]=4 710 B15R0.366 CCCC(=O)CSCCCCCCCCO 62a_100000747444_100000033203 [0,0,1,0,0,0|3,0,0]=4 711 B15R0.366 CCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000211992 [0,0,1,0,0,0|2,0,0]=3 712 B15R0.366 CCCC(=O)OCNCCCCCCCO 2230a_100011996573_100000034017 [0,0,1,0,0,0|2,0,0]=3 713 B15R0.366 CCCC(=O)OCNCCCCCCCO 34a_100011996573_100000034017 [0,0,1,0,0,0|2,0,0]=3 714 B15R0.366 CCCC(=O)OCNCCCOCCCO 2230a_100011310245_100000034017 [0,0,1,0,0,0|3,0,0]=4 715 B15R0.366 CCCC(=O)OCNCCCOCCCO 34a_100011310245_100000034017 [0,0,1,0,0,0|3,0,0]=4 716 B15R0.366 CCCC(=O)OCNCCCOCCOC 2230a_100000206027_100000034017 [0,0,1,0,0,0|3,0,0]=4 717 B15R0.366 CCCC(=O)OCNCCCOCCOC 34a_100000206027_100000034017 [0,0,1,0,0,0|3,0,0]=4 718 B15R0.366 CCCC(=O)OCNCCOCCOCC 2230a_100102712874_100000034017 [0,0,1,0,0,0|3,0,0]=4 719 B15R0.366 CCCC(=O)OCNCCOCCOCC 34a_100102712874_100000034017 [0,0,1,0,0,0|3,0,0]=4 720 B15R0.366 CCCC(=O)OCOCCCCCCCBr 34a_100000760002_100000034017 [0,0,1,0,0,0|2,0,0]=3 721 B15R0.366 CCCC(=O)OCOCCCCCCCN 34a_100011996573_100000034017 [0,0,1,0,0,0|2,0,0]=3 722 B15R0.366 CCCC(=O)OCOCCCCCCOC 34a_200012092642_100000034017 [0,0,1,0,0,0|2,0,0]=3 723 B15R0.366 CCCC(=O)OCOCCCOCCCN 34a_100011310245_100000034017 [0,0,1,0,0,0|3,0,0]=4 724 B15R0.366 CCCC(=O)OCOCCOCCOCC 34a_100000210240_100000034017 [0,0,1,0,0,0|3,0,0]=4 725 B15R0.366 CCCC(=O)OCSCCCCCCC#N 62a_100009813337_100000034017 [0,0,1,0,0,0|2,0,1]=4 726 B15R0.366 CCCC(=O)OCSCCCCCCCO 62a_100000760002_100000034017 [0,0,1,0,0,0|2,0,0]=3 727 B15R0.366 CCCC(=O)OCSCCCCCCOC 62a_100011998445_100000034017 [0,0,1,0,0,0|2,0,0]=3 728 B15R0.366 CCCC(=O)OCSCCCOCCOC 62a_100011216529_100000034017 [0,0,1,0,0,0|3,0,0]=4 729 B15R0.366 CCCC(=O)OCSCCOCCOCC 62a_100011211534_100000034017 [0,0,1,0,0,0|3,0,0]=4 730 B15R0.366 CCCC(C)OCCCCCCCCCBr 34a_100009813782_100000766640 [0,0,1,0,0,0|2,0,1]=4 731 B15R0.366 CCCC(C)OCCCCCCCCCBr 7a_100009813782_100000766640 [0,0,1,0,0,0|2,0,1]=4 732 B15R0.366 CCCC(C)OCCCCCCCCCCl 34a_100009868337_100000766640 [0,0,1,0,0,0|2,0,1]=4 733 B15R0.366 CCCC(C)OCCCCCCCCCCl 7a_100009868337_100000766640 [0,0,1,0,0,0|2,0,1]=4 734 B15R0.366 CCCC(C)OCCCCCCCCCN 34a_100000078944_100000766640 [0,0,1,0,0,0|2,0,1]=4 735 B15R0.366 CCCC(C)OCCCCCCCCCO 34a_100000764384_100009813782 [0,0,1,0,0,0|2,0,1]=4 736 B15R0.366 CCCC(C)OCCCCCCCCCO 7a_100000764384_100009813782 [0,0,1,0,0,0|2,0,1]=4 737 B15R0.366 CCCC/C=C\CCOCOC(=O)CCC 34a_200016286491_100000034017 [0,0,1,0,0,0|1,0,2]=4 738 B15R0.366 CCCCC#CCCOCOC(=O)CCC 34a_100000037610_100000034017 [0,0,1,0,0,0|1,0,2]=4 739 B15R0.366 CCCCC/C=C/COCOC(=O)CCC 34a_100016258190_100000034017 [0,0,1,0,0,0|1,0,2]=4 740 B15R0.366 CCCCCC#CCOCOC(=O)CCC 34a_200000033628_100000034017 [0,0,1,0,0,0|1,0,2]=4 741 B15R0.366 CCCCCC#CCSCOC(=O)CCC 62a_100009816472_100000034017 [0,0,1,0,0,0|1,0,2]=4 742 B15R0.366 CCCCCCCCC=NNC(=O)CCC 4a_100000189770_100011218696 [0,0,1,0,0,0|2,0,1]=4 743 B15R0.366 CCCCCCCCCC=CC(=O)CCC 1458a_200015352897_100000210303 [0,0,1,0,0,0|1,0,1]=3 744 B15R0.366 CCCCCCCCCC=CC(=O)CCF 1458a_200015352897_100011217306 [0,0,1,0,0,0|2,0,1]=4 745 B15R0.366 CCCCCCCCCC=CC(=O)CCO 1458a_200015352897_100000211926 [0,0,1,0,0,0|2,0,1]=4 746 B15R0.366 CCCCCCCCCC=CC(=O)NCC 11a_100015525214_200015352897 [0,0,1,0,0,0|2,0,1]=4 747 B15R0.366 CCCCCCCCCC=CC(=O)NCC 240690a_100015525214_200015352897 [0,0,1,0,0,0|2,0,1]=4 748 B15R0.366 CCCCCCCCCCCC(=O)CC#N 1458a_100000210736_100011214920 [0,0,1,0,0,0|2,0,1]=4 749 B15R0.366 CCCCCCCCCCCC(=O)CC#N 1458a_100051588842_100011215454 [0,0,1,0,0,0|2,0,1]=4 750 B15R0.366 CCCCCCCCCCCC(=O)CCC 1458a_100000210736_100000210303 [0,0,1,0,0,0|1,0,0]=2 751 B15R0.366 CCCCCCCCCCCC(=O)CCC 1458a_100000211992_100011215454 [0,0,1,0,0,0|1,0,0]=2 752 B15R0.366 CCCCCCCCCCCC(=O)CCF 1458a_100000210736_100011217306 [0,0,1,0,0,0|2,0,0]=3 753 B15R0.366 CCCCCCCCCCCC(=O)CCO 1458a_100000210736_100000211926 [0,0,1,0,0,0|2,0,0]=3 754 B15R0.366 CCCCCCCCCCCC(=O)CCO 1458a_100011216618_100011215454 [0,0,1,0,0,0|2,0,0]=3 755 B15R0.366 CCCCCCCCCCCC(=O)COC 1458a_100000210968_100011215454 [0,0,1,0,0,0|2,0,0]=3 756 B15R0.366 CCCCCCCCCCCC(=O)CSC 1458a_100000184570_100011215454 [0,0,1,0,0,0|2,0,0]=3 757 B15R0.366 CCCCCCCCCCCC(=O)NCC 11a_100015525214_100000210736 [0,0,1,0,0,0|2,0,0]=3 758 B15R0.366 CCCCCCCCCCCC(=O)NCC 240690a_100015525214_100000210736 [0,0,1,0,0,0|2,0,0]=3 759 B15R0.366 CCCCCCCCCCCC(=O)NNC 22a_100016993582_100000210736 [0,0,1,0,0,0|3,0,0]=4 760 B15R0.366 CCCCCCCCCCCN(C)CCC 2230a_100000747261_100011215454 [0,0,1,0,0,0|3,0,0]=4 761 B15R0.366 CCCCCCCCCCCN(C)CCC 269982a_100000747261_100011215454 [0,0,1,0,0,0|3,0,0]=4 762 B15R0.366 CCCCCCCCCCNC(=O)CC#N 1626a_100000684558_100051588842 [0,0,1,0,0,0|2,0,1]=4 763 B15R0.366 CCCCCCCCCCNC(=O)CC#N 240690a_100000684558_100051588842 [0,0,1,0,0,0|2,0,1]=4 764 B15R0.366 CCCCCCCCCCNC(=O)CCC 11a_100000684558_100000211992 [0,0,1,0,0,0|1,0,0]=2 765 B15R0.366 CCCCCCCCCCNC(=O)CCC 1626a_100000684558_100000211992 [0,0,1,0,0,0|1,0,0]=2 766 B15R0.366 CCCCCCCCCCNC(=O)CCC 240690a_100000684558_100000211992 [0,0,1,0,0,0|1,0,0]=2 767 B15R0.366 CCCCCCCCCCNC(=O)CCC 527a_100000684558_100000211992 [0,0,1,0,0,0|1,0,0]=2 768 B15R0.366 CCCCCCCCCCNC(=O)CCO 240690a_100000684558_100011216618 [0,0,1,0,0,0|2,0,0]=3 769 B15R0.366 CCCCCCCCCCNC(=O)COC 11a_100000684558_100000210968 [0,0,1,0,0,0|2,0,0]=3 770 B15R0.366 CCCCCCCCCCNC(=O)COC 1626a_100000684558_100000210968 [0,0,1,0,0,0|2,0,0]=3 771 B15R0.366 CCCCCCCCCCNC(=O)COC 240690a_100000684558_100000210968 [0,0,1,0,0,0|2,0,0]=3 772 B15R0.366 CCCCCCCCCCNC(=O)COC 527a_100000684558_100000210968 [0,0,1,0,0,0|2,0,0]=3 773 B15R0.366 CCCCCCCCCCNC(=O)CSC 11a_100000684558_100000184570 [0,0,1,0,0,0|2,0,0]=3 774 B15R0.366 CCCCCCCCCCNC(=O)CSC 1626a_100000684558_100000184570 [0,0,1,0,0,0|2,0,0]=3 775 B15R0.366 CCCCCCCCCCNC(=O)CSC 240690a_100000684558_100000184570 [0,0,1,0,0,0|2,0,0]=3 776 B15R0.366 CCCCCCCCCCNC(=O)CSC 527a_100000684558_100000184570 [0,0,1,0,0,0|2,0,0]=3 777 B15R0.366 CCCCCCCCCCNC(=O)NCC 2708a_100000684558_100015525214 [0,0,1,0,0,0|2,0,0]=3 778 B15R0.366 CCCCCCCCCCNC(=O)NCC 2708a_100015525214_100000684558 [0,0,1,0,0,0|2,0,0]=3 779 B15R0.366 CCCCCCCCCCNC(=O)NCC 273464a_100000684558_100015525214 [0,0,1,0,0,0|2,0,0]=3 780 B15R0.366 CCCCCCCCCCNC(=O)NCC 273464a_100015525214_100000684558 [0,0,1,0,0,0|2,0,0]=3 781 B15R0.366 CCCCCCCCCCNC(=O)NCC 512a_100000684558_100015525214 [0,0,1,0,0,0|2,0,0]=3 782 B15R0.366 CCCCCCCCCCNC(=O)NCC 512a_100015525214_100000684558 [0,0,1,0,0,0|2,0,0]=3 783 B15R0.366 CCCCCCCCCCNC(=O)NNC 273464a_100000684558_100016993582 [0,0,1,0,0,0|3,0,0]=4 784 B15R0.366 CCCCCCCCCCNC(=O)NNC 512a_100000684558_100016993582 [0,0,1,0,0,0|3,0,0]=4 785 B15R0.366 CCCCCCCCCCNC(=O)NNC 512a_100016993582_100000684558 [0,0,1,0,0,0|3,0,0]=4 786 B15R0.366 CCCCCCCCCCNC(C)CCC 2230a_100000684558_100000766640 [0,0,1,0,0,0|2,0,1]=4 787 B15R0.366 CCCCCCCCCCNC(C)CCC 2230a_100000741246_100000210320 [0,0,1,0,0,0|2,0,1]=4 788 B15R0.366 CCCCCCCCCCNC(C)CCC 270004a_100000684558_100000211909 [0,0,1,0,0,0|2,0,1]=4 789 B15R0.366 CCCCCCCCCCNC(C)CCC 34a_100000684558_100000766640 [0,0,1,0,0,0|2,0,1]=4 790 B15R0.366 CCCCCCCCCCOC(=O)CNC 2230a_106832991635_100000210668 [0,0,1,0,0,0|1,0,0]=2 791 B15R0.366 CCCCCCCCCCOC(=O)CNC 34a_100102657272_100000210668 [0,0,1,0,0,0|1,0,0]=2 792 B15R0.366 CCCCCCCCCCOC(=O)CNC 7a_106832991635_100000210668 [0,0,1,0,0,0|1,0,0]=2 793 B15R0.366 CCCCCCCCCCOC(=O)COC 34a_100138415774_100000210668 [0,0,1,0,0,0|1,0,0]=2 794 B15R0.366 CCCCCCCCCCOC(=O)CSC 62a_100000680656_200000210301 [0,0,1,0,0,0|1,0,0]=2 795 B15R0.366 CCCCCCCCCCOC(=O)CSC 62a_200000210301_100000680656 [0,0,1,0,0,0|1,0,0]=2 796 B15R0.366 CCCCCCCCCCOC(=O)CS[13CH3] 62a_100000680656_200025704644 [0,0,1,0,0,0|1,0,0]=2 797 B15R0.366 CCCCCCCCCCOC(=O)CS[13CH3] 62a_200025704644_100000680656 [0,0,1,0,0,0|1,0,0]=2 798 B15R0.366 CCCCCCCCCCOC(C)CCBr 34a_100012276601_100000210320 [0,0,1,0,0,0|2,0,1]=4 799 B15R0.366 CCCCCCCCCCOC(C)CCC 34a_100000210711_100000766640 [0,0,1,0,0,0|1,0,1]=3 800 B15R0.366 CCCCCCCCCCOC(C)CCC 34a_100000764384_100000210320 [0,0,1,0,0,0|1,0,1]=3 801 B15R0.366 CCCCCCCCCCOC(C)CCC 7a_100000210711_100000766640 [0,0,1,0,0,0|1,0,1]=3 802 B15R0.366 CCCCCCCCCCOC(C)CCC 7a_100000764384_100000210320 [0,0,1,0,0,0|1,0,1]=3 803 B15R0.366 CCCCCCCCCCOC(C)CCO 34a_100000210711_100009893172 [0,0,1,0,0,0|2,0,1]=4 804 B15R0.366 CCCCCCCCCCOC(C)CCO 7a_100000210711_100009893172 [0,0,1,0,0,0|2,0,1]=4 805 B15R0.366 CCCCCCCCCCOC(C)COC 34a_100000210711_100000765312 [0,0,1,0,0,0|2,0,1]=4 806 B15R0.366 CCCCCCCCCCOC(C)COC 7a_100000210711_100000765312 [0,0,1,0,0,0|2,0,1]=4 807 B15R0.366 CCCCCCCCCCO[C@H](C)COC 34a_100011934205_100000210320 [0,0,1,0,0,0|2,0,1]=4 808 B15R0.366 CCCCCCCCCNCC(=O)CCC 2230a_100000212291_100000747444 [0,0,1,0,0,0|2,0,0]=3 809 B15R0.366 CCCCCCCCCNCC(=O)NCC 2230a_100000212291_100000183381 [0,0,1,0,0,0|3,0,0]=4 810 B15R0.366 CCCCCCCCCNCC(=O)NCC 2230a_100016988866_100011214924 [0,0,1,0,0,0|3,0,0]=4 811 B15R0.366 CCCCCCCCCNCC(=O)NCC 34a_100000212291_100000183381 [0,0,1,0,0,0|3,0,0]=4 812 B15R0.366 CCCCCCCCCNCC(=O)OCC 2230a_100000212291_100000188475 [0,0,1,0,0,0|3,0,0]=4 813 B15R0.366 CCCCCCCCCNCC(=O)OCC 34a_100000212291_100000188475 [0,0,1,0,0,0|3,0,0]=4 814 B15R0.366 CCCCCCCCCOCC(=O)CCC 7a_100000210712_100000747444 [0,0,1,0,0,0|2,0,0]=3 815 B15R0.366 CCCCCCCCCOCC(=O)NCC 34a_100000210712_100000183381 [0,0,1,0,0,0|3,0,0]=4 816 B15R0.366 CCCCCCCCCOCC(=O)NCC 7a_100000210712_100000183381 [0,0,1,0,0,0|3,0,0]=4 817 B15R0.366 CCCCCCCCCOCC(=O)OCC 34a_100000210712_100000188475 [0,0,1,0,0,0|3,0,0]=4 818 B15R0.366 CCCCCCCCCOCC(=O)OCC 7a_100000210712_100000188475 [0,0,1,0,0,0|3,0,0]=4 819 B15R0.366 CCCCCCCCCSCC(=O)CCC 62a_100000747444_100000210670 [0,0,1,0,0,0|2,0,0]=3 820 B15R0.366 CCCCCCCCCSCC(=O)NCC 62a_100000183381_100000210670 [0,0,1,0,0,0|3,0,0]=4 821 B15R0.366 CCCCCCCCCSCC(=O)OCC 62a_100000188475_100000210670 [0,0,1,0,0,0|3,0,0]=4 822 B15R0.366 CCCCCCCCNCCC(=O)NCC 2230a_100000229939_100000737597 [0,0,1,0,0,0|3,0,0]=4 823 B15R0.366 CCCCCCCCNCCC(=O)NCC 34a_100025743525_100000210759 [0,0,1,0,0,0|3,0,0]=4 824 B15R0.366 CCCCCCCCNCCC(=O)OCC 2230a_100000229939_100011206558 [0,0,1,0,0,0|3,0,0]=4 825 B15R0.366 CCCCCCCCNCCC(=O)OCC 34a_100000229939_100000765890 [0,0,1,0,0,0|3,0,0]=4 826 B15R0.366 CCCCCCCCNCOC(=O)CCC 2230a_100000229939_100000034017 [0,0,1,0,0,0|1,0,0]=2 827 B15R0.366 CCCCCCCCNCOC(=O)CCC 34a_100000229939_100000034017 [0,0,1,0,0,0|1,0,0]=2 828 B15R0.366 CCCCCCCCOCCC(=O)NCC 7a_100000210232_100000737597 [0,0,1,0,0,0|3,0,0]=4 829 B15R0.366 CCCCCCCCOCCC(=O)OCC 34a_100000210232_100000765890 [0,0,1,0,0,0|3,0,0]=4 830 B15R0.366 CCCCCCCCOCCC(=O)OCC 7a_100000210232_100011206558 [0,0,1,0,0,0|3,0,0]=4 831 B15R0.366 CCCCCCCCOCOC(=O)CCC 34a_100000210232_100000034017 [0,0,1,0,0,0|1,0,0]=2 832 B15R0.366 CCCCCCCCSCCC(=O)NCC 62a_100000210759_100000737597 [0,0,1,0,0,0|3,0,0]=4 833 B15R0.366 CCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210317 [0,0,1,0,0,0|3,0,0]=4 834 B15R0.366 CCCCCCCCSCCC(=O)OCC 62a_100000210759_100000765890 [0,0,1,0,0,0|3,0,0]=4 835 B15R0.366 CCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210317 [0,0,1,0,0,0|3,0,0]=4 836 B15R0.366 CCCCCCCCSCOC(=O)CCC 62a_100000210759_100000034017 [0,0,1,0,0,0|1,0,0]=2 837 B15R0.366 CCCCCCCCSCOC(=O)OCC 62a_100000210759_100000075025 [0,0,1,0,0,0|2,0,0]=3 838 B15R0.366 CCCCCCCNCCCC(=O)OCC 2230a_100000229938_100009991533 [0,0,1,0,0,0|3,0,0]=4 839 B15R0.366 CCCCCCCOCCCC(=O)OCC 34a_100000210272_100009991533 [0,0,1,0,0,0|3,0,0]=4 840 B15R0.366 CCCCCCCOCCCC(=O)OCC 7a_100000210272_100011215271 [0,0,1,0,0,0|3,0,0]=4 841 B15R0.366 CCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210614 [0,0,1,0,0,0|3,0,0]=4 842 B15R0.366 CCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210614 [0,0,1,0,0,0|3,0,0]=4 843 B15R0.366 CCCCCCCOCCNC(=O)OCC 7a_100000210272_200011445536 [0,0,1,0,0,0|3,0,0]=4 844 B15R0.366 CCCCCCCSCCCC(=O)OCC 62a_100000210614_100009991533 [0,0,1,0,0,0|3,0,0]=4 845 B15R0.366 CCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210316 [0,0,1,0,0,0|3,0,0]=4 846 B15R0.366 CCCCCCCSCCNC(=O)OCC 62a_100000210614_200011445536 [0,0,1,0,0,0|3,0,0]=4 847 B15R0.366 CCCCCCNCCCCC(=O)OCC 2230a_100000210581_100000750268 [0,0,1,0,0,0|3,0,0]=4 848 B15R0.366 CCCCCCOCCCCC(=O)OCC 34a_100000210259_100000750268 [0,0,1,0,0,0|3,0,0]=4 849 B15R0.366 CCCCCCOCCCCC(=O)OCC 7a_100000210259_100000750268 [0,0,1,0,0,0|3,0,0]=4 850 B15R0.366 CCCCCCOCCOCC(=O)CCC 7a_100000691444_100000747444 [0,0,1,0,0,0|3,0,0]=4 851 B15R0.366 CCCCCCSCCCCC(=O)OCC 62a_100000210314_100000750268 [0,0,1,0,0,0|3,0,0]=4 852 B15R0.366 CCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210757 [0,0,1,0,0,0|3,0,0]=4 853 B15R0.366 CCCCCNCCCCCC(=O)OCC 2230a_100000209983_100000755133 [0,0,1,0,0,0|3,0,0]=4 854 B15R0.366 CCCCCNCCOCOC(=O)CCC 34a_100000224656_100000034017 [0,0,1,0,0,0|2,0,0]=3 855 B15R0.366 CCCCCOCCCCCC(=O)OCC 34a_100000210253_100000755133 [0,0,1,0,0,0|3,0,0]=4 856 B15R0.366 CCCCCOCCCCCC(=O)OCC 7a_100000210253_100000755133 [0,0,1,0,0,0|3,0,0]=4 857 B15R0.366 CCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210326 [0,0,1,0,0,0|3,0,0]=4 858 B15R0.366 CCCCCOCCOCOC(=O)CCC 34a_100011215259_100000034017 [0,0,1,0,0,0|2,0,0]=3 859 B15R0.366 CCCCCSCCCCCC(=O)OCC 62a_100000210326_100000755133 [0,0,1,0,0,0|3,0,0]=4 860 B15R0.366 CCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210326 [0,0,1,0,0,0|3,0,0]=4 861 B15R0.366 CCCCNCCCCCCC(=O)OCC 2230a_100000102301_100009814379 [0,0,1,0,0,0|3,0,0]=4 862 B15R0.366 CCCCNCCCCCCC(=O)OCC 7a_106832991798_100009814379 [0,0,1,0,0,0|3,0,0]=4 863 B15R0.366 CCCCOCCCCCCC(=O)OCC 34a_100000210227_100009814379 [0,0,1,0,0,0|3,0,0]=4 864 B15R0.366 CCCCOCCCCCCC(=O)OCC 7a_100000210227_100009814379 [0,0,1,0,0,0|3,0,0]=4 865 B15R0.366 CCCCOCCCCOCC(=O)CCC 7a_200000760531_100000747444 [0,0,1,0,0,0|3,0,0]=4 866 B15R0.366 CCCCOCCCNCOC(=O)CCC 2230a_200000211371_100000034017 [0,0,1,0,0,0|2,0,0]=3 867 B15R0.366 CCCCOCCCNCOC(=O)CCC 34a_200000211371_100000034017 [0,0,1,0,0,0|2,0,0]=3 868 B15R0.366 CCCCOCCCOCOC(=O)CCC 34a_200011215613_100000034017 [0,0,1,0,0,0|2,0,0]=3 869 B15R0.366 CCCCSCCCCCCC(=O)OCC 62a_100000210211_100009814379 [0,0,1,0,0,0|3,0,0]=4 870 B15R0.366 CCCOCCCCCCCC(=O)OCC 34a_100000210258_100009991516 [0,0,1,0,0,0|3,0,0]=4 871 B15R0.366 CCCSCCCCCCCC(=O)OCC 62a_100000210303_100009991516 [0,0,1,0,0,0|3,0,0]=4 872 B15R0.366 CCNC(=O)CCCCCCCCCCO 240690a_100015525214_200000016029 [0,0,1,0,0,0|3,0,0]=4 873 B15R0.366 CCNC(=O)NCCCCCCCCCO 2708a_100000078944_100015525214 [0,0,1,0,0,0|3,0,0]=4 874 B15R0.366 CCNC(=O)NCCCCCCCCCO 2708a_100015525214_100000078944 [0,0,1,0,0,0|3,0,0]=4 875 B15R0.366 CCNC(=O)NCCCCCCCCCO 273464a_100000078944_100015525214 [0,0,1,0,0,0|3,0,0]=4 876 B15R0.366 CCNC(=O)NCCCCCCCCCO 273464a_100015525214_100000078944 [0,0,1,0,0,0|3,0,0]=4 877 B15R0.366 CCNC(=O)NCCCCCCCCCO 512a_100000078944_100015525214 [0,0,1,0,0,0|3,0,0]=4 878 B15R0.366 CCNC(=O)NCCCCCCCCCO 512a_100015525214_100000078944 [0,0,1,0,0,0|3,0,0]=4 879 B15R0.366 CCNCCCCCCCCC(=O)OCC 2230a_100015525214_100010175975 [0,0,1,0,0,0|3,0,0]=4 880 B15R0.366 CCOC(=O)CCCCCCCCCNC 2230a_106832991635_100009828014 [0,0,1,0,0,0|3,0,0]=4 881 B15R0.366 CCOC(=O)CCCCCCCCCNC 34a_100102657272_100009828014 [0,0,1,0,0,0|3,0,0]=4 882 B15R0.366 CCOC(=O)CCCCCCCCCNC 7a_106832991635_100009828014 [0,0,1,0,0,0|3,0,0]=4 883 B15R0.366 CCOC(=O)CCCCCCCCCOC 34a_100138415774_100009828014 [0,0,1,0,0,0|3,0,0]=4 884 B15R0.366 CCOC(=O)CCCCCCCCCSC 62a_200000210301_100009828014 [0,0,1,0,0,0|3,0,0]=4 885 B15R0.366 CCOC(=O)CCCCCCCCCS[13CH3] 62a_200025704644_100009828014 [0,0,1,0,0,0|3,0,0]=4 886 B15R0.366 CCOC(=O)CCCCCCCCSCC 62a_100000210202_100010175975 [0,0,1,0,0,0|3,0,0]=4 887 B15R0.366 CCOC(=O)OCSCCCCCCCO 62a_100000760002_100000075025 [0,0,1,0,0,0|3,0,0]=4 888 B15R0.366 CCOC(=O)OCSCCCCCCOC 62a_100011998445_100000075025 [0,0,1,0,0,0|3,0,0]=4 889 B15R0.366 CCOCCCCCCCCC(=O)OCC 34a_100121572206_100010175975 [0,0,1,0,0,0|3,0,0]=4 890 B15R0.366 COCC(=O)CCCCCCCCCCO 1458a_100000210968_100009813290 [0,0,1,0,0,0|3,0,0]=4 891 B15R0.366 COCC(=O)NCCCCCCCCCO 240690a_100000078944_100000210968 [0,0,1,0,0,0|3,0,0]=4 892 B15R0.366 CSCC(=O)CCCCCCCCCCO 1458a_100000184570_100009813290 [0,0,1,0,0,0|3,0,0]=4 893 B15R0.366 CSCC(=O)NCCCCCCCCCO 240690a_100000078944_100000184570 [0,0,1,0,0,0|3,0,0]=4 894 B15R0.366 O=C(CCO)CCCCCCCCCCO 1458a_100011216618_100009813290 [0,0,1,0,0,0|3,0,0]=4 895 B15R0.366 O=C(CCO)NCCCCCCCCCO 240690a_100000078944_100011216618 [0,0,1,0,0,0|3,0,0]=4 896 B15R0.1998 C=C(C)CN(CC)CCCCCCCCC 2230a_100000211296_100011214924 [0,0,1,0,0,0|3,0,0]=4 897 B15R0.1998 C=C(C)CN(CC)CCCCCCCCC 269982a_100000211296_100000210670 [0,0,1,0,0,0|3,0,0]=4 898 B15R0.1998 CCCCCCCCCN(CC)CC(=O)O 269956a_100000746405_100000210670 [0,0,1,0,0,0|3,0,0]=4 899 B15R0.1998 CCCCCCCCN[C@H](CC)CC(=O)O 269956a_100016995926_100000210759 [0,0,1,0,0,0|3,0,0]=4 900 B15R0.2001 C/C=C/C(CCC)OCCCCCCCC 34a_200016264281_100000210759 [0,0,1,0,0,0|3,0,0]=4 901 B15R0.2001 C/C=C/C(CCC)OCCCCCCCC 7a_200016264281_100000210759 [0,0,1,0,0,0|3,0,0]=4 902 B15R0.2001 C=CCC(CCC)OCCCCCCCC 34a_100011215139_100000210759 [0,0,1,0,0,0|3,0,0]=4 903 B15R0.2001 C=CCC(CCC)OCCCCCCCC 7a_100011215139_100000210759 [0,0,1,0,0,0|3,0,0]=4 904 B15R0.3221 CCCCCCCCCC(=O)CC(=O)CC 1458a_100000210558_100000747405 [0,0,1,0,0,0|2,0,1]=4 905 B15R0.3221 CCCCCCCCCC(C)NC(C)CC 270004a_100000209981_100011215753 [0,0,1,0,0,0|2,0,1]=4 906 B15R0.3221 CCCCCCCCCC(C)OC(C)CC 34a_100011218016_100011215416 [0,0,1,0,0,0|1,0,1]=3 907 B15R0.3221 CCCCCCCCCC(C)OC(C)CC 7a_100011218016_100000758301 [0,0,1,0,0,0|1,0,1]=3 908 B15R0.3221 CCCCCCCCCC(C)OC(C)CO 34a_100011218016_100012180447 [0,0,1,0,0,0|2,0,1]=4 909 B15R0.3221 CCCCCCCCCC(C)OC(C)CO 7a_100011218016_100012180447 [0,0,1,0,0,0|2,0,1]=4 910 B15R0.3221 CCCCCCCCCC(O)CC(=O)NC 1626a_100102657272_200012339438 [0,0,1,0,0,0|3,0,0]=4 911 B15R0.3221 CCCCCCCCCC(O)CC(=O)NC 240690a_100102657272_200012339438 [0,0,1,0,0,0|3,0,0]=4 912 B15R0.3221 CCCCCCCCCN(C)CC(=O)CC 269982a_100000232482_100000747405 [0,0,1,0,0,0|2,0,0]=3 913 B15R0.3221 CCCCCCCCCN(C)CC(=O)NC 2230a_100000189611_100011214924 [0,0,1,0,0,0|3,0,0]=4 914 B15R0.3221 CCCCCCCCCN(C)CC(=O)NC 2230a_100000232482_100000183359 [0,0,1,0,0,0|3,0,0]=4 915 B15R0.3221 CCCCCCCCCN(C)CC(=O)NC 269982a_100000232482_100000183359 [0,0,1,0,0,0|3,0,0]=4 916 B15R0.3221 CCCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100011214924 [0,0,1,0,0,0|3,0,0]=4 917 B15R0.3221 CCCCCCCCCN(C)CC(=O)OC 2230a_100000232482_100000747449 [0,0,1,0,0,0|3,0,0]=4 918 B15R0.3221 CCCCCCCCCN(C)CC(=O)OC 269982a_100000232482_100000747449 [0,0,1,0,0,0|3,0,0]=4 919 B15R0.3221 CCCCCCCCNC(C)CC(=O)OC 2230a_100000229939_100009817358 [0,0,1,0,0,0|3,0,0]=4 920 B15R0.3221 CCCCCCCCNC(C)CC(=O)OC 34a_100000229939_100009817358 [0,0,1,0,0,0|3,0,0]=4 921 B15R0.3221 CCCCCCCCOC(C)CC(=O)OC 34a_100000210232_100009817358 [0,0,1,0,0,0|3,0,0]=4 922 B15R0.3221 CCCCCCCCOC(C)CC(=O)OC 7a_100000210232_100009817358 [0,0,1,0,0,0|3,0,0]=4 923 B15R0.3221 CCCCCCCCSC(C)CC(=O)OC 62a_100000210759_100009817358 [0,0,1,0,0,0|3,0,0]=4 924 B15R0.3221 CCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100000210317 [0,0,1,0,0,0|3,0,0]=4 925 B17R2.86 CCCC1CCCCC1N2CCNC(=O)C2 270004a_100000184651_100011218038 [0,0,0,1,0,0|3,0,0]=4 926 B17R2.86 CCCC1CCCCC1N2CCOC(=O)C2 270004a_100000131268_100011218038 [0,0,0,1,0,0|3,0,0]=4 927 B17R2.91 CCCC1CCCC1NC2CCNC(=O)C2 269862a_100016994916_100000723119 [0,0,0,1,0,0|3,0,0]=4 928 B17R2.261 CCC1CCCCC1NC2CCNC(=O)C2 269862a_100016994916_100000757040 [0,0,0,1,0,0|3,0,0]=4 929 B17R2.2485 CCCCC1CCCC1N2CCNC(=O)C2 270004a_100000184651_100000750825 [0,0,0,1,0,0|3,0,0]=4 930 B17R2.2485 CCCCC1CCCC1N2CCOC(=O)C2 270004a_100000131268_100000750825 [0,0,0,1,0,0|3,0,0]=4 931 B17R2.3366 CC1=CC(CCC1)OCCCC2CCCC2 34a_100011218613_100011713738 [0,0,0,1,0,0|3,0,0]=4 932 B17R2.3366 O=C1CC(CCN1)COCCC2CCCC2 34a_100009886756_100000760354 [0,0,0,1,0,0|3,0,0]=4 933 B17R2.3366 O=C1CC(CCN1)NCCCC2CCCC2 2230a_100016994916_100011713738 [0,0,0,1,0,0|3,0,0]=4 934 B17R2.3366 O=C1CC(CCN1)NCCCC2CCCC2 34a_100016994916_100011713738 [0,0,0,1,0,0|3,0,0]=4 935 B17R2.3366 O=C1CCCC(C1)OCCCC2CCCC2 34a_100012613340_100011713738 [0,0,0,1,0,0|2,0,0]=3 936 B17R2.3366 O=C1CCCC(C1)OCCCN2CCCC2 34a_100012613340_100016991639 [0,0,0,1,0,0|3,0,0]=4 937 B17R2.3366 O=C1CCCC(N1)COCCC2CCCC2 34a_200000102386_100000760354 [0,0,0,1,0,0|2,0,0]=3 938 B17R2.3366 O=C1COCC(N1)COCCC2CCCC2 34a_200000101122_100000760354 [0,0,0,1,0,0|3,0,0]=4 939 B17R2.3366 O=C1C[C@@H](CCN1)OCCCC2CCCC2 34a_100015189427_100011713738 [0,0,0,1,0,0|3,0,0]=4 940 B17R2.3373 CN1CCCC1CCOC2CCCC(=O)C2 34a_100012613340_100000005710 [0,0,0,1,0,0|3,0,0]=4 941 B17R2.5301 CC1=CC(CCC1)OCCC2CCCCC2 34a_100011218613_100011209188 [0,0,0,1,0,0|3,0,0]=4 942 B17R2.5301 O=C1CC(CCN1)COCC2CCCCC2 34a_100009886756_100000211423 [0,0,0,1,0,0|3,0,0]=4 943 B17R2.5301 O=C1CC(CCN1)NCCC2CCCCC2 2230a_100016994916_100012355289 [0,0,0,1,0,0|3,0,0]=4 944 B17R2.5301 O=C1CC(CCN1)NCCC2CCCCC2 34a_100016994916_100011209188 [0,0,0,1,0,0|3,0,0]=4 945 B17R2.5301 O=C1CCCC(C1)OCCC2CCCCC2 34a_100012613340_100011209188 [0,0,0,1,0,0|2,0,0]=3 946 B17R2.5301 O=C1CCCC(C1)OCCC2CCOCC2 34a_100012613340_100011934994 [0,0,0,1,0,0|3,0,0]=4 947 B17R2.5301 O=C1CCCC(C1)OCCN2CCCCC2 34a_100012613340_100000739454 [0,0,0,1,0,0|3,0,0]=4 948 B17R2.5301 O=C1CCCC(C1)OCOC2CCCCC2 34a_100012613340_100011935260 [0,0,0,1,0,0|3,0,0]=4 949 B17R2.5301 O=C1CCCC(N1)COCC2CCCCC2 34a_200000102386_100000211423 [0,0,0,1,0,0|2,0,0]=3 950 B17R2.5301 O=C1CCCC(N1)COCC2CCCCO2 34a_200000102386_100000211543 [0,0,0,1,0,0|3,0,0]=4 951 B17R2.5301 O=C1CCCC(N1)COCC2CCCOC2 34a_200000102386_100000741521 [0,0,0,1,0,0|3,0,0]=4 952 B17R2.5301 O=C1CCCC(N1)COCC2CCOCC2 34a_200000102386_100000754603 [0,0,0,1,0,0|3,0,0]=4 953 B17R2.5301 O=C1CN(CCN1)CCCC2CCCCC2 2230a_100000184651_100011713725 [0,0,0,1,0,0|3,0,0]=4 954 B17R2.5301 O=C1CN(CCO1)CCCC2CCCCC2 2230a_100000131268_100011713725 [0,0,0,1,0,0|3,0,0]=4 955 B17R2.5301 O=C1COCC(N1)COCC2CCCCC2 34a_200000101122_100000211423 [0,0,0,1,0,0|3,0,0]=4 956 B17R2.5301 O=C1C[C@@H](CCN1)OCCC2CCCCC2 34a_100015189427_100011209188 [0,0,0,1,0,0|3,0,0]=4 957 B17R2.19530 CC1=CC(CCC1)OCC2CCCCCC2 34a_100011218613_200000696569 [0,0,0,1,0,0|3,0,0]=4 958 B17R2.19530 O=C1CC(CCN1)COC2CCCCCC2 34a_100009886756_100011217769 [0,0,0,1,0,0|3,0,0]=4 959 B17R2.19530 O=C1CC(CCN1)NCC2CCCCCC2 2230a_100016994916_200000696569 [0,0,0,1,0,0|3,0,0]=4 960 B17R2.19530 O=C1CC(CCN1)NCC2CCCCCC2 269862a_100016994916_200000763224 [0,0,0,1,0,0|3,0,0]=4 961 B17R2.19530 O=C1CC(CCN1)NCC2CCCCCC2 34a_100016994916_200000696569 [0,0,0,1,0,0|3,0,0]=4 962 B17R2.19530 O=C1CCCC(C1)OCC2CCCCCC2 34a_100012613340_200000696569 [0,0,0,1,0,0|2,0,0]=3 963 B17R2.19530 O=C1CCCC(N1)COC2CCCCCC2 34a_200000102386_100011217769 [0,0,0,1,0,0|2,0,0]=3 964 B17R2.19530 O=C1COCC(N1)COC2CCCCCC2 34a_200000101122_100011217769 [0,0,0,1,0,0|3,0,0]=4 965 B17R2.19530 O=C1C[C@@H](CCN1)OCC2CCCCCC2 34a_100015189427_200000696569 [0,0,0,1,0,0|3,0,0]=4 966 B17R2.19565 O=C1CN(CCN1)C2CCCCCCCC2 270004a_100000184651_100000038600 [0,0,0,1,0,0|3,0,0]=4 967 B17R2.19565 O=C1CN(CCO1)C2CCCCCCCC2 270004a_100000131268_100000038600 [0,0,0,1,0,0|3,0,0]=4 968 B17R2.41893 CN1CCCCC1COC2CCCC(=O)C2 34a_100012613340_100015186950 [0,0,0,1,0,0|3,0,0]=4 969 B17R2.41893 O=C1CCCC(N1)COC2CCCCC2F 34a_200000102386_100015423560 [0,0,0,1,0,0|3,0,0]=4 970 B17R2.41893 O=C1CCCC(N1)COC2CCCCC2O 34a_200000102386_100000038908 [0,0,0,1,0,0|3,0,0]=4 971 B15R1.34 CCCCCCCCCN1CNC(=O)C1 2230a_200000708111_100011214924 [0,0,0,0,1,0|3,0,0]=4 972 B15R1.34 CCCCCCCCNC1CNC(=O)C1 2230a_100000697751_100000210759 [0,0,0,0,1,0|3,0,0]=4 973 B15R1.34 CCCCCCCCNC1COC(=O)O1 34a_100000229939_100000032252 [0,0,0,0,1,0|2,0,0]=3 974 B15R1.34 CCCCCCCCOC1CCC(=O)C1 34a_100012614533_100000210759 [0,0,0,0,1,0|2,0,0]=3 975 B15R1.34 CCCCCCCCOC1CNC(=O)C1 34a_100000690082_100000210759 [0,0,0,0,1,0|3,0,0]=4 976 B15R1.34 CCCCCCCCOC1COC(=O)O1 34a_100000210232_100000032252 [0,0,0,0,1,0|2,0,0]=3 977 B15R1.34 CCCCCCCCSC1COC(=O)O1 62a_100000210759_100000032252 [0,0,0,0,1,0|2,0,0]=3 978 B15R1.34 CCCCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210681 [0,0,0,0,1,0|3,0,0]=4 979 B15R1.34 CCCCCCCNCC1CNC(=O)C1 34a_100016993742_100000210614 [0,0,0,0,1,0|3,0,0]=4 980 B15R1.34 CCCCCCCNCC1CNC(=O)O1 2230a_100000229938_100000181169 [0,0,0,0,1,0|2,0,0]=3 981 B15R1.34 CCCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000229938_100015189358 [0,0,0,0,1,0|2,0,0]=3 982 B15R1.34 CCCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210681 [0,0,0,0,1,0|2,0,0]=3 983 B15R1.34 CCCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210614 [0,0,0,0,1,0|2,0,0]=3 984 B15R1.34 CCCCCCCNC[C@H]1COC(=O)N1 2230a_100000229938_100015307671 [0,0,0,0,1,0|3,0,0]=4 985 B15R1.34 CCCCCCCOCC1CCC(=O)N1 34a_100000737831_100000210614 [0,0,0,0,1,0|2,0,0]=3 986 B15R1.34 CCCCCCCOCC1CNC(=O)C1 34a_100016041077_100000210614 [0,0,0,0,1,0|3,0,0]=4 987 B15R1.34 CCCCCCCOCC1CNC(=O)O1 34a_100000210272_100000181169 [0,0,0,0,1,0|2,0,0]=3 988 B15R1.34 CCCCCCCOCC1CNC(=O)O1 34a_100011315639_100000210614 [0,0,0,0,1,0|2,0,0]=3 989 B15R1.34 CCCCCCCOCC1CNC(=O)O1 7a_100000210272_100000181169 [0,0,0,0,1,0|2,0,0]=3 990 B15R1.34 CCCCCCCOCC1COC(=O)O1 34a_100000210272_100000073702 [0,0,0,0,1,0|2,0,0]=3 991 B15R1.34 CCCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210272_100015189358 [0,0,0,0,1,0|2,0,0]=3 992 B15R1.34 CCCCCCCOC[C@H]1COC(=O)N1 34a_100000210272_100015307671 [0,0,0,0,1,0|3,0,0]=4 993 B15R1.34 CCCCCCCOC[C@H]1COC(=O)N1 7a_100000210272_100015307671 [0,0,0,0,1,0|3,0,0]=4 994 B15R1.34 CCCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210316 [0,0,0,0,1,0|2,0,0]=3 995 B15R1.34 CCCCCCCSCC1CNC(=O)O1 62a_100000210614_100000181169 [0,0,0,0,1,0|2,0,0]=3 996 B15R1.34 CCCCCCCSCC1COC(=O)O1 62a_100000073702_100000210316 [0,0,0,0,1,0|2,0,0]=3 997 B15R1.34 CCCCCCCSCC1COC(=O)O1 62a_100000210614_100000073702 [0,0,0,0,1,0|2,0,0]=3 998 B15R1.34 CCCCCCCSC[C@@H]1CCC(=O)N1 62a_100000210614_100015189358 [0,0,0,0,1,0|2,0,0]=3 999 B15R1.34 CCCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210316 [0,0,0,0,1,0|2,0,0]=3 1000 B15R1.34 CCCCCCCSC[C@H]1COC(=O)N1 62a_100000210614_100015307671 [0,0,0,0,1,0|3,0,0]=4 1001 B15R1.34 CCCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210316 [0,0,0,0,1,0|3,0,0]=4 1002 B15R1.34 CCCCCCOCCC1COS(=O)O1 7a_100000210259_100009840081 [0,0,0,0,1,0|3,0,0]=4 1003 B15R1.34 CCCCCCSCCC1COS(=O)O1 62a_100000210314_100009840081 [0,0,0,0,1,0|3,0,0]=4 1004 B15R1.34 CCCCCNCCOC1COC(=O)O1 34a_100000224656_100000032252 [0,0,0,0,1,0|3,0,0]=4 1005 B15R1.34 CCCCCOCCOC1COC(=O)O1 34a_100011215259_100000032252 [0,0,0,0,1,0|3,0,0]=4 1006 B15R1.34 CCCCOCCCNC1COC(=O)O1 34a_200000211371_100000032252 [0,0,0,0,1,0|3,0,0]=4 1007 B15R1.34 CCCCOCCCOC1COC(=O)O1 34a_200011215613_100000032252 [0,0,0,0,1,0|3,0,0]=4 1008 B15R1.34 CCCCOCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000743108 [0,0,0,0,1,0|3,0,0]=4 1009 B15R1.34 CCCCOCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000743108 [0,0,0,0,1,0|3,0,0]=4 1010 B15R1.34 CCCCOCCOCC1CCC(=O)N1 34a_100000737831_100000743108 [0,0,0,0,1,0|3,0,0]=4 1011 B15R1.34 CCCCOCCOCC1CNC(=O)O1 34a_100000210238_100000181169 [0,0,0,0,1,0|3,0,0]=4 1012 B15R1.34 CCCCOCCOCC1CNC(=O)O1 34a_100011315639_100000743108 [0,0,0,0,1,0|3,0,0]=4 1013 B15R1.34 CCCCOCCOCC1CNC(=O)O1 7a_100000210238_100000181169 [0,0,0,0,1,0|3,0,0]=4 1014 B15R1.34 CCCCOCCOCC1COC(=O)O1 34a_100000210238_100000073702 [0,0,0,0,1,0|3,0,0]=4 1015 B15R1.34 CCCCOCCOC[C@@H]1CCC(=O)N1 7a_100000210238_100015189358 [0,0,0,0,1,0|3,0,0]=4 1016 B15R1.34 CCCCOCCSCC1CNC(=O)O1 62a_100000181169_100000743108 [0,0,0,0,1,0|3,0,0]=4 1017 B15R1.34 CCCCOCCSCC1CNC(=O)O1 62a_100000743108_100000181169 [0,0,0,0,1,0|3,0,0]=4 1018 B15R1.34 CCCCOCCSCC1COC(=O)O1 62a_100000073702_100000743108 [0,0,0,0,1,0|3,0,0]=4 1019 B15R1.34 CCCCOCCSCC1COC(=O)O1 62a_100000743108_100000073702 [0,0,0,0,1,0|3,0,0]=4 1020 B15R1.34 CCCCOCCSC[C@@H]1CCC(=O)N1 62a_100000743108_100015189358 [0,0,0,0,1,0|3,0,0]=4 1021 B15R1.34 CCCCOCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000743108 [0,0,0,0,1,0|3,0,0]=4 1022 B15R1.34 CCCCSCCNCC1CNC(=O)O1 2230a_100025743550_100000181169 [0,0,0,0,1,0|3,0,0]=4 1023 B15R1.34 CCCCSCCNC[C@@H]1CCC(=O)N1 2230a_100025743550_100015189358 [0,0,0,0,1,0|3,0,0]=4 1024 B15R1.34 CCCCSCCOCC1CNC(=O)O1 34a_200000230436_100000181169 [0,0,0,0,1,0|3,0,0]=4 1025 B15R1.34 CCCCSCCOCC1CNC(=O)O1 7a_200000230436_100000181169 [0,0,0,0,1,0|3,0,0]=4 1026 B15R1.34 CCCCSCCOCC1COC(=O)O1 34a_200000230436_100000073702 [0,0,0,0,1,0|3,0,0]=4 1027 B15R1.34 CCCCSCCOC[C@@H]1CCC(=O)N1 7a_200000230436_100015189358 [0,0,0,0,1,0|3,0,0]=4 1028 B15R1.34 CCCOCCCNCC1CNC(=O)O1 2230a_100011217757_100000181169 [0,0,0,0,1,0|3,0,0]=4 1029 B15R1.34 CCCOCCCNCC1CNC(=O)O1 34a_100011217757_100000181169 [0,0,0,0,1,0|3,0,0]=4 1030 B15R1.34 CCCOCCCNCC1COC(=O)O1 34a_100011217757_100000073702 [0,0,0,0,1,0|3,0,0]=4 1031 B15R1.34 CCCOCCCNC[C@@H]1CCC(=O)N1 2230a_100011217757_100015189358 [0,0,0,0,1,0|3,0,0]=4 1032 B15R1.34 CNCCCCCOCC1CNC(=O)O1 34a_100000722520_100000181169 [0,0,0,0,1,0|3,0,0]=4 1033 B15R1.34 CNCCCCCOCC1COC(=O)O1 34a_100000722520_100000073702 [0,0,0,0,1,0|3,0,0]=4 1034 B15R1.34 COCCCCCCOC1CCC(=O)C1 34a_100012614533_100011998445 [0,0,0,0,1,0|3,0,0]=4 1035 B15R1.34 COCCCCCCOC1COC(=O)O1 34a_200012092642_100000032252 [0,0,0,0,1,0|3,0,0]=4 1036 B15R1.34 COCCCCCCSC1COC(=O)O1 62a_100011998445_100000032252 [0,0,0,0,1,0|3,0,0]=4 1037 B15R1.34 COCCCCCNCC1CNC(=O)O1 2230a_100000747528_100000181169 [0,0,0,0,1,0|3,0,0]=4 1038 B15R1.34 COCCCCCNCC1CNC(=O)O1 34a_100000747528_100000181169 [0,0,0,0,1,0|3,0,0]=4 1039 B15R1.34 COCCCCCNCC1COC(=O)O1 34a_100000747528_100000073702 [0,0,0,0,1,0|3,0,0]=4 1040 B15R1.34 COCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000747528_100015189358 [0,0,0,0,1,0|3,0,0]=4 1041 B15R1.34 NCCCCCCCOC1COC(=O)O1 34a_100011996573_100000032252 [0,0,0,0,1,0|3,0,0]=4 1042 B15R1.34 NCCCCCCOCC1CNC(=O)O1 34a_100000686447_100000181169 [0,0,0,0,1,0|3,0,0]=4 1043 B15R1.34 NCCCCCCOCC1COC(=O)O1 34a_100000686447_100000073702 [0,0,0,0,1,0|3,0,0]=4 1044 B15R1.34 O=C1CCC(C1)OCCCCCCCO 34a_100012614533_100000760002 [0,0,0,0,1,0|3,0,0]=4 1045 B15R1.34 O=C1CCC(N1)COCCCCCCF 34a_100000737831_100015922095 [0,0,0,0,1,0|3,0,0]=4 1046 B15R1.34 O=C1CCC(N1)COCCCCCCO 34a_100000737831_100000766143 [0,0,0,0,1,0|3,0,0]=4 1047 B15R1.34 O=C1CC[C@@H](N1)CNCCCCCCF 2230a_100015423886_100015922095 [0,0,0,0,1,0|3,0,0]=4 1048 B15R1.34 O=C1CC[C@@H](N1)CNCCCCCCF 34a_100015423886_100015922095 [0,0,0,0,1,0|3,0,0]=4 1049 B15R1.34 O=C1CC[C@@H](N1)CNCCCCCCO 2230a_100015423886_100000766143 [0,0,0,0,1,0|3,0,0]=4 1050 B15R1.34 O=C1CC[C@@H](N1)CNCCCCCCO 34a_100015423886_100000766143 [0,0,0,0,1,0|3,0,0]=4 1051 B15R1.34 O=C1CC[C@H](N1)CNCCCCCCO 2230a_100000686447_100015189358 [0,0,0,0,1,0|3,0,0]=4 1052 B15R1.34 O=C1CC[C@H](N1)COCCCCCCBr 7a_100011215345_100015189358 [0,0,0,0,1,0|3,0,0]=4 1053 B15R1.34 O=C1CC[C@H](N1)COCCCCCCCl 7a_100000766143_100015189358 [0,0,0,0,1,0|3,0,0]=4 1054 B15R1.34 O=C1CC[C@H](N1)COCCCCCCF 7a_100000732779_100015189358 [0,0,0,0,1,0|3,0,0]=4 1055 B15R1.34 O=C1CC[C@H](N1)CSCCCCCCF 62a_100015189358_100015922095 [0,0,0,0,1,0|3,0,0]=4 1056 B15R1.34 O=C1CC[C@H](N1)CSCCCCCCF 62a_100015922095_100015189358 [0,0,0,0,1,0|3,0,0]=4 1057 B15R1.34 O=C1CC[C@H](N1)CSCCCCCCO 62a_100000766143_100015189358 [0,0,0,0,1,0|3,0,0]=4 1058 B15R1.34 O=C1CC[C@H](N1)CSCCCCCCO 62a_100015189358_100000766143 [0,0,0,0,1,0|3,0,0]=4 1059 B15R1.34 O=C1NCC(O1)CNCCCCCCO 2230a_100000686447_100000181169 [0,0,0,0,1,0|3,0,0]=4 1060 B15R1.34 O=C1NCC(O1)CNCCCCCCO 34a_100000686447_100000181169 [0,0,0,0,1,0|3,0,0]=4 1061 B15R1.34 O=C1NCC(O1)COCCCCCCBr 34a_100011215345_100000181169 [0,0,0,0,1,0|3,0,0]=4 1062 B15R1.34 O=C1NCC(O1)COCCCCCCBr 7a_100011215345_100000181169 [0,0,0,0,1,0|3,0,0]=4 1063 B15R1.34 O=C1NCC(O1)COCCCCCCCl 34a_100000766143_100000181169 [0,0,0,0,1,0|3,0,0]=4 1064 B15R1.34 O=C1NCC(O1)COCCCCCCCl 7a_100000766143_100000181169 [0,0,0,0,1,0|3,0,0]=4 1065 B15R1.34 O=C1NCC(O1)COCCCCCCF 34a_100000732779_100000181169 [0,0,0,0,1,0|3,0,0]=4 1066 B15R1.34 O=C1NCC(O1)COCCCCCCF 34a_100011315639_100015922095 [0,0,0,0,1,0|3,0,0]=4 1067 B15R1.34 O=C1NCC(O1)COCCCCCCF 7a_100000732779_100000181169 [0,0,0,0,1,0|3,0,0]=4 1068 B15R1.34 O=C1NCC(O1)COCCCCCCO 34a_100011315639_100000766143 [0,0,0,0,1,0|3,0,0]=4 1069 B15R1.34 O=C1NCC(O1)CSCCCCCCF 62a_100000181169_100015922095 [0,0,0,0,1,0|3,0,0]=4 1070 B15R1.34 O=C1NCC(O1)CSCCCCCCF 62a_100015922095_100000181169 [0,0,0,0,1,0|3,0,0]=4 1071 B15R1.34 O=C1NCC(O1)CSCCCCCCO 62a_100000181169_100000766143 [0,0,0,0,1,0|3,0,0]=4 1072 B15R1.34 O=C1NCC(O1)CSCCCCCCO 62a_100000766143_100000181169 [0,0,0,0,1,0|3,0,0]=4 1073 B15R1.34 O=C1OCC(O1)CNCCCCCCO 34a_100000686447_100000073702 [0,0,0,0,1,0|3,0,0]=4 1074 B15R1.34 O=C1OCC(O1)COCCCCCCBr 34a_100011215345_100000073702 [0,0,0,0,1,0|3,0,0]=4 1075 B15R1.34 O=C1OCC(O1)COCCCCCCCl 34a_100000766143_100000073702 [0,0,0,0,1,0|3,0,0]=4 1076 B15R1.34 O=C1OCC(O1)COCCCCCCF 34a_100000732779_100000073702 [0,0,0,0,1,0|3,0,0]=4 1077 B15R1.34 O=C1OCC(O1)CSCCCCCCF 62a_100000073702_100015922095 [0,0,0,0,1,0|3,0,0]=4 1078 B15R1.34 O=C1OCC(O1)CSCCCCCCF 62a_100015922095_100000073702 [0,0,0,0,1,0|3,0,0]=4 1079 B15R1.34 O=C1OCC(O1)CSCCCCCCO 62a_100000073702_100000766143 [0,0,0,0,1,0|3,0,0]=4 1080 B15R1.34 O=C1OCC(O1)CSCCCCCCO 62a_100000766143_100000073702 [0,0,0,0,1,0|3,0,0]=4 1081 B15R1.34 O=C1OCC(O1)NCCCCCCCO 34a_100011996573_100000032252 [0,0,0,0,1,0|3,0,0]=4 1082 B15R1.34 O=C1OCC(O1)OCCCCCCCBr 34a_100000760002_100000032252 [0,0,0,0,1,0|3,0,0]=4 1083 B15R1.34 O=C1OCC(O1)SCCCCCCCO 62a_100000760002_100000032252 [0,0,0,0,1,0|3,0,0]=4 1084 B15R1.3515 C#CCCCCCCOC1CCCC1=O 34a_100011217361_100000709159 [0,0,0,0,1,0|1,0,2]=4 1085 B15R1.3515 C#CCCCCCCOC1CCCC1=O 34a_200000719330_100012276617 [0,0,0,0,1,0|1,0,2]=4 1086 B15R1.3515 C#CCCCCCCOC1CCCC1=O 7a_100011217361_100000211823 [0,0,0,0,1,0|1,0,2]=4 1087 B15R1.3515 C#CCCCCCCSC1CCCC1=O 62a_100000211823_100012276617 [0,0,0,0,1,0|1,0,2]=4 1088 B15R1.3515 C#CCCCCCCSC1CCCC1=O 62a_100012276617_100000211823 [0,0,0,0,1,0|1,0,2]=4 1089 B15R1.3515 C=CCCCCCCOC1CCCC1=O 34a_200000719330_100011215473 [0,0,0,0,1,0|1,0,2]=4 1090 B15R1.3515 C=CCCCCCCOC1CCCC1=O 34a_200011216477_100000709159 [0,0,0,0,1,0|1,0,2]=4 1091 B15R1.3515 C=CCCCCCCOC1CCCC1=O 7a_200011216477_100000211823 [0,0,0,0,1,0|1,0,2]=4 1092 B15R1.3515 C=CCCCCCCSC1CCCC1=O 62a_100000211823_100011215473 [0,0,0,0,1,0|1,0,2]=4 1093 B15R1.3515 C=CCCCCCCSC1CCCC1=O 62a_100011215473_100000211823 [0,0,0,0,1,0|1,0,2]=4 1094 B15R1.3515 CC/C=C\CCCCOC1CCCC1=O 34a_100016287862_100000709159 [0,0,0,0,1,0|1,0,2]=4 1095 B15R1.3515 CC/C=C\CCCCOC1CCCC1=O 7a_100016287862_100000211823 [0,0,0,0,1,0|1,0,2]=4 1096 B15R1.3515 CCCC/C=C\CCOC1CCCC1=O 34a_200016286491_100000709159 [0,0,0,0,1,0|1,0,2]=4 1097 B15R1.3515 CCCC/C=C\CCOC1CCCC1=O 7a_200016286491_100000211823 [0,0,0,0,1,0|1,0,2]=4 1098 B15R1.3515 CCCCC#CCCOC1CCCC1=O 34a_100000037610_100000709159 [0,0,0,0,1,0|1,0,2]=4 1099 B15R1.3515 CCCCC#CCCOC1CCCC1=O 7a_100000037610_100000211823 [0,0,0,0,1,0|1,0,2]=4 1100 B15R1.3515 CCCCC/C=C/COC1CCCC1=O 34a_100016258190_100000709159 [0,0,0,0,1,0|1,0,2]=4 1101 B15R1.3515 CCCCC/C=C/COC1CCCC1=O 7a_100016258190_100000211823 [0,0,0,0,1,0|1,0,2]=4 1102 B15R1.3515 CCCCCC#CCOC1CCCC1=O 34a_200000033628_100000709159 [0,0,0,0,1,0|1,0,2]=4 1103 B15R1.3515 CCCCCC#CCOC1CCCC1=O 34a_200000719330_100009816472 [0,0,0,0,1,0|1,0,2]=4 1104 B15R1.3515 CCCCCC#CCOC1CCCC1=O 7a_200000033628_100000211823 [0,0,0,0,1,0|1,0,2]=4 1105 B15R1.3515 CCCCCC#CCSC1CCCC1=O 62a_100000211823_100009816472 [0,0,0,0,1,0|1,0,2]=4 1106 B15R1.3515 CCCCCC#CCSC1CCCC1=O 62a_100009816472_100000211823 [0,0,0,0,1,0|1,0,2]=4 1107 B15R1.3515 CCCCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100011214924 [0,0,0,0,1,0|2,0,1]=4 1108 B15R1.3515 CCCCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100000210670 [0,0,0,0,1,0|2,0,1]=4 1109 B15R1.3515 CCCCCCCCCN1CCC[C@H]1C 2230a_100015189458_100011214924 [0,0,0,0,1,0|2,0,1]=4 1110 B15R1.3515 CCCCCCCCCN1CCC[C@H]1C 269982a_100015189458_100000210670 [0,0,0,0,1,0|2,0,1]=4 1111 B15R1.3515 CCCCCCCCCN1CCC[C@H]1C 34a_100015189458_100011214924 [0,0,0,0,1,0|2,0,1]=4 1112 B15R1.3515 CCCCCCCCNC1CCCC1=O 2230a_100000229939_100000211823 [0,0,0,0,1,0|1,0,0]=2 1113 B15R1.3515 CCCCCCCCNC1CCCC1=O 34a_100000229939_100000709159 [0,0,0,0,1,0|1,0,0]=2 1114 B15R1.3515 CCCCCCCCNC1CCCC1C 269862a_100000229939_100000752053 [0,0,0,0,1,0|2,0,1]=4 1115 B15R1.3515 CCCCCCCCNC1CCNC1=O 2230a_100016995588_100000210759 [0,0,0,0,1,0|2,0,0]=3 1116 B15R1.3515 CCCCCCCCNC1CCNC1=O 34a_100016995588_100000210759 [0,0,0,0,1,0|2,0,0]=3 1117 B15R1.3515 CCCCCCCCNC1CCOC1=O 2230a_100000229939_100000211211 [0,0,0,0,1,0|2,0,0]=3 1118 B15R1.3515 CCCCCCCCNC1CCOC1=O 34a_100000229939_100000211211 [0,0,0,0,1,0|2,0,0]=3 1119 B15R1.3515 CCCCCCCCN[C@@H]1CONC1=O 2230a_100000765999_100000210759 [0,0,0,0,1,0|3,0,0]=4 1120 B15R1.3515 CCCCCCCCN[C@@H]1CONC1=O 34a_100000765999_100000210759 [0,0,0,0,1,0|3,0,0]=4 1121 B15R1.3515 CCCCCCCCOC1CCCC1=O 34a_100000210232_100000709159 [0,0,0,0,1,0|1,0,0]=2 1122 B15R1.3515 CCCCCCCCOC1CCCC1=O 34a_200000719330_100000210759 [0,0,0,0,1,0|1,0,0]=2 1123 B15R1.3515 CCCCCCCCOC1CCCC1=O 7a_100000210232_100000211823 [0,0,0,0,1,0|1,0,0]=2 1124 B15R1.3515 CCCCCCCCOC1CCCC1C 34a_100011216460_100000210759 [0,0,0,0,1,0|2,0,1]=4 1125 B15R1.3515 CCCCCCCCOC1CCCC1C 7a_100011216460_100000210759 [0,0,0,0,1,0|2,0,1]=4 1126 B15R1.3515 CCCCCCCCOC1CCOC1=O 34a_100000210232_100000211211 [0,0,0,0,1,0|2,0,0]=3 1127 B15R1.3515 CCCCCCCCOC1CCOC1=O 7a_100000210232_100000211211 [0,0,0,0,1,0|2,0,0]=3 1128 B15R1.3515 CCCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000210759 [0,0,0,0,1,0|2,0,1]=4 1129 B15R1.3515 CCCCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210759 [0,0,0,0,1,0|2,0,1]=4 1130 B15R1.3515 CCCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100000210759 [0,0,0,0,1,0|2,0,0]=3 1131 B15R1.3515 CCCCCCCCSC1CCCC1=O 62a_100000210759_100000211823 [0,0,0,0,1,0|1,0,0]=2 1132 B15R1.3515 CCCCCCCCSC1CCCC1=O 62a_100000211823_100000210317 [0,0,0,0,1,0|1,0,0]=2 1133 B15R1.3515 CCCCCCCCSC1CCOC1=O 62a_100000210759_100000211211 [0,0,0,0,1,0|2,0,0]=3 1134 B15R1.3515 CCCCCCCCSC1CCOC1=O 62a_100000211211_100000210317 [0,0,0,0,1,0|2,0,0]=3 1135 B15R1.3515 CCCCCCCCS[C@@H]1CCC[C@H]1O 62a_100000210759_200016002552 [0,0,0,0,1,0|1,0,2]=4 1136 B15R1.3515 CCCCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210317 [0,0,0,0,1,0|1,0,2]=4 1137 B15R1.3515 CCCCCCCOCC1=CCCC1=O 34a_100000087531_100000210614 [0,0,0,0,1,0|1,0,2]=4 1138 B15R1.3515 CCCCCCCOCC1CCCN1C 34a_100000743107_100000210614 [0,0,0,0,1,0|3,0,0]=4 1139 B15R1.3515 CCCCCCCOCC1CCNC1=O 34a_100000133458_100000210614 [0,0,0,0,1,0|2,0,0]=3 1140 B15R1.3515 CCCCCCCSCN1CCCC1=O 62a_100000026320_100000210316 [0,0,0,0,1,0|2,0,0]=3 1141 B15R1.3515 CCCCCCCSCN1CCCC1=O 62a_100000210614_100000026320 [0,0,0,0,1,0|2,0,0]=3 1142 B15R1.3515 CCCCCCNCCC1CCCN1C 2230a_100000210581_100000005710 [0,0,0,0,1,0|3,0,0]=4 1143 B15R1.3515 CCCCCCNCCN1CCCC1=O 2230a_100000210581_100000739059 [0,0,0,0,1,0|2,0,0]=3 1144 B15R1.3515 CCCCCCNCCN1CCCC1=O 2230a_100011200922_100000210314 [0,0,0,0,1,0|2,0,0]=3 1145 B15R1.3515 CCCCCCNCCN1CCNC1=O 2230a_100000210581_100000090651 [0,0,0,0,1,0|3,0,0]=4 1146 B15R1.3515 CCCCCCNCCN1CCNC1=O 2230a_100011207550_100000210314 [0,0,0,0,1,0|3,0,0]=4 1147 B15R1.3515 CCCCCCOCCC1CCCN1C 34a_100000210259_100000005710 [0,0,0,0,1,0|3,0,0]=4 1148 B15R1.3515 CCCCCCOCCC1CCCN1C 34a_100011215177_100000210314 [0,0,0,0,1,0|3,0,0]=4 1149 B15R1.3515 CCCCCCOCCC1CCCN1C 7a_100000210259_100000005710 [0,0,0,0,1,0|3,0,0]=4 1150 B15R1.3515 CCCCCCOCCC1CCCN1C 7a_100011215177_100000210314 [0,0,0,0,1,0|3,0,0]=4 1151 B15R1.3515 CCCCCCOCCN1CCCC1=O 34a_100000210259_100000739059 [0,0,0,0,1,0|2,0,0]=3 1152 B15R1.3515 CCCCCCOCCN1CCCC1=O 34a_100000211209_100000210314 [0,0,0,0,1,0|2,0,0]=3 1153 B15R1.3515 CCCCCCOCCN1CCCC1=O 7a_100000210259_100000739059 [0,0,0,0,1,0|2,0,0]=3 1154 B15R1.3515 CCCCCCOCCN1CCCC1=O 7a_100000211209_100000210314 [0,0,0,0,1,0|2,0,0]=3 1155 B15R1.3515 CCCCCCOCCN1CCNC1=O 34a_100000216532_100000210314 [0,0,0,0,1,0|3,0,0]=4 1156 B15R1.3515 CCCCCCOCCN1CCNC1=O 7a_100000210259_100000090651 [0,0,0,0,1,0|3,0,0]=4 1157 B15R1.3515 CCCCCCSCCC1CCCN1C 62a_100000005710_100000210757 [0,0,0,0,1,0|3,0,0]=4 1158 B15R1.3515 CCCCCCSCCC1CCCN1C 62a_100000210314_100000005710 [0,0,0,0,1,0|3,0,0]=4 1159 B15R1.3515 CCCCCCSCCN1CCCC1=O 62a_100000210314_100000739059 [0,0,0,0,1,0|2,0,0]=3 1160 B15R1.3515 CCCCCCSCCN1CCCC1=O 62a_100000739059_100000210757 [0,0,0,0,1,0|2,0,0]=3 1161 B15R1.3515 CCCCCCSCCN1CCNC1=O 62a_100000090651_100000210757 [0,0,0,0,1,0|3,0,0]=4 1162 B15R1.3515 CCCCCCSCCN1CCNC1=O 62a_100000210314_100000090651 [0,0,0,0,1,0|3,0,0]=4 1163 B15R1.3515 CCCCCNCCCN1CCCC1=O 2230a_100000210347_100000210326 [0,0,0,0,1,0|2,0,0]=3 1164 B15R1.3515 CCCCCNCCCN1CCCC1=O 34a_100000210347_100000718602 [0,0,0,0,1,0|2,0,0]=3 1165 B15R1.3515 CCCCCNCCOC1CCCC1=O 34a_100000224656_100000709159 [0,0,0,0,1,0|2,0,0]=3 1166 B15R1.3515 CCCCCNCCOC1CCOC1=O 34a_100000224656_100000211211 [0,0,0,0,1,0|3,0,0]=4 1167 B15R1.3515 CCCCCOCCCN1CCCC1=O 34a_100011216539_100000718602 [0,0,0,0,1,0|2,0,0]=3 1168 B15R1.3515 CCCCCOCCCN1CCCC1=O 7a_100011216539_100000210326 [0,0,0,0,1,0|2,0,0]=3 1169 B15R1.3515 CCCCCOCCOC1CCCC1=O 34a_100011215259_100000709159 [0,0,0,0,1,0|2,0,0]=3 1170 B15R1.3515 CCCCCOCCOC1CCCC1=O 7a_100011215259_100000211823 [0,0,0,0,1,0|2,0,0]=3 1171 B15R1.3515 CCCCCOCCOC1CCOC1=O 34a_100011215259_100000211211 [0,0,0,0,1,0|3,0,0]=4 1172 B15R1.3515 CCCCCOCCOC1CCOC1=O 7a_100011215259_100000211211 [0,0,0,0,1,0|3,0,0]=4 1173 B15R1.3515 CCCCOCCCNC1CCCC1=O 2230a_200000211371_100000211823 [0,0,0,0,1,0|2,0,0]=3 1174 B15R1.3515 CCCCOCCCNC1CCCC1=O 34a_200000211371_100000709159 [0,0,0,0,1,0|2,0,0]=3 1175 B15R1.3515 CCCCOCCCNC1CCOC1=O 2230a_200000211371_100000211211 [0,0,0,0,1,0|3,0,0]=4 1176 B15R1.3515 CCCCOCCCNC1CCOC1=O 34a_200000211371_100000211211 [0,0,0,0,1,0|3,0,0]=4 1177 B15R1.3515 CCCCOCCCOC1CCCC1=O 34a_200011215613_100000709159 [0,0,0,0,1,0|2,0,0]=3 1178 B15R1.3515 CCCCOCCCOC1CCCC1=O 7a_200011215613_100000211823 [0,0,0,0,1,0|2,0,0]=3 1179 B15R1.3515 CCCCOCCCOC1CCOC1=O 34a_200011215613_100000211211 [0,0,0,0,1,0|3,0,0]=4 1180 B15R1.3515 CCCCOCCCOC1CCOC1=O 7a_200011215613_100000211211 [0,0,0,0,1,0|3,0,0]=4 1181 B15R1.3515 CCCCOCCOCC1CCNC1=O 34a_100000133458_100000743108 [0,0,0,0,1,0|3,0,0]=4 1182 B15R1.3515 CCCCOCCSCN1CCCC1=O 62a_100000026320_100000743108 [0,0,0,0,1,0|3,0,0]=4 1183 B15R1.3515 CCCCOCCSCN1CCCC1=O 62a_100000743108_100000026320 [0,0,0,0,1,0|3,0,0]=4 1184 B15R1.3515 CCCCOCNCCN1CCCC1=O 2230a_100011200922_100011995733 [0,0,0,0,1,0|3,0,0]=4 1185 B15R1.3515 CCCCOCOCCN1CCCC1=O 34a_100000211209_100011995733 [0,0,0,0,1,0|3,0,0]=4 1186 B15R1.3515 CCCCOCSCCN1CCCC1=O 62a_100000739059_100011995733 [0,0,0,0,1,0|3,0,0]=4 1187 B15R1.3515 CCCCOCSCCN1CCCC1=O 62a_100011995733_100000739059 [0,0,0,0,1,0|3,0,0]=4 1188 B15R1.3515 CCCOCCNCCN1CCCC1=O 2230a_100011200922_100011215938 [0,0,0,0,1,0|3,0,0]=4 1189 B15R1.3515 CCCOCCNCCN1CCCC1=O 2230a_100161115042_100000739059 [0,0,0,0,1,0|3,0,0]=4 1190 B15R1.3515 CCCOCCNCCN1CCCC1=O 34a_100161115042_100000739059 [0,0,0,0,1,0|3,0,0]=4 1191 B15R1.3515 CCCOCCOCCN1CCCC1=O 34a_100000211209_100011215938 [0,0,0,0,1,0|3,0,0]=4 1192 B15R1.3515 CCCOCCOCCN1CCCC1=O 34a_100000752267_100000739059 [0,0,0,0,1,0|3,0,0]=4 1193 B15R1.3515 CCCOCCOCCN1CCCC1=O 7a_100000211209_100011215938 [0,0,0,0,1,0|3,0,0]=4 1194 B15R1.3515 CCCOCCOCCN1CCCC1=O 7a_100000752267_100000739059 [0,0,0,0,1,0|3,0,0]=4 1195 B15R1.3515 CCCOCCSCCN1CCCC1=O 62a_100000739059_100011215938 [0,0,0,0,1,0|3,0,0]=4 1196 B15R1.3515 CCCOCCSCCN1CCCC1=O 62a_100011215938_100000739059 [0,0,0,0,1,0|3,0,0]=4 1197 B15R1.3515 CCCSCCNCCN1CCCC1=O 2230a_100020603323_100000739059 [0,0,0,0,1,0|3,0,0]=4 1198 B15R1.3515 CCCSCCOCCN1CCCC1=O 34a_200000230433_100000739059 [0,0,0,0,1,0|3,0,0]=4 1199 B15R1.3515 CCCSCCOCCN1CCCC1=O 7a_200000230433_100000739059 [0,0,0,0,1,0|3,0,0]=4 1200 B15R1.3515 CCOCCCNCCN1CCCC1=O 2230a_100000210961_100000739059 [0,0,0,0,1,0|3,0,0]=4 1201 B15R1.3515 CCOCCCNCCN1CCCC1=O 2230a_100011200922_100012232248 [0,0,0,0,1,0|3,0,0]=4 1202 B15R1.3515 CCOCCCNCCN1CCCC1=O 34a_100000210961_100000739059 [0,0,0,0,1,0|3,0,0]=4 1203 B15R1.3515 CCOCCCOCCN1CCCC1=O 34a_100000211209_100012232248 [0,0,0,0,1,0|3,0,0]=4 1204 B15R1.3515 CCOCCCOCCN1CCCC1=O 34a_100000757476_100000739059 [0,0,0,0,1,0|3,0,0]=4 1205 B15R1.3515 CCOCCCOCCN1CCCC1=O 7a_100000211209_100012232248 [0,0,0,0,1,0|3,0,0]=4 1206 B15R1.3515 CCOCCCOCCN1CCCC1=O 7a_100000757476_100000739059 [0,0,0,0,1,0|3,0,0]=4 1207 B15R1.3515 CCOCCCSCCN1CCCC1=O 62a_100000739059_100012232248 [0,0,0,0,1,0|3,0,0]=4 1208 B15R1.3515 CCOCCCSCCN1CCCC1=O 62a_100012232248_100000739059 [0,0,0,0,1,0|3,0,0]=4 1209 B15R1.3515 CCOCCNCCCN1CCCC1=O 2230a_100000210347_100011215890 [0,0,0,0,1,0|3,0,0]=4 1210 B15R1.3515 CCOCCNCCCN1CCCC1=O 34a_100000210347_100000210147 [0,0,0,0,1,0|3,0,0]=4 1211 B15R1.3515 CCOCCOCCCN1CCCC1=O 34a_100011216539_100000210147 [0,0,0,0,1,0|3,0,0]=4 1212 B15R1.3515 CCOCCOCCCN1CCCC1=O 7a_100011216539_100011215890 [0,0,0,0,1,0|3,0,0]=4 1213 B15R1.3515 CCOCCOCCNC1CCCC1=O 2230a_100102712874_100000211823 [0,0,0,0,1,0|3,0,0]=4 1214 B15R1.3515 CCOCCOCCNC1CCCC1=O 34a_100102712874_100000709159 [0,0,0,0,1,0|3,0,0]=4 1215 B15R1.3515 CCOCCOCCOC1CCCC1=O 34a_100000210240_100000709159 [0,0,0,0,1,0|3,0,0]=4 1216 B15R1.3515 CCOCCOCCOC1CCCC1=O 34a_200000719330_100011211534 [0,0,0,0,1,0|3,0,0]=4 1217 B15R1.3515 CCOCCOCCOC1CCCC1=O 7a_100000210240_100000211823 [0,0,0,0,1,0|3,0,0]=4 1218 B15R1.3515 CCOCCOCCSC1CCCC1=O 62a_100000211823_100011211534 [0,0,0,0,1,0|3,0,0]=4 1219 B15R1.3515 CCOCCOCCSC1CCCC1=O 62a_100011211534_100000211823 [0,0,0,0,1,0|3,0,0]=4 1220 B15R1.3515 CCSCCCOCCN1CCCC1=O 34a_100011216438_100000739059 [0,0,0,0,1,0|3,0,0]=4 1221 B15R1.3515 CCSCCCOCCN1CCCC1=O 7a_100011216438_100000739059 [0,0,0,0,1,0|3,0,0]=4 1222 B15R1.3515 CCSCCNCCCN1CCCC1=O 2230a_100000210347_100000757381 [0,0,0,0,1,0|3,0,0]=4 1223 B15R1.3515 CCSCCNCCCN1CCCC1=O 34a_100000210347_100000757381 [0,0,0,0,1,0|3,0,0]=4 1224 B15R1.3515 CCSCCOCCCN1CCCC1=O 34a_100011216539_100000757381 [0,0,0,0,1,0|3,0,0]=4 1225 B15R1.3515 CCSCCOCCCN1CCCC1=O 7a_100011216539_100000757381 [0,0,0,0,1,0|3,0,0]=4 1226 B15R1.3515 COCCCCCCNC1CCNC1=O 2230a_100016995588_100011998445 [0,0,0,0,1,0|3,0,0]=4 1227 B15R1.3515 COCCCCCCNC1CCNC1=O 34a_100016995588_100011998445 [0,0,0,0,1,0|3,0,0]=4 1228 B15R1.3515 COCCCCCCOC1CCCC1=O 34a_200000719330_100011998445 [0,0,0,0,1,0|2,0,0]=3 1229 B15R1.3515 COCCCCCCOC1CCCC1=O 34a_200012092642_100000709159 [0,0,0,0,1,0|2,0,0]=3 1230 B15R1.3515 COCCCCCCOC1CCCC1=O 7a_200012092642_100000211823 [0,0,0,0,1,0|2,0,0]=3 1231 B15R1.3515 COCCCCCCOC1CCOC1=O 34a_200012092642_100000211211 [0,0,0,0,1,0|3,0,0]=4 1232 B15R1.3515 COCCCCCCOC1CCOC1=O 7a_200012092642_100000211211 [0,0,0,0,1,0|3,0,0]=4 1233 B15R1.3515 COCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100011998445 [0,0,0,0,1,0|3,0,0]=4 1234 B15R1.3515 COCCCCCCSC1CCCC1=O 62a_100000211823_100011998445 [0,0,0,0,1,0|2,0,0]=3 1235 B15R1.3515 COCCCCCCSC1CCCC1=O 62a_100011998445_100000211823 [0,0,0,0,1,0|2,0,0]=3 1236 B15R1.3515 COCCCCCCSC1CCOC1=O 62a_100000211211_100011998445 [0,0,0,0,1,0|3,0,0]=4 1237 B15R1.3515 COCCCCCCSC1CCOC1=O 62a_100011998445_100000211211 [0,0,0,0,1,0|3,0,0]=4 1238 B15R1.3515 COCCCCNCCN1CCCC1=O 2230a_100011200922_100000730899 [0,0,0,0,1,0|3,0,0]=4 1239 B15R1.3515 COCCCCOCCN1CCCC1=O 34a_100000211209_100000755781 [0,0,0,0,1,0|3,0,0]=4 1240 B15R1.3515 COCCCCOCCN1CCCC1=O 34a_100000740925_100000739059 [0,0,0,0,1,0|3,0,0]=4 1241 B15R1.3515 COCCCCOCCN1CCCC1=O 7a_100000211209_100000730899 [0,0,0,0,1,0|3,0,0]=4 1242 B15R1.3515 COCCCCSCCN1CCCC1=O 62a_100000730899_100000739059 [0,0,0,0,1,0|3,0,0]=4 1243 B15R1.3515 COCCCCSCCN1CCCC1=O 62a_100000739059_100000730899 [0,0,0,0,1,0|3,0,0]=4 1244 B15R1.3515 COCCCNCCCN1CCCC1=O 2230a_100000210347_100000740836 [0,0,0,0,1,0|3,0,0]=4 1245 B15R1.3515 COCCCNCCCN1CCCC1=O 34a_100000210347_100000740836 [0,0,0,0,1,0|3,0,0]=4 1246 B15R1.3515 COCCCOCCCN1CCCC1=O 34a_100011216539_100000740836 [0,0,0,0,1,0|3,0,0]=4 1247 B15R1.3515 COCCCOCCCN1CCCC1=O 7a_100011216539_100000740836 [0,0,0,0,1,0|3,0,0]=4 1248 B15R1.3515 COCCOCCCNC1CCCC1=O 2230a_100000206027_100000211823 [0,0,0,0,1,0|3,0,0]=4 1249 B15R1.3515 COCCOCCCNC1CCCC1=O 34a_100000206027_100000709159 [0,0,0,0,1,0|3,0,0]=4 1250 B15R1.3515 COCCOCCCOC1CCCC1=O 34a_200000719330_100011216529 [0,0,0,0,1,0|3,0,0]=4 1251 B15R1.3515 COCCOCCCSC1CCCC1=O 62a_100000211823_100011216529 [0,0,0,0,1,0|3,0,0]=4 1252 B15R1.3515 COCCOCCCSC1CCCC1=O 62a_100011216529_100000211823 [0,0,0,0,1,0|3,0,0]=4 1253 B15R1.3515 CSCCCCOCCN1CCCC1=O 34a_100011217163_100000739059 [0,0,0,0,1,0|3,0,0]=4 1254 B15R1.3515 CSCCCCOCCN1CCCC1=O 7a_100011217163_100000739059 [0,0,0,0,1,0|3,0,0]=4 1255 B15R1.3515 N#CCCCCCCSC1CCCC1=O 62a_100000211823_100009813337 [0,0,0,0,1,0|2,0,1]=4 1256 B15R1.3515 N#CCCCCCCSC1CCCC1=O 62a_100009813337_100000211823 [0,0,0,0,1,0|2,0,1]=4 1257 B15R1.3515 NCCCCCCCOC1CCCC1=O 34a_100011996573_100000709159 [0,0,0,0,1,0|2,0,0]=3 1258 B15R1.3515 NCCCCCCCOC1CCOC1=O 34a_100011996573_100000211211 [0,0,0,0,1,0|3,0,0]=4 1259 B15R1.3515 NCCCCCOCCN1CCCC1=O 34a_100000762737_100000739059 [0,0,0,0,1,0|3,0,0]=4 1260 B15R1.3515 NCCCOCCCOC1CCCC1=O 34a_100011310245_100000709159 [0,0,0,0,1,0|3,0,0]=4 1261 B15R1.3515 O=C1CCCC1NCCCCCCCO 2230a_100011996573_100000211823 [0,0,0,0,1,0|2,0,0]=3 1262 B15R1.3515 O=C1CCCC1NCCCCCCCO 34a_100011996573_100000709159 [0,0,0,0,1,0|2,0,0]=3 1263 B15R1.3515 O=C1CCCC1NCCCOCCCO 2230a_100011310245_100000211823 [0,0,0,0,1,0|3,0,0]=4 1264 B15R1.3515 O=C1CCCC1NCCCOCCCO 34a_100011310245_100000709159 [0,0,0,0,1,0|3,0,0]=4 1265 B15R1.3515 O=C1CCCC1OCCCCCCCBr 34a_100000760002_100000709159 [0,0,0,0,1,0|2,0,0]=3 1266 B15R1.3515 O=C1CCCC1OCCCCCCCBr 7a_100000760002_100000211823 [0,0,0,0,1,0|2,0,0]=3 1267 B15R1.3515 O=C1CCCC1OCCCCCCCO 34a_200000719330_100000760002 [0,0,0,0,1,0|2,0,0]=3 1268 B15R1.3515 O=C1CCCC1SCCCCCCCO 62a_100000211823_100000760002 [0,0,0,0,1,0|2,0,0]=3 1269 B15R1.3515 O=C1CCCC1SCCCCCCCO 62a_100000760002_100000211823 [0,0,0,0,1,0|2,0,0]=3 1270 B15R1.3515 O=C1CCCN1CCCNCCCCF 2230a_100000210347_100000729493 [0,0,0,0,1,0|3,0,0]=4 1271 B15R1.3515 O=C1CCCN1CCCNCCCCF 34a_100000210347_100000729493 [0,0,0,0,1,0|3,0,0]=4 1272 B15R1.3515 O=C1CCCN1CCCNCCCCO 2230a_100000210347_100000210776 [0,0,0,0,1,0|3,0,0]=4 1273 B15R1.3515 O=C1CCCN1CCCNCCCCO 34a_100000210347_100011216708 [0,0,0,0,1,0|3,0,0]=4 1274 B15R1.3515 O=C1CCCN1CCCOCCCCF 34a_100011216539_100000729493 [0,0,0,0,1,0|3,0,0]=4 1275 B15R1.3515 O=C1CCCN1CCCOCCCCF 7a_100011216539_100000729493 [0,0,0,0,1,0|3,0,0]=4 1276 B15R1.3515 O=C1CCCN1CCCOCCCCO 34a_100011216539_100011216708 [0,0,0,0,1,0|3,0,0]=4 1277 B15R1.3515 O=C1CCCN1CCCOCCCCO 7a_100011216539_100000210776 [0,0,0,0,1,0|3,0,0]=4 1278 B15R1.3515 O=C1CCCN1CCNCCCCCF 2230a_100011200922_100000729378 [0,0,0,0,1,0|3,0,0]=4 1279 B15R1.3515 O=C1CCCN1CCNCCCCCO 2230a_100000762737_100000739059 [0,0,0,0,1,0|3,0,0]=4 1280 B15R1.3515 O=C1CCCN1CCNCCCCCO 2230a_100011200922_100000746330 [0,0,0,0,1,0|3,0,0]=4 1281 B15R1.3515 O=C1CCCN1CCNCCCCCO 34a_100000762737_100000739059 [0,0,0,0,1,0|3,0,0]=4 1282 B15R1.3515 O=C1CCCN1CCOCCCCCBr 34a_100000746331_100000739059 [0,0,0,0,1,0|3,0,0]=4 1283 B15R1.3515 O=C1CCCN1CCOCCCCCBr 7a_100000746331_100000739059 [0,0,0,0,1,0|3,0,0]=4 1284 B15R1.3515 O=C1CCCN1CCOCCCCCCl 34a_100000746330_100000739059 [0,0,0,0,1,0|3,0,0]=4 1285 B15R1.3515 O=C1CCCN1CCOCCCCCCl 7a_100000746330_100000739059 [0,0,0,0,1,0|3,0,0]=4 1286 B15R1.3515 O=C1CCCN1CCOCCCCCF 34a_100000211209_100000729378 [0,0,0,0,1,0|3,0,0]=4 1287 B15R1.3515 O=C1CCCN1CCOCCCCCF 7a_100000211209_100000729378 [0,0,0,0,1,0|3,0,0]=4 1288 B15R1.3515 O=C1CCCN1CCOCCCCCI 34a_200012148887_100000739059 [0,0,0,0,1,0|3,0,0]=4 1289 B15R1.3515 O=C1CCCN1CCOCCCCCI 7a_200012148887_100000739059 [0,0,0,0,1,0|3,0,0]=4 1290 B15R1.3515 O=C1CCCN1CCOCCCCCO 34a_100000211209_100000746330 [0,0,0,0,1,0|3,0,0]=4 1291 B15R1.3515 O=C1CCCN1CCOCCCCCO 7a_100000211209_100000746330 [0,0,0,0,1,0|3,0,0]=4 1292 B15R1.3515 O=C1CCCN1CCSCCCCCF 62a_100000729378_100000739059 [0,0,0,0,1,0|3,0,0]=4 1293 B15R1.3515 O=C1CCCN1CCSCCCCCF 62a_100000739059_100000729378 [0,0,0,0,1,0|3,0,0]=4 1294 B15R1.3515 O=C1CCCN1CCSCCCCCO 62a_100000739059_100000746330 [0,0,0,0,1,0|3,0,0]=4 1295 B15R1.3515 O=C1CCCN1CCSCCCCCO 62a_100000746330_100000739059 [0,0,0,0,1,0|3,0,0]=4 1296 B15R1.3515 O=C1CCCN1CSCCCCCCF 62a_100000026320_100015922095 [0,0,0,0,1,0|3,0,0]=4 1297 B15R1.3515 O=C1CCCN1CSCCCCCCF 62a_100015922095_100000026320 [0,0,0,0,1,0|3,0,0]=4 1298 B15R1.3515 O=C1CCCN1CSCCCCCCO 62a_100000026320_100000766143 [0,0,0,0,1,0|3,0,0]=4 1299 B15R1.3515 O=C1CCCN1CSCCCCCCO 62a_100000766143_100000026320 [0,0,0,0,1,0|3,0,0]=4 1300 B15R1.3515 O=C1NCCC1COCCCCCCF 34a_100000133458_100015922095 [0,0,0,0,1,0|3,0,0]=4 1301 B15R1.3515 O=C1NCCC1COCCCCCCO 34a_100000133458_100000766143 [0,0,0,0,1,0|3,0,0]=4 1302 B15R1.3515 O=C1NCCC1NCCCCCCCO 2230a_100016995588_100000760002 [0,0,0,0,1,0|3,0,0]=4 1303 B15R1.3515 O=C1NCCC1NCCCCCCCO 34a_100016995588_100000760002 [0,0,0,0,1,0|3,0,0]=4 1304 B15R1.3515 O=C1NCC[C@@H]1OCCCCCCCO 34a_100000688343_100000760002 [0,0,0,0,1,0|3,0,0]=4 1305 B15R1.3515 O=C1OCCC1NCCCCCCCO 2230a_100011996573_100000211211 [0,0,0,0,1,0|3,0,0]=4 1306 B15R1.3515 O=C1OCCC1NCCCCCCCO 34a_100011996573_100000211211 [0,0,0,0,1,0|3,0,0]=4 1307 B15R1.3515 O=C1OCCC1OCCCCCCCBr 34a_100000760002_100000211211 [0,0,0,0,1,0|3,0,0]=4 1308 B15R1.3515 O=C1OCCC1OCCCCCCCBr 7a_100000760002_100000211211 [0,0,0,0,1,0|3,0,0]=4 1309 B15R1.3515 O=C1OCCC1SCCCCCCCO 62a_100000211211_100000760002 [0,0,0,0,1,0|3,0,0]=4 1310 B15R1.3515 O=C1OCCC1SCCCCCCCO 62a_100000760002_100000211211 [0,0,0,0,1,0|3,0,0]=4 1311 B17R1.25267 CCCCCCCCCN1CCCNC(=O)C1 2230a_100015190381_100011214924 [0,0,0,0,0,1|2,0,0]=3 1312 B17R1.25267 O=C1CN(CCCN1)CCCCCCCCO 2230a_100015190381_100000033203 [0,0,0,0,0,1|3,0,0]=4 1313 B17R1.25295 CCCCCCCCCN1CCNC(=O)CC1 2230a_100000698595_100011214924 [0,0,0,0,0,1|3,0,0]=4 1314 B17R1.25295 CCCCCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210670 [0,0,0,0,0,1|3,0,0]=4 1315 B14R0.392 C=CCCCCCCCCCCCNC 2230a_106832991635_102130925996 [1,0,1,0,0,0|2,0,0]=4 1316 B14R0.392 C=CCCCCCCCCCCCNC 34a_100102657272_102130925996 [1,0,1,0,0,0|2,0,0]=4 1317 B14R0.392 C=CCCCCCCCCCCCNC 7a_106832991635_102130925996 [1,0,1,0,0,0|2,0,0]=4 1318 B14R0.392 C=CCCCCCCCCCCCOC 34a_100138415774_102130925996 [1,0,1,0,0,0|2,0,0]=4 1319 B14R0.392 C=CCCCCCCCCCCCSC 62a_102130925996_200000210301 [1,0,1,0,0,0|2,0,0]=4 1320 B14R0.392 C=CCCCCCCCCCCCSC 62a_200000210301_102130925996 [1,0,1,0,0,0|2,0,0]=4 1321 B14R0.392 C=CCCCCCCCCCCCS[13CH3] 62a_102130925996_200025704644 [1,0,1,0,0,0|2,0,0]=4 1322 B14R0.392 C=CCCCCCCCCCCCS[13CH3] 62a_200025704644_102130925996 [1,0,1,0,0,0|2,0,0]=4 1323 B14R0.392 C=CCCCCCCCCCCNCC 2230a_100015525214_100011093070 [1,0,1,0,0,0|2,0,0]=4 1324 B14R0.392 C=CCCCCCCCCCCOCC 34a_100121572206_100011093070 [1,0,1,0,0,0|2,0,0]=4 1325 B14R0.392 C=CCCCCCCCCCCSCC 62a_100000210202_100011093070 [1,0,1,0,0,0|2,0,0]=4 1326 B14R0.392 C=CCCCCCCCCCCSCC 62a_100011093070_100000210202 [1,0,1,0,0,0|2,0,0]=4 1327 B14R0.392 C=CCCCCCCCCCNCCC 2230a_100000081888_100000210303 [1,0,1,0,0,0|2,0,0]=4 1328 B14R0.392 C=CCCCCCCCCCNCCC 34a_100000081888_100000210303 [1,0,1,0,0,0|2,0,0]=4 1329 B14R0.392 C=CCCCCCCCCCOCCC 34a_100000038209_100000210303 [1,0,1,0,0,0|2,0,0]=4 1330 B14R0.392 C=CCCCCCCCCCOCCC 34a_100000210258_100009814027 [1,0,1,0,0,0|2,0,0]=4 1331 B14R0.392 C=CCCCCCCCCCOCCC 7a_100000038209_100000210303 [1,0,1,0,0,0|2,0,0]=4 1332 B14R0.392 C=CCCCCCCCCCSCCC 62a_100000210303_100009814027 [1,0,1,0,0,0|2,0,0]=4 1333 B14R0.392 C=CCCCCCCCCCSCCC 62a_100009814027_100000210303 [1,0,1,0,0,0|2,0,0]=4 1334 B14R0.392 C=CCCCCCCCCNCCCC 2230a_100000102301_100011933949 [1,0,1,0,0,0|2,0,0]=4 1335 B14R0.392 C=CCCCCCCCCNCCCC 7a_106832991798_100011933949 [1,0,1,0,0,0|2,0,0]=4 1336 B14R0.392 C=CCCCCCCCCOCCCC 34a_100000210227_100011933949 [1,0,1,0,0,0|2,0,0]=4 1337 B14R0.392 C=CCCCCCCCCOCCCC 34a_100011215194_100000210210 [1,0,1,0,0,0|2,0,0]=4 1338 B14R0.392 C=CCCCCCCCCOCCCC 7a_100000210227_100011933949 [1,0,1,0,0,0|2,0,0]=4 1339 B14R0.392 C=CCCCCCCCCOCCCC 7a_100011215194_100000210211 [1,0,1,0,0,0|2,0,0]=4 1340 B14R0.392 C=CCCCCCCCCSCCCC 62a_100000210211_100011933949 [1,0,1,0,0,0|2,0,0]=4 1341 B14R0.392 C=CCCCCCCCCSCCCC 62a_100011933949_100000210210 [1,0,1,0,0,0|2,0,0]=4 1342 B14R0.392 C=CCCCCCCCNCCCCC 2230a_100000209983_100012355270 [1,0,1,0,0,0|2,0,0]=4 1343 B14R0.392 C=CCCCCCCCOCCCCC 34a_100000210253_100012355270 [1,0,1,0,0,0|2,0,0]=4 1344 B14R0.392 C=CCCCCCCCOCCCCC 34a_100000730831_100000718602 [1,0,1,0,0,0|2,0,0]=4 1345 B14R0.392 C=CCCCCCCCOCCCCC 7a_100000210253_100012355270 [1,0,1,0,0,0|2,0,0]=4 1346 B14R0.392 C=CCCCCCCCOCCCCC 7a_100000730831_100000210326 [1,0,1,0,0,0|2,0,0]=4 1347 B14R0.392 C=CCCCCCCCSCCCCC 62a_100000210326_100012355270 [1,0,1,0,0,0|2,0,0]=4 1348 B14R0.392 C=CCCCCCCCSCCCCC 62a_100012355270_100000210326 [1,0,1,0,0,0|2,0,0]=4 1349 B14R0.392 C=CCCCCCCNCCCCCC 2230a_100000210581_100011215473 [1,0,1,0,0,0|2,0,0]=4 1350 B14R0.392 C=CCCCCCCOCCCCCC 34a_100000210259_100011215473 [1,0,1,0,0,0|2,0,0]=4 1351 B14R0.392 C=CCCCCCCOCCCCCC 34a_200011216477_100000210314 [1,0,1,0,0,0|2,0,0]=4 1352 B14R0.392 C=CCCCCCCOCCCCCC 7a_100000210259_100011215473 [1,0,1,0,0,0|2,0,0]=4 1353 B14R0.392 C=CCCCCCCOCCCCCC 7a_200011216477_100000210314 [1,0,1,0,0,0|2,0,0]=4 1354 B14R0.392 C=CCCCCCCSCCCCCC 62a_100000210314_100011215473 [1,0,1,0,0,0|2,0,0]=4 1355 B14R0.392 C=CCCCCCCSCCCCCC 62a_100011215473_100000210757 [1,0,1,0,0,0|2,0,0]=4 1356 B14R0.392 C=CCCCCCNCCCCCCC 2230a_100000229938_100000700193 [1,0,1,0,0,0|2,0,0]=4 1357 B14R0.392 C=CCCCCCOCCCCCCC 34a_100000210272_100000700193 [1,0,1,0,0,0|2,0,0]=4 1358 B14R0.392 C=CCCCCCOCCCCCCC 34a_100011216702_100000210614 [1,0,1,0,0,0|2,0,0]=4 1359 B14R0.392 C=CCCCCCOCCCCCCC 7a_100000210272_100000700193 [1,0,1,0,0,0|2,0,0]=4 1360 B14R0.392 C=CCCCCCOCCCCCCC 7a_100011216702_100000210614 [1,0,1,0,0,0|2,0,0]=4 1361 B14R0.392 C=CCCCCCSCCCCCCC 62a_100000210614_100000700193 [1,0,1,0,0,0|2,0,0]=4 1362 B14R0.392 C=CCCCCCSCCCCCCC 62a_100000700193_100000210316 [1,0,1,0,0,0|2,0,0]=4 1363 B14R0.392 C=CCCCCNCCCCCCCC 2230a_100000229939_100011215482 [1,0,1,0,0,0|2,0,0]=4 1364 B14R0.392 C=CCCCCNCCCCCCCC 2230a_100000703577_100000210759 [1,0,1,0,0,0|2,0,0]=4 1365 B14R0.392 C=CCCCCNCCCCCCCC 34a_100000229939_100011215482 [1,0,1,0,0,0|2,0,0]=4 1366 B14R0.392 C=CCCCCNCCCCCCCC 34a_100000703577_100000210759 [1,0,1,0,0,0|2,0,0]=4 1367 B14R0.392 C=CCCCCOCCCCCCCC 34a_100000210232_100011215482 [1,0,1,0,0,0|2,0,0]=4 1368 B14R0.392 C=CCCCCOCCCCCCCC 34a_100000766645_100000210759 [1,0,1,0,0,0|2,0,0]=4 1369 B14R0.392 C=CCCCCOCCCCCCCC 7a_100000210232_100011215482 [1,0,1,0,0,0|2,0,0]=4 1370 B14R0.392 C=CCCCCOCCCCCCCC 7a_100000766645_100000210759 [1,0,1,0,0,0|2,0,0]=4 1371 B14R0.392 C=CCCCCSCCCCCCCC 62a_100000210759_100011215482 [1,0,1,0,0,0|2,0,0]=4 1372 B14R0.392 C=CCCCCSCCCCCCCC 62a_100011215482_100000210317 [1,0,1,0,0,0|2,0,0]=4 1373 B14R0.392 C=CCCCNCCCCCCCCC 2230a_100000212291_100011713584 [1,0,1,0,0,0|2,0,0]=4 1374 B14R0.392 C=CCCCNCCCCCCCCC 2230a_100000700776_100011214924 [1,0,1,0,0,0|2,0,0]=4 1375 B14R0.392 C=CCCCNCCCCCCCCC 34a_100000212291_100000757094 [1,0,1,0,0,0|2,0,0]=4 1376 B14R0.392 C=CCCCNCCCCCCCCC 34a_100000700776_100011214924 [1,0,1,0,0,0|2,0,0]=4 1377 B14R0.392 C=CCCCOCCCCCCCCC 34a_100000210712_100000757094 [1,0,1,0,0,0|2,0,0]=4 1378 B14R0.392 C=CCCCOCCCCCCCCC 34a_100000758997_100011214924 [1,0,1,0,0,0|2,0,0]=4 1379 B14R0.392 C=CCCCOCCCCCCCCC 7a_100000210712_100000757094 [1,0,1,0,0,0|2,0,0]=4 1380 B14R0.392 C=CCCCOCCCCCCCCC 7a_100000758997_100000210328 [1,0,1,0,0,0|2,0,0]=4 1381 B14R0.392 C=CCCCSCCCCCCCCC 62a_100011713584_100000210670 [1,0,1,0,0,0|2,0,0]=4 1382 B14R0.392 C=CCCNCCCCCCCCCC 2230a_100000684558_100000754431 [1,0,1,0,0,0|2,0,0]=4 1383 B14R0.392 C=CCCNCCCCCCCCCC 2230a_100015191253_100000210320 [1,0,1,0,0,0|2,0,0]=4 1384 B14R0.392 C=CCCNCCCCCCCCCC 34a_100000684558_100000754431 [1,0,1,0,0,0|2,0,0]=4 1385 B14R0.392 C=CCCOCCCCCCCCCC 34a_100000210711_100000754431 [1,0,1,0,0,0|2,0,0]=4 1386 B14R0.392 C=CCCOCCCCCCCCCC 34a_100011205117_100000210320 [1,0,1,0,0,0|2,0,0]=4 1387 B14R0.392 C=CCCOCCCCCCCCCC 7a_100000210711_100000754431 [1,0,1,0,0,0|2,0,0]=4 1388 B14R0.392 C=CCCSCCCCCCCCCC 62a_100000754431_100000210320 [1,0,1,0,0,0|2,0,0]=4 1389 B14R0.392 C=CCNCCCCCCCCCCC 2230a_100020586998_100011215454 [1,0,1,0,0,0|2,0,0]=4 1390 B14R0.392 C=CCNCCCCCCCCCCC 2230a_200011215754_100000210623 [1,0,1,0,0,0|2,0,0]=4 1391 B14R0.392 C=CCNCCCCCCCCCCC 34a_200011215754_100015514636 [1,0,1,0,0,0|2,0,0]=4 1392 B14R0.392 C=CCOCCCCCCCCCCC 34a_100000210809_100015514636 [1,0,1,0,0,0|2,0,0]=4 1393 B14R0.392 C=CCOCCCCCCCCCCC 34a_200000210373_100011215454 [1,0,1,0,0,0|2,0,0]=4 1394 B14R0.392 C=CCOCCCCCCCCCCC 7a_100000210809_100015514636 [1,0,1,0,0,0|2,0,0]=4 1395 B14R0.392 C=CCSCCCCCCCCCCC 62a_100000210623_100011215454 [1,0,1,0,0,0|2,0,0]=4 1396 B14R0.392 CCC/C=C/COCCCCCCCC 34a_100016278788_100000210759 [1,0,1,0,0,0|2,0,0]=4 1397 B14R0.392 CCC/C=C/COCCCCCCCC 7a_100016278788_100000210759 [1,0,1,0,0,0|2,0,0]=4 1398 B14R0.392 CCCCCCCCCC/C=C/COC 34a_200025761149_200000210301 [1,0,1,0,0,0|2,0,0]=4 1399 B14R0.392 CCCCCCCCCC/C=C/COC 7a_200025761149_200000210301 [1,0,1,0,0,0|2,0,0]=4 1400 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 34a_200025761149_200025704644 [1,0,1,0,0,0|2,0,0]=4 1401 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 7a_200025761149_200025704644 [1,0,1,0,0,0|2,0,0]=4 1402 B14R0.392 CCCCCCCCCCCCCNC 2230a_100011215765_200000210301 [1,0,1,0,0,0|2,0,0]=4 1403 B14R0.392 CCCCCCCCCCCCCNC 2230a_106832991635_100000210684 [1,0,1,0,0,0|2,0,0]=4 1404 B14R0.392 CCCCCCCCCCCCCNC 270004a_106832991635_200011215488 [1,0,1,0,0,0|2,0,0]=4 1405 B14R0.392 CCCCCCCCCCCCCNC 34a_100011215765_200000210301 [1,0,1,0,0,0|2,0,0]=4 1406 B14R0.392 CCCCCCCCCCCCCNC 34a_100102657272_100000210684 [1,0,1,0,0,0|2,0,0]=4 1407 B14R0.392 CCCCCCCCCCCCCNC 7a_106832991635_100000210684 [1,0,1,0,0,0|2,0,0]=4 1408 B14R0.392 CCCCCCCCCCCCCN[13CH3] 2230a_100011215765_200025704644 [1,0,1,0,0,0|2,0,0]=4 1409 B14R0.392 CCCCCCCCCCCCCN[13CH3] 34a_100011215765_200025704644 [1,0,1,0,0,0|2,0,0]=4 1410 B14R0.392 CCCCCCCCCCCCCOC 34a_100000185773_200000210301 [1,0,1,0,0,0|2,0,0]=4 1411 B14R0.392 CCCCCCCCCCCCCOC 34a_100138415774_100000210684 [1,0,1,0,0,0|2,0,0]=4 1412 B14R0.392 CCCCCCCCCCCCCOC 7a_100000185773_200000210301 [1,0,1,0,0,0|2,0,0]=4 1413 B14R0.392 CCCCCCCCCCCCCO[13CH3] 34a_100000185773_200025704644 [1,0,1,0,0,0|2,0,0]=4 1414 B14R0.392 CCCCCCCCCCCCCO[13CH3] 7a_100000185773_200025704644 [1,0,1,0,0,0|2,0,0]=4 1415 B14R0.392 CCCCCCCCCCCCCSC 62a_200000210301_100011934334 [1,0,1,0,0,0|2,0,0]=4 1416 B14R0.392 CCCCCCCCCCCCCS[13CH3] 62a_200025704644_100011934334 [1,0,1,0,0,0|2,0,0]=4 1417 B14R0.392 CCCCCCCCCCCNCC=O 2230a_200011215754_200015260668 [1,0,1,0,0,0|1,0,0]=3 1418 B14R0.392 CCCCCCCCCCCNCC=O 34a_200011215754_200009817547 [1,0,1,0,0,0|1,0,0]=3 1419 B14R0.392 CCCCCCCCCCCNCCC 2230a_200011215754_100000210303 [1,0,1,0,0,0|2,0,0]=4 1420 B14R0.392 CCCCCCCCCCCNCCC 34a_200011215754_100000210303 [1,0,1,0,0,0|2,0,0]=4 1421 B14R0.392 CCCCCCCCCCCNCCO 2230a_100016997473_100011215454 [1,0,1,0,0,0|1,0,1]=4 1422 B14R0.392 CCCCCCCCCCCNCCO 2230a_200011215754_100000211926 [1,0,1,0,0,0|1,0,1]=4 1423 B14R0.392 CCCCCCCCCCCNCCO 34a_100016990907_100011215454 [1,0,1,0,0,0|1,0,1]=4 1424 B14R0.392 CCCCCCCCCCCNCCO 34a_200011215754_100000211926 [1,0,1,0,0,0|1,0,1]=4 1425 B14R0.392 CCCCCCCCCCCOCC=O 34a_100000210809_200009817547 [1,0,1,0,0,0|1,0,0]=3 1426 B14R0.392 CCCCCCCCCCCOCC=O 7a_100000210809_200015260668 [1,0,1,0,0,0|1,0,0]=3 1427 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210258_100011215454 [1,0,1,0,0,0|2,0,0]=4 1428 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210809_100000210303 [1,0,1,0,0,0|2,0,0]=4 1429 B14R0.392 CCCCCCCCCCCOCCC 7a_100000210809_100000210303 [1,0,1,0,0,0|2,0,0]=4 1430 B14R0.392 CCCCCCCCCCCOCCO 34a_100000210809_100000211926 [1,0,1,0,0,0|1,0,1]=4 1431 B14R0.392 CCCCCCCCCCCOCCO 7a_100000210809_100000211926 [1,0,1,0,0,0|1,0,1]=4 1432 B14R0.392 CCCCCCCCCCCSCC=O 62a_200015260668_100011215454 [1,0,1,0,0,0|1,0,0]=3 1433 B14R0.392 CCCCCCCCCCCSCCC 62a_100000210303_100011215454 [1,0,1,0,0,0|2,0,0]=4 1434 B14R0.392 CCCCCCCCCCCSCCO 62a_100000211926_100011215454 [1,0,1,0,0,0|1,0,1]=4 1435 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000102301_100000210320 [1,0,1,0,0,0|1,0,1]=4 1436 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000684558_100000210211 [1,0,1,0,0,0|1,0,1]=4 1437 B14R0.392 CCCCCCCCCCNCCCC 34a_100000684558_100000210210 [1,0,1,0,0,0|1,0,1]=4 1438 B14R0.392 CCCCCCCCCCNCCCC 7a_106832991798_100000210320 [1,0,1,0,0,0|1,0,1]=4 1439 B14R0.392 CCCCCCCCCCNCCCO 2230a_100000684558_100000230001 [1,0,1,0,0,0|1,0,1]=4 1440 B14R0.392 CCCCCCCCCCNCCCO 34a_100000684558_100000230001 [1,0,1,0,0,0|1,0,1]=4 1441 B14R0.392 CCCCCCCCCCOCCCBr 34a_100011217188_100000210320 [1,0,1,0,0,0|1,0,1]=4 1442 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210227_100000210320 [1,0,1,0,0,0|0,0,1]=3 1443 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210711_100000210210 [1,0,1,0,0,0|0,0,1]=3 1444 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210227_100000210320 [1,0,1,0,0,0|0,0,1]=3 1445 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210711_100000210211 [1,0,1,0,0,0|0,0,1]=3 1446 B14R0.392 CCCCCCCCCCOCCCCl 34a_100000230001_100000210320 [1,0,1,0,0,0|1,0,1]=4 1447 B14R0.392 CCCCCCCCCCOCCCF 34a_100000210711_100011934791 [1,0,1,0,0,0|1,0,1]=4 1448 B14R0.392 CCCCCCCCCCOCCCF 34a_100000759539_100000210320 [1,0,1,0,0,0|1,0,1]=4 1449 B14R0.392 CCCCCCCCCCOCCCF 7a_100000210711_100011934791 [1,0,1,0,0,0|1,0,1]=4 1450 B14R0.392 CCCCCCCCCCOCCCN 34a_100000182051_100000210320 [1,0,1,0,0,0|1,0,1]=4 1451 B14R0.392 CCCCCCCCCCOCCCO 34a_100000210711_100000230001 [1,0,1,0,0,0|1,0,1]=4 1452 B14R0.392 CCCCCCCCCCOCCCO 7a_100000210711_100011215043 [1,0,1,0,0,0|1,0,1]=4 1453 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210237_100000210320 [1,0,1,0,0,0|1,0,1]=4 1454 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210711_100011201679 [1,0,1,0,0,0|1,0,1]=4 1455 B14R0.392 CCCCCCCCCCOCCOC 7a_100000210711_100000233755 [1,0,1,0,0,0|1,0,1]=4 1456 B14R0.392 CCCCCCCCCCOCCSC 34a_100000210711_100000212216 [1,0,1,0,0,0|1,0,1]=4 1457 B14R0.392 CCCCCCCCCCOCCSC 34a_100000230434_100000210320 [1,0,1,0,0,0|1,0,1]=4 1458 B14R0.392 CCCCCCCCCCOCCSC 7a_100000210711_100000212216 [1,0,1,0,0,0|1,0,1]=4 1459 B14R0.392 CCCCCCCCCCOCCSC 7a_100000230434_100000210320 [1,0,1,0,0,0|1,0,1]=4 1460 B14R0.392 CCCCCCCCCCSCCCC 62a_100000210211_100000210320 [1,0,1,0,0,0|0,1,1]=4 1461 B14R0.392 CCCCCCCCCCSCCCO 62a_100011215043_100000210320 [1,0,1,0,0,0|1,0,1]=4 1462 B14R0.392 CCCCCCCCCNCCCC=O 2230a_100000212291_200011292268 [1,0,1,0,0,0|1,0,0]=3 1463 B14R0.392 CCCCCCCCCNCCCCO 2230a_100000212291_100000210776 [1,0,1,0,0,0|1,0,1]=4 1464 B14R0.392 CCCCCCCCCNCCCCO 2230a_100000750430_100011214924 [1,0,1,0,0,0|1,0,1]=4 1465 B14R0.392 CCCCCCCCCNCCCCO 34a_100000212291_100011216708 [1,0,1,0,0,0|1,0,1]=4 1466 B14R0.392 CCCCCCCCCNCCCCO 34a_100000750430_100011214924 [1,0,1,0,0,0|1,0,1]=4 1467 B14R0.392 CCCCCCCCCOCCCC=O 7a_100000210712_200011292268 [1,0,1,0,0,0|1,0,0]=3 1468 B14R0.392 CCCCCCCCCOCCCCO 34a_100000210712_100011216708 [1,0,1,0,0,0|1,0,1]=4 1469 B14R0.392 CCCCCCCCCOCCCCO 7a_100000210712_100000210776 [1,0,1,0,0,0|1,0,1]=4 1470 B14R0.392 CCCCCCCCCSCCCC=O 62a_200011292268_100000210670 [1,0,1,0,0,0|1,0,0]=3 1471 B14R0.392 CCCCCCCCCSCCCCO 62a_100000210776_100000210670 [1,0,1,0,0,0|1,0,1]=4 1472 B14R0.392 CCCCCCCCNCCCCC=O 2230a_100000229939_100000139335 [1,0,1,0,0,0|1,0,0]=3 1473 B14R0.392 CCCCCCCCNCCCCCO 2230a_100000229939_100000746330 [1,0,1,0,0,0|1,0,1]=4 1474 B14R0.392 CCCCCCCCNCCCCCO 2230a_100000762737_100000210759 [1,0,1,0,0,0|1,0,1]=4 1475 B14R0.392 CCCCCCCCNCCCCCO 34a_100000229939_100000746330 [1,0,1,0,0,0|1,0,1]=4 1476 B14R0.392 CCCCCCCCNCCCCCO 34a_100000762737_100000210759 [1,0,1,0,0,0|1,0,1]=4 1477 B14R0.392 CCCCCCCCNCOCCCC 2230a_100000229939_100011995733 [1,0,1,0,0,0|1,0,1]=4 1478 B14R0.392 CCCCCCCCNCOCCCC 34a_100000229939_100011995733 [1,0,1,0,0,0|1,0,1]=4 1479 B14R0.392 CCCCCCCCOCCCCC=O 7a_100000210232_100000139335 [1,0,1,0,0,0|1,0,0]=3 1480 B14R0.392 CCCCCCCCOCCCCCO 34a_100000210232_100000746330 [1,0,1,0,0,0|1,0,1]=4 1481 B14R0.392 CCCCCCCCOCCCCCO 7a_100000210232_100000746330 [1,0,1,0,0,0|1,0,1]=4 1482 B14R0.392 CCCCCCCCOCOCCCC 34a_100000210232_100011995733 [1,0,1,0,0,0|1,0,1]=4 1483 B14R0.392 CCCCCCCCSCCCCC=O 62a_100000139335_100000210317 [1,0,1,0,0,0|1,0,0]=3 1484 B14R0.392 CCCCCCCCSCCCCC=O 62a_100000210759_100000139335 [1,0,1,0,0,0|1,0,0]=3 1485 B14R0.392 CCCCCCCCSCCCCCO 62a_100000210759_100000746330 [1,0,1,0,0,0|1,0,1]=4 1486 B14R0.392 CCCCCCCCSCCCCCO 62a_100000746330_100000210317 [1,0,1,0,0,0|1,0,1]=4 1487 B14R0.392 CCCCCCCCSCOCCCC 62a_100000210759_100011995733 [1,0,1,0,0,0|1,0,1]=4 1488 B14R0.392 CCCCCCCCSCOCCCC 62a_100011995733_100000210317 [1,0,1,0,0,0|1,0,1]=4 1489 B14R0.392 CCCCCCCNCCCCCC=O 2230a_100000229938_100000139337 [1,0,1,0,0,0|1,0,0]=3 1490 B14R0.392 CCCCCCCNCCCCCCO 2230a_100000229938_100000766143 [1,0,1,0,0,0|1,0,1]=4 1491 B14R0.392 CCCCCCCNCCCCCCO 2230a_100000686447_100000210681 [1,0,1,0,0,0|1,0,1]=4 1492 B14R0.392 CCCCCCCNCCCCCCO 34a_100000686447_100000210614 [1,0,1,0,0,0|1,0,1]=4 1493 B14R0.392 CCCCCCCNCCOCCCC 2230a_100000229938_100000743108 [1,0,1,0,0,0|1,0,1]=4 1494 B14R0.392 CCCCCCCOCCCCCC=O 7a_100000210272_100000139337 [1,0,1,0,0,0|1,0,0]=3 1495 B14R0.392 CCCCCCCOCCCCCCO 34a_100000210272_100000766143 [1,0,1,0,0,0|1,0,1]=4 1496 B14R0.392 CCCCCCCOCCCCCCO 7a_100000210272_100000766143 [1,0,1,0,0,0|1,0,1]=4 1497 B14R0.392 CCCCCCCOCCOCCCC 34a_100000210238_100000210614 [1,0,1,0,0,0|1,0,1]=4 1498 B14R0.392 CCCCCCCOCCOCCCC 34a_100000210272_100000743108 [1,0,1,0,0,0|1,0,1]=4 1499 B14R0.392 CCCCCCCOCCOCCCC 7a_100000210238_100000210614 [1,0,1,0,0,0|1,0,1]=4 1500 B14R0.392 CCCCCCCOCCOCCCC 7a_100000210272_100000743108 [1,0,1,0,0,0|1,0,1]=4 1501 B14R0.392 CCCCCCCSCCCCCC=O 62a_100000139337_100000210316 [1,0,1,0,0,0|1,0,0]=3 1502 B14R0.392 CCCCCCCSCCCCCC=O 62a_100000210614_100000139337 [1,0,1,0,0,0|1,0,0]=3 1503 B14R0.392 CCCCCCCSCCCCCCO 62a_100000210614_100000766143 [1,0,1,0,0,0|1,0,1]=4 1504 B14R0.392 CCCCCCCSCCCCCCO 62a_100000766143_100000210316 [1,0,1,0,0,0|1,0,1]=4 1505 B14R0.392 CCCCCCCSCCOCCCC 62a_100000210614_100000743108 [1,0,1,0,0,0|1,0,1]=4 1506 B14R0.392 CCCCCCCSCCOCCCC 62a_100000743108_100000210316 [1,0,1,0,0,0|1,0,1]=4 1507 B14R0.392 CCCCCCNCCCCCCCO 2230a_100000210581_100000760002 [1,0,1,0,0,0|1,0,1]=4 1508 B14R0.392 CCCCCCNCCCCCCCO 2230a_100011996573_100000210314 [1,0,1,0,0,0|1,0,1]=4 1509 B14R0.392 CCCCCCNCCCCCCCO 34a_100011996573_100000210314 [1,0,1,0,0,0|1,0,1]=4 1510 B14R0.392 CCCCCCNCCCOCCCC 2230a_200000211371_100000210314 [1,0,1,0,0,0|1,0,1]=4 1511 B14R0.392 CCCCCCNCCCOCCCC 34a_200000211371_100000210314 [1,0,1,0,0,0|1,0,1]=4 1512 B14R0.392 CCCCCCOCCCCCCCO 34a_100000210259_100000760002 [1,0,1,0,0,0|1,0,1]=4 1513 B14R0.392 CCCCCCOCCCCCCCO 7a_100000210259_100000760002 [1,0,1,0,0,0|1,0,1]=4 1514 B14R0.392 CCCCCCOCCCOCCCC 34a_200011215613_100000210314 [1,0,1,0,0,0|1,0,1]=4 1515 B14R0.392 CCCCCCOCCCOCCCC 7a_200011215613_100000210314 [1,0,1,0,0,0|1,0,1]=4 1516 B14R0.392 CCCCCCOCCOCCCC=O 7a_100000691444_200011292268 [1,0,1,0,0,0|2,0,0]=4 1517 B14R0.392 CCCCCCSCCCCCCCO 62a_100000210314_100000760002 [1,0,1,0,0,0|1,0,1]=4 1518 B14R0.392 CCCCCCSCCCCCCCO 62a_100000760002_100000210757 [1,0,1,0,0,0|1,0,1]=4 1519 B14R0.392 CCCCCNCCCCCCCCO 2230a_100000209983_100000033203 [1,0,1,0,0,0|1,0,1]=4 1520 B14R0.392 CCCCCNCCCCCCCCO 2230a_102515433106_100000210326 [1,0,1,0,0,0|1,0,1]=4 1521 B14R0.392 CCCCCNCCCCCCCCO 34a_102515433106_100000718602 [1,0,1,0,0,0|1,0,1]=4 1522 B14R0.392 CCCCCOCCCCCCCCO 34a_100000210253_100000033203 [1,0,1,0,0,0|1,0,1]=4 1523 B14R0.392 CCCCCOCCCCCCCCO 7a_100000210253_100000033203 [1,0,1,0,0,0|1,0,1]=4 1524 B14R0.392 CCCCCOCCCCOCCCC 34a_200000760531_100000718602 [1,0,1,0,0,0|1,0,1]=4 1525 B14R0.392 CCCCCOCCCCOCCCC 7a_200000760531_100000210326 [1,0,1,0,0,0|1,0,1]=4 1526 B14R0.392 CCCCCOCCOCCCCC=O 7a_100011215259_100000139335 [1,0,1,0,0,0|2,0,0]=4 1527 B14R0.392 CCCCCSCCCCCCCCO 62a_100000033203_100000210326 [1,0,1,0,0,0|1,0,1]=4 1528 B14R0.392 CCCCCSCCCCCCCCO 62a_100000210326_100000033203 [1,0,1,0,0,0|1,0,1]=4 1529 B14R0.392 CCCCNCCCCCCCCCO 2230a_100000078944_100000210211 [1,0,1,0,0,0|1,0,1]=4 1530 B14R0.392 CCCCNCCCCCCCCCO 2230a_100000102301_100009813782 [1,0,1,0,0,0|1,0,1]=4 1531 B14R0.392 CCCCNCCCCCCCCCO 34a_100000078944_100000210210 [1,0,1,0,0,0|1,0,1]=4 1532 B14R0.392 CCCCNCCCCCCCCCO 7a_106832991798_100009813782 [1,0,1,0,0,0|1,0,1]=4 1533 B14R0.392 CCCCOCCCCCCCCCBr 34a_100009813782_100000210210 [1,0,1,0,0,0|1,0,1]=4 1534 B14R0.392 CCCCOCCCCCCCCCBr 7a_100009813782_100000210211 [1,0,1,0,0,0|1,0,1]=4 1535 B14R0.392 CCCCOCCCCCCCCCCl 34a_100009868337_100000210210 [1,0,1,0,0,0|1,0,1]=4 1536 B14R0.392 CCCCOCCCCCCCCCCl 7a_100009868337_100000210211 [1,0,1,0,0,0|1,0,1]=4 1537 B14R0.392 CCCCOCCCCCCCCCN 34a_100000078944_100000210210 [1,0,1,0,0,0|1,0,1]=4 1538 B14R0.392 CCCCOCCCCCCCCCO 34a_100000210227_100009813782 [1,0,1,0,0,0|1,0,1]=4 1539 B14R0.392 CCCCOCCCCCCCCCO 7a_100000210227_100009813782 [1,0,1,0,0,0|1,0,1]=4 1540 B14R0.392 CCCCOCCCCOCCCC=O 7a_200000760531_200011292268 [1,0,1,0,0,0|2,0,0]=4 1541 B14R0.392 CCCCOCCCNCCCCC=O 2230a_200000211371_100000139335 [1,0,1,0,0,0|2,0,0]=4 1542 B14R0.392 CCCCOCCCOCCCCC=O 7a_200011215613_100000139335 [1,0,1,0,0,0|2,0,0]=4 1543 B14R0.392 CCCCOCCOCCCCCC=O 7a_100000210238_100000139337 [1,0,1,0,0,0|2,0,0]=4 1544 B14R0.392 CCCCOCCSCCCCCC=O 62a_100000139337_100000743108 [1,0,1,0,0,0|2,0,0]=4 1545 B14R0.392 CCCCOCCSCCCCCC=O 62a_100000743108_100000139337 [1,0,1,0,0,0|2,0,0]=4 1546 B14R0.392 CCCCSCCCCCCCCCO 62a_100000210211_100009813782 [1,0,1,0,0,0|1,0,1]=4 1547 B14R0.392 CCCCSCCCCCCCCCO 62a_100009813782_100000210210 [1,0,1,0,0,0|1,0,1]=4 1548 B14R0.392 CCCCSCCNCCCCCC=O 2230a_100025743550_100000139337 [1,0,1,0,0,0|2,0,0]=4 1549 B14R0.392 CCCCSCCOCCCCCC=O 7a_200000230436_100000139337 [1,0,1,0,0,0|2,0,0]=4 1550 B14R0.392 CCCNCCCCCCCCCCO 2230a_100000066964_100000210303 [1,0,1,0,0,0|1,0,1]=4 1551 B14R0.392 CCCNCCCCCCCCCCO 34a_100000066964_100000210303 [1,0,1,0,0,0|1,0,1]=4 1552 B14R0.392 CCCOCCCCCCCCCCO 34a_100000210258_100009813290 [1,0,1,0,0,0|1,0,1]=4 1553 B14R0.392 CCCOCCCNCCCCCC=O 2230a_100011217757_100000139337 [1,0,1,0,0,0|2,0,0]=4 1554 B14R0.392 CCCSCCCCCCCCCCO 62a_100000210303_200000033068 [1,0,1,0,0,0|1,0,1]=4 1555 B14R0.392 CCCSCCCCCCCCCCO 62a_100009813290_100000210303 [1,0,1,0,0,0|1,0,1]=4 1556 B14R0.392 CCNCCCCCCCCCCCO 2230a_100015525214_100009812471 [1,0,1,0,0,0|1,0,1]=4 1557 B14R0.392 CCOCCCCCCCCCCCO 34a_100121572206_100009812471 [1,0,1,0,0,0|1,0,1]=4 1558 B14R0.392 CCSCCCCCCCCCCCO 62a_100009812471_100000210202 [1,0,1,0,0,0|1,0,1]=4 1559 B14R0.392 CNCCCCCCCCCCCCO 2230a_100000066677_200000210301 [1,0,1,0,0,0|1,0,1]=4 1560 B14R0.392 CNCCCCCCCCCCCCO 2230a_106832991635_100009813331 [1,0,1,0,0,0|1,0,1]=4 1561 B14R0.392 CNCCCCCCCCCCCCO 34a_100000066677_200000210301 [1,0,1,0,0,0|1,0,1]=4 1562 B14R0.392 CNCCCCCCCCCCCCO 34a_100102657272_100009813331 [1,0,1,0,0,0|1,0,1]=4 1563 B14R0.392 CNCCCCCCCCCCCCO 7a_106832991635_100009813331 [1,0,1,0,0,0|1,0,1]=4 1564 B14R0.392 COCCCCCCCCCCCCO 34a_100138415774_100009813331 [1,0,1,0,0,0|1,0,1]=4 1565 B14R0.392 COCCCCCCOCCCCC=O 7a_200012092642_100000139335 [1,0,1,0,0,0|2,0,0]=4 1566 B14R0.392 COCCCCCCSCCCCC=O 62a_100000139335_100011998445 [1,0,1,0,0,0|2,0,0]=4 1567 B14R0.392 COCCCCCCSCCCCC=O 62a_100011998445_100000139335 [1,0,1,0,0,0|2,0,0]=4 1568 B14R0.392 COCCCCCNCCCCCC=O 2230a_100000747528_100000139337 [1,0,1,0,0,0|2,0,0]=4 1569 B14R0.392 CSCCCCCCCCCCCCO 62a_100009813331_200000210301 [1,0,1,0,0,0|1,0,1]=4 1570 B14R0.392 NCCCCCCCCCCOCC=O 34a_100000066964_200009817547 [1,0,1,0,0,0|2,0,0]=4 1571 B14R0.392 O=CCCCCCNCCCCCCO 2230a_100000686447_100000139337 [1,0,1,0,0,0|2,0,0]=4 1572 B14R0.392 O=CCCCCCOCCCCCCBr 7a_100011215345_100000139337 [1,0,1,0,0,0|2,0,0]=4 1573 B14R0.392 O=CCCCCCOCCCCCCCl 7a_100000766143_100000139337 [1,0,1,0,0,0|2,0,0]=4 1574 B14R0.392 O=CCCCCCOCCCCCCF 7a_100000732779_100000139337 [1,0,1,0,0,0|2,0,0]=4 1575 B14R0.392 O=CCCCCCSCCCCCCF 62a_100000139337_100015922095 [1,0,1,0,0,0|2,0,0]=4 1576 B14R0.392 O=CCCCCCSCCCCCCF 62a_100015922095_100000139337 [1,0,1,0,0,0|2,0,0]=4 1577 B14R0.392 O=CCCCCCSCCCCCCO 62a_100000139337_100000766143 [1,0,1,0,0,0|2,0,0]=4 1578 B14R0.392 O=CCCCCCSCCCCCCO 62a_100000766143_100000139337 [1,0,1,0,0,0|2,0,0]=4 1579 B14R0.392 O=CCCCCNCCCCCCCO 2230a_100011996573_100000139335 [1,0,1,0,0,0|2,0,0]=4 1580 B14R0.392 O=CCCCCOCCCCCCCBr 7a_100000760002_100000139335 [1,0,1,0,0,0|2,0,0]=4 1581 B14R0.392 O=CCCCCSCCCCCCCO 62a_100000139335_100000760002 [1,0,1,0,0,0|2,0,0]=4 1582 B14R0.392 O=CCCCCSCCCCCCCO 62a_100000760002_100000139335 [1,0,1,0,0,0|2,0,0]=4 1583 B14R0.392 O=CCCCNCCCCCCCCO 2230a_102515433106_200011292268 [1,0,1,0,0,0|2,0,0]=4 1584 B14R0.392 O=CCCCOCCCCCCCCBr 7a_100009813846_200011292268 [1,0,1,0,0,0|2,0,0]=4 1585 B14R0.392 O=CCCCOCCCCCCCCCl 7a_100000033203_200011292268 [1,0,1,0,0,0|2,0,0]=4 1586 B14R0.392 O=CCCCSCCCCCCCCO 62a_100000033203_200011292268 [1,0,1,0,0,0|2,0,0]=4 1587 B14R0.392 O=CCCCSCCCCCCCCO 62a_200011292268_100000033203 [1,0,1,0,0,0|2,0,0]=4 1588 B14R0.392 O=CCNCCCCCCCCCCO 2230a_100000066964_200015260668 [1,0,1,0,0,0|2,0,0]=4 1589 B14R0.392 O=CCNCCCCCCCCCCO 34a_100000066964_200009817547 [1,0,1,0,0,0|2,0,0]=4 1590 B14R0.392 O=CCOCCCCCCCCCCBr 34a_100009813290_200009817547 [1,0,1,0,0,0|2,0,0]=4 1591 B14R0.392 O=CCOCCCCCCCCCCBr 7a_100009813290_200015260668 [1,0,1,0,0,0|2,0,0]=4 1592 B14R0.392 O=CCOCCCCCCCCCCCl 34a_200000033068_200009817547 [1,0,1,0,0,0|2,0,0]=4 1593 B14R0.392 O=CCOCCCCCCCCCCCl 7a_200000033068_200015260668 [1,0,1,0,0,0|2,0,0]=4 1594 B14R0.392 O=CCSCCCCCCCCCCO 62a_100009813290_200015260668 [1,0,1,0,0,0|2,0,0]=4 1595 B14R0.392 O=CCSCCCCCCCCCCO 62a_200015260668_200000033068 [1,0,1,0,0,0|2,0,0]=4 1596 B14R0.392 [13CH3]NCCCCCCCCCCCCO 2230a_100000066677_200025704644 [1,0,1,0,0,0|1,0,1]=4 1597 B14R0.392 [13CH3]NCCCCCCCCCCCCO 34a_100000066677_200025704644 [1,0,1,0,0,0|1,0,1]=4 1598 B14R0.392 [13CH3]SCCCCCCCCCCCCO 62a_100009813331_200025704644 [1,0,1,0,0,0|1,0,1]=4 1599 B14R0.394 CC(=O)CCCCCCCCCCCO 1458a_100000070787_100009812471 [1,0,1,0,0,0|2,0,0]=4 1600 B14R0.394 CCCCCCCCCCCCC(=O)C 1458a_100000070787_100000759014 [1,0,1,0,0,0|1,0,0]=3 1601 B14R0.394 CCCCCCCCCCCCC(=O)C 1458a_100011215791_200000210301 [1,0,1,0,0,0|1,0,0]=3 1602 B14R0.394 CCCCCCCCCCCCC(=O)[13CH3] 1458a_100011215791_200025704644 [1,0,1,0,0,0|1,0,0]=3 1603 B14R0.394 CCCCCCCCCCCNC(=O)C 11a_200011215754_100015343762 [1,0,1,0,0,0|2,0,0]=4 1604 B14R0.394 CCCCCCCCCCCNC(=O)C 1626a_200011215754_100015343762 [1,0,1,0,0,0|2,0,0]=4 1605 B14R0.394 CCCCCCCCCCCNC(=O)C 240690a_200011215754_100015343762 [1,0,1,0,0,0|2,0,0]=4 1606 B14R0.394 CCCCCCCCCCCNC(=O)C 527a_200011215754_100103153847 [1,0,1,0,0,0|2,0,0]=4 1607 B14R0.394 CCCCCCCCCCNCC(=O)N 2230a_100000684558_100000747473 [1,0,1,0,0,0|2,0,0]=4 1608 B14R0.394 CCCCCCCCCCNCC(=O)N 2230a_100000711301_100000210320 [1,0,1,0,0,0|2,0,0]=4 1609 B14R0.394 CCCCCCCCCCNCC(=O)N 34a_100000684558_100000187820 [1,0,1,0,0,0|2,0,0]=4 1610 B14R0.394 CCCCCCCCCCNCC(=O)O 269956a_100016091260_100000210320 [1,0,1,0,0,0|1,0,0]=3 1611 B14R0.394 CCCCCCCCCCNCC(=O)[O-] 34a_100000684558_100020667443 [1,0,1,0,0,0|1,0,1]=4 1612 B14R0.394 CCCCCCCCCCOCC(=O)C 34a_100000211253_100000210320 [1,0,1,0,0,0|2,0,0]=4 1613 B14R0.394 CCCCCCCCCCOCC(=O)N 34a_100000210711_100000187820 [1,0,1,0,0,0|2,0,0]=4 1614 B14R0.394 CCCCCCCCCCOCC(=O)N 7a_100000210711_100000187820 [1,0,1,0,0,0|2,0,0]=4 1615 B14R0.394 CCCCCCCCCCOCC(=O)[O-] 34a_100000210711_100020667443 [1,0,1,0,0,0|1,0,1]=4 1616 B14R0.394 CCCCCCCCCCSCC(=O)N 62a_100000747473_100000210320 [1,0,1,0,0,0|2,0,0]=4 1617 B14R0.394 CCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100000210320 [1,0,1,0,0,0|1,0,1]=4 1618 B14R0.394 CCCCCCCCCNCCC(=O)N 2230a_100000212291_100000744528 [1,0,1,0,0,0|2,0,0]=4 1619 B14R0.394 CCCCCCCCCNCCC(=O)N 34a_100000212291_100000731001 [1,0,1,0,0,0|2,0,0]=4 1620 B14R0.394 CCCCCCCCCNOCC(=O)O 269956a_100000106656_100000210670 [1,0,1,0,0,0|2,0,0]=4 1621 B14R0.394 CCCCCCCCCOCCC(=O)C 34a_100000759926_100011214924 [1,0,1,0,0,0|2,0,0]=4 1622 B14R0.394 CCCCCCCCCOCCC(=O)C 7a_100000210712_100000053229 [1,0,1,0,0,0|2,0,0]=4 1623 B14R0.394 CCCCCCCCCOCCC(=O)C 7a_100000759926_100000210328 [1,0,1,0,0,0|2,0,0]=4 1624 B14R0.394 CCCCCCCCCOCCC(=O)N 34a_100000210712_100000731001 [1,0,1,0,0,0|2,0,0]=4 1625 B14R0.394 CCCCCCCCCOCCC(=O)N 34a_100000757172_100011214924 [1,0,1,0,0,0|2,0,0]=4 1626 B14R0.394 CCCCCCCCCOCCC(=O)N 7a_100000210712_100000744528 [1,0,1,0,0,0|2,0,0]=4 1627 B14R0.394 CCCCCCCCCOCCC(=O)N 7a_100000757172_100000210328 [1,0,1,0,0,0|2,0,0]=4 1628 B14R0.394 CCCCCCCCCSCCC(=O)C 62a_100000053229_100000210670 [1,0,1,0,0,0|2,0,0]=4 1629 B14R0.394 CCCCCCCCCSCCC(=O)N 62a_100000744528_100000210670 [1,0,1,0,0,0|2,0,0]=4 1630 B14R0.394 CCCCCCCCNCCCC(=O)C 34a_100000229939_100000685027 [1,0,1,0,0,0|2,0,0]=4 1631 B14R0.394 CCCCCCCCNCCCC(=O)N 34a_100000229939_100102525003 [1,0,1,0,0,0|2,0,0]=4 1632 B14R0.394 CCCCCCCCNCCCC(=O)N 34a_100000739312_100000210759 [1,0,1,0,0,0|2,0,0]=4 1633 B14R0.394 CCCCCCCCOCCCC(=O)C 34a_100000210232_100000685027 [1,0,1,0,0,0|2,0,0]=4 1634 B14R0.394 CCCCCCCCOCCCC(=O)C 34a_100000759063_100000210759 [1,0,1,0,0,0|2,0,0]=4 1635 B14R0.394 CCCCCCCCOCCCC(=O)C 7a_100000210232_100011215641 [1,0,1,0,0,0|2,0,0]=4 1636 B14R0.394 CCCCCCCCOCCCC(=O)C 7a_100000759063_100000210759 [1,0,1,0,0,0|2,0,0]=4 1637 B14R0.394 CCCCCCCCOCCCC(=O)N 34a_100000210232_100102525003 [1,0,1,0,0,0|2,0,0]=4 1638 B14R0.394 CCCCCCCCOCCCC(=O)N 7a_100000210232_100102525003 [1,0,1,0,0,0|2,0,0]=4 1639 B14R0.394 CCCCCCCCSCCCC(=O)C 62a_100000210759_100011215641 [1,0,1,0,0,0|2,0,0]=4 1640 B14R0.394 CCCCCCCCSCCCC(=O)C 62a_100011215641_100000210317 [1,0,1,0,0,0|2,0,0]=4 1641 B14R0.394 CCCCCCCCSCCCC(=O)N 62a_100000210759_100102525003 [1,0,1,0,0,0|2,0,0]=4 1642 B14R0.394 CCCCCCCCSCCCC(=O)N 62a_100102525003_100000210317 [1,0,1,0,0,0|2,0,0]=4 1643 B14R0.394 CCCCCCCNCCCCC(=O)N 34a_100000696515_100000210614 [1,0,1,0,0,0|2,0,0]=4 1644 B14R0.394 CCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210614 [1,0,1,0,0,0|2,0,0]=4 1645 B14R0.394 CCCCCCCOCCCCC(=O)C 34a_100000210272_100009817362 [1,0,1,0,0,0|2,0,0]=4 1646 B14R0.394 CCCCCCCOCCCCC(=O)C 7a_100000210272_100000735457 [1,0,1,0,0,0|2,0,0]=4 1647 B14R0.394 CCCCCCCOCCCCC(=O)N 34a_100012022536_100000210614 [1,0,1,0,0,0|2,0,0]=4 1648 B14R0.394 CCCCCCCOCCCCC(=O)N 7a_100012022536_100000210614 [1,0,1,0,0,0|2,0,0]=4 1649 B14R0.394 CCCCCCCSCCCCC(=O)C 62a_100000210614_100000735457 [1,0,1,0,0,0|2,0,0]=4 1650 B14R0.394 CCCCCCCSCCCCC(=O)C 62a_100000735457_100000210316 [1,0,1,0,0,0|2,0,0]=4 1651 B14R0.394 CCCCCCNCCCCCC(=O)N 2230a_100000210581_100009817443 [1,0,1,0,0,0|2,0,0]=4 1652 B14R0.394 CCCCCCOCCCCCC(=O)N 34a_100000123541_100000210314 [1,0,1,0,0,0|2,0,0]=4 1653 B14R0.394 CCCCCCOCCCCCC(=O)N 34a_100000210259_100009817443 [1,0,1,0,0,0|2,0,0]=4 1654 B14R0.394 CCCCCCOCCCCCC(=O)N 7a_100000123541_100000210314 [1,0,1,0,0,0|2,0,0]=4 1655 B14R0.394 CCCCCCOCCCCCC(=O)N 7a_100000210259_100009817443 [1,0,1,0,0,0|2,0,0]=4 1656 B14R0.394 CCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210314 [1,0,1,0,0,0|1,0,1]=4 1657 B14R0.394 CCCCCCSCCCCCC(=O)N 62a_100000210314_100009817443 [1,0,1,0,0,0|2,0,0]=4 1658 B14R0.394 CCCCCCSCCCCCC(=O)N 62a_100009817443_100000210757 [1,0,1,0,0,0|2,0,0]=4 1659 B14R0.394 CNCCCCCCCCCCC(=O)N 2230a_106832991635_200010167045 [1,0,1,0,0,0|2,0,0]=4 1660 B14R0.394 CNCCCCCCCCCCC(=O)N 34a_100102657272_200010167045 [1,0,1,0,0,0|2,0,0]=4 1661 B14R0.394 CNCCCCCCCCCCC(=O)N 7a_106832991635_200010167045 [1,0,1,0,0,0|2,0,0]=4 1662 B14R0.394 COCCCCCCCCCCC(=O)N 34a_100138415774_200010167045 [1,0,1,0,0,0|2,0,0]=4 1663 B14R0.394 CSCCCCCCCCCCC(=O)N 62a_200000210301_200010167045 [1,0,1,0,0,0|2,0,0]=4 1664 B14R0.394 CSCCCCCCCCCCC(=O)N 62a_200010167045_200000210301 [1,0,1,0,0,0|2,0,0]=4 1665 B14R0.394 O=C(O)CNCCCCCCCCCO 269956a_100016091260_100009813782 [1,0,1,0,0,0|2,0,0]=4 1666 B14R0.394 [13CH3]SCCCCCCCCCCC(=O)N 62a_200010167045_200025704644 [1,0,1,0,0,0|2,0,0]=4 1667 B14R0.394 [13CH3]SCCCCCCCCCCC(=O)N 62a_200025704644_200010167045 [1,0,1,0,0,0|2,0,0]=4 1668 B14R0.179 CCCCCCCCC(C)COCC=O 34a_200012125181_200009817547 [1,0,1,0,0,0|2,0,0]=4 1669 B14R0.179 CCCCCCCCC(C)COCC=O 7a_200012125181_200015260668 [1,0,1,0,0,0|2,0,0]=4 1670 B14R0.179 CCCCCCCCN(C)CCCC=O 2230a_100000207567_200011292268 [1,0,1,0,0,0|2,0,0]=4 1671 B14R0.179 CCCCCCCCN(C)CCCC=O 269982a_100000207567_200011292268 [1,0,1,0,0,0|2,0,0]=4 1672 B14R0.493 CCCCCCCCCC(C)CNCC 270004a_100015525214_200011218516 [1,0,1,0,0,0|2,0,0]=4 1673 B14R0.493 CCCCCCCCCC(C)NCCC 270004a_100020643023_100011215753 [1,0,1,0,0,0|1,0,1]=4 1674 B14R0.493 CCCCCCCCCC(C)OCC=O 34a_100011218016_200009817547 [1,0,1,0,0,0|2,0,0]=4 1675 B14R0.493 CCCCCCCCCC(C)OCC=O 7a_100011218016_200015260668 [1,0,1,0,0,0|2,0,0]=4 1676 B14R0.493 CCCCCCCCCC(C)OCCC 34a_100011218016_100000210303 [1,0,1,0,0,0|0,0,1]=3 1677 B14R0.493 CCCCCCCCCC(C)OCCC 7a_100011218016_100000210303 [1,0,1,0,0,0|0,0,1]=3 1678 B14R0.493 CCCCCCCCCC(C)OCCF 34a_100011218016_100011217306 [1,0,1,0,0,0|1,0,1]=4 1679 B14R0.493 CCCCCCCCCC(C)OCCF 7a_100011218016_100011217306 [1,0,1,0,0,0|1,0,1]=4 1680 B14R0.493 CCCCCCCCCC(C)OCCO 34a_100011218016_100000211926 [1,0,1,0,0,0|1,0,1]=4 1681 B14R0.493 CCCCCCCCCC(C)OCCO 7a_100011218016_100000211926 [1,0,1,0,0,0|1,0,1]=4 1682 B14R0.493 CCCCCCCCCC(C)OCSC 34a_100011218016_100011218213 [1,0,1,0,0,0|1,0,1]=4 1683 B14R0.493 CCCCCCCNCC(C)OCCC 2230a_100015185124_100000210681 [1,0,1,0,0,0|1,0,1]=4 1684 B14R0.493 CCCCCCCNCC(C)OCCC 34a_100015185124_100000210614 [1,0,1,0,0,0|1,0,1]=4 1685 B14R0.337 CCC(=O)CCCCCCCCCCO 1458a_100000210414_100009813290 [1,0,1,0,0,0|2,0,0]=4 1686 B14R0.337 CCC(=O)NCCCCCCCCCO 240690a_100000078944_100000210414 [1,0,1,0,0,0|2,0,0]=4 1687 B14R0.337 CCC(=O)OCCOCCCCCCF 7a_200000031056_100015922095 [1,0,1,0,0,0|2,0,0]=4 1688 B14R0.337 CCC(=O)OCCOCCCCCCO 7a_200000031056_100000766143 [1,0,1,0,0,0|2,0,0]=4 1689 B14R0.337 CCCCCCCCCC=CC(=O)CC 1458a_200015352897_100000210202 [1,0,1,0,0,0|1,0,1]=4 1690 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210414_100011215454 [1,0,1,0,0,0|1,0,0]=3 1691 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210736_100000210202 [1,0,1,0,0,0|1,0,0]=3 1692 B14R0.337 CCCCCCCCCCCC(=O)CF 1458a_100000210736_100015361967 [1,0,1,0,0,0|2,0,0]=4 1693 B14R0.337 CCCCCCCCCCCC(=O)CO 1458a_100000210174_100011215454 [1,0,1,0,0,0|2,0,0]=4 1694 B14R0.337 CCCCCCCCCCCC(=O)NC 11a_106832991635_100000210736 [1,0,1,0,0,0|2,0,0]=4 1695 B14R0.337 CCCCCCCCCCCC(=O)NC 1626a_100102657272_100000210736 [1,0,1,0,0,0|2,0,0]=4 1696 B14R0.337 CCCCCCCCCCCC(=O)NC 240690a_100102657272_100000210736 [1,0,1,0,0,0|2,0,0]=4 1697 B14R0.337 CCCCCCCCCCNC(=O)CC 11a_100000684558_100000210414 [1,0,1,0,0,0|1,0,0]=3 1698 B14R0.337 CCCCCCCCCCNC(=O)CC 1626a_100000684558_100000210414 [1,0,1,0,0,0|1,0,0]=3 1699 B14R0.337 CCCCCCCCCCNC(=O)CC 240690a_100000684558_100000210414 [1,0,1,0,0,0|1,0,0]=3 1700 B14R0.337 CCCCCCCCCCNC(=O)CC 527a_100000684558_100000210414 [1,0,1,0,0,0|1,0,0]=3 1701 B14R0.337 CCCCCCCCCCNC(=O)CO 240690a_100000684558_100000210174 [1,0,1,0,0,0|2,0,0]=4 1702 B14R0.337 CCCCCCCCCCNC(=O)CO 527a_100000684558_100000210174 [1,0,1,0,0,0|2,0,0]=4 1703 B14R0.337 CCCCCCCCCCNC(=O)NC 2708a_100000684558_106832991635 [1,0,1,0,0,0|2,0,0]=4 1704 B14R0.337 CCCCCCCCCCNC(=O)NC 2708a_100102657272_100000684558 [1,0,1,0,0,0|2,0,0]=4 1705 B14R0.337 CCCCCCCCCCNC(=O)NC 273464a_100000684558_100102657272 [1,0,1,0,0,0|2,0,0]=4 1706 B14R0.337 CCCCCCCCCCNC(=O)NC 273464a_100102657272_100000684558 [1,0,1,0,0,0|2,0,0]=4 1707 B14R0.337 CCCCCCCCCCNC(=O)NC 512a_100000684558_100102657272 [1,0,1,0,0,0|2,0,0]=4 1708 B14R0.337 CCCCCCCCCCNC(=O)NC 512a_106832991638_100000684558 [1,0,1,0,0,0|2,0,0]=4 1709 B14R0.337 CCCCCCCCCCOC(C)CC 34a_100000210711_100011215416 [1,0,1,0,0,0|1,0,1]=4 1710 B14R0.337 CCCCCCCCCCOC(C)CC 7a_100000210228_100000210320 [1,0,1,0,0,0|1,0,1]=4 1711 B14R0.337 CCCCCCCCCCOC(C)CC 7a_100000210711_100000758301 [1,0,1,0,0,0|1,0,1]=4 1712 B14R0.337 CCCCCCCCCOCC(=O)CC 34a_100000725409_100011214924 [1,0,1,0,0,0|2,0,0]=4 1713 B14R0.337 CCCCCCCCCOCC(=O)CC 7a_100000210712_100000747405 [1,0,1,0,0,0|2,0,0]=4 1714 B14R0.337 CCCCCCCCCSCC(=O)CC 62a_100000747405_100000210670 [1,0,1,0,0,0|2,0,0]=4 1715 B14R0.337 CCCCCCCCSCOC(=O)OC 62a_100000210759_100000139417 [1,0,1,0,0,0|2,0,0]=4 1716 B14R0.337 CCCCCCCNCCNC(=O)CC 34a_100132302217_100000210614 [1,0,1,0,0,0|2,0,0]=4 1717 B14R0.337 CCCCCCCOCCNC(=O)CC 34a_200000158885_100000210614 [1,0,1,0,0,0|2,0,0]=4 1718 B14R0.337 CCCCCCCOCCNC(=O)CC 7a_200000158885_100000210614 [1,0,1,0,0,0|2,0,0]=4 1719 B14R0.337 CCCCCCCOCCOC(=O)CC 7a_200000031056_100000210614 [1,0,1,0,0,0|1,0,0]=3 1720 B14R0.337 CCCCCCCOCCOC(=O)NC 34a_100000210272_200011997002 [1,0,1,0,0,0|2,0,0]=4 1721 B14R0.337 CCCCCCCOCCOC(=O)NC 7a_100000210272_200011997002 [1,0,1,0,0,0|2,0,0]=4 1722 B14R0.337 CCCCCCCOCCOC(=O)OC 34a_100010262106_100000210614 [1,0,1,0,0,0|2,0,0]=4 1723 B14R0.337 CCCCCCCSCCOC(=O)NC 62a_100000210614_200011997002 [1,0,1,0,0,0|2,0,0]=4 1724 B14R0.337 CCCCCCCSCCOC(=O)NC 62a_200011997002_100000210316 [1,0,1,0,0,0|2,0,0]=4 1725 B14R0.337 CCCCOCCOCCOC(=O)CC 7a_200000031056_100000743108 [1,0,1,0,0,0|2,0,0]=4 1726 B14R0.393 C#CCC(=O)CCCCCCCCCC 1458a_100000210375_100000184674 [1,0,1,0,0,0|0,0,2]=4 1727 B14R0.393 C#CCC(=O)CCCCCCCCCC 1458a_100011220946_100000210319 [1,0,1,0,0,0|0,0,2]=4 1728 B14R0.393 C#CCCCCCCCCC(=O)CCC 1458a_100000029693_100000210303 [1,0,1,0,0,0|0,0,2]=4 1729 B14R0.393 C=CCC(=O)CCCCCCCCCC 1458a_100000210193_100000210319 [1,0,1,0,0,0|0,0,2]=4 1730 B14R0.393 C=CCC(=O)CCCCCCCCCC 1458a_100000210375_100000210623 [1,0,1,0,0,0|0,0,2]=4 1731 B14R0.393 C=CCCCCCCCCC(=O)CCC 1458a_100000211349_100000210303 [1,0,1,0,0,0|0,0,2]=4 1732 B14R0.393 C=CCCCCCCCCC(=O)CCC 1458a_100000211992_100011933949 [1,0,1,0,0,0|0,0,2]=4 1733 B14R0.393 CC#CC(=O)CCCCCCCCCC 1458a_100000763181_100000210319 [1,0,1,0,0,0|0,0,2]=4 1734 B14R0.393 CC#CCCCCCCCC(=O)CCC 1458a_100000066323_100000210303 [1,0,1,0,0,0|0,0,2]=4 1735 B14R0.393 CC=CC(=O)CCCCCCCCCC 1458a_100000210699_100000210319 [1,0,1,0,0,0|0,0,2]=4 1736 B14R0.393 CCC#CCCCCCCC(=O)CCC 1458a_100000211992_200000036426 [1,0,1,0,0,0|0,0,2]=4 1737 B14R0.393 CCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210303 [1,0,1,0,0,0|1,0,0]=3 1738 B14R0.393 CCCC(=O)CCCCCCCCCO 1458a_100000211992_100009813782 [1,0,1,0,0,0|1,0,0]=3 1739 B14R0.393 CCCC(=O)CNCCCCCCCO 2230a_100011996573_100000747444 [1,0,1,0,0,0|2,0,0]=4 1740 B14R0.393 CCCC(=O)COCCCCCCCBr 7a_100000760002_100000747444 [1,0,1,0,0,0|2,0,0]=4 1741 B14R0.393 CCCC(=O)COCCCCCCOC 7a_200012092642_100000747444 [1,0,1,0,0,0|2,0,0]=4 1742 B14R0.393 CCCC(=O)CSCCCCCCCO 62a_100000747444_100000760002 [1,0,1,0,0,0|2,0,0]=4 1743 B14R0.393 CCCC(=O)CSCCCCCCCO 62a_100000760002_100000747444 [1,0,1,0,0,0|2,0,0]=4 1744 B14R0.393 CCCC(=O)CSCCCCCCOC 62a_100000747444_100011998445 [1,0,1,0,0,0|2,0,0]=4 1745 B14R0.393 CCCC(=O)CSCCCCCCOC 62a_100011998445_100000747444 [1,0,1,0,0,0|2,0,0]=4 1746 B14R0.393 CCCC(=O)NCCCCCCCCO 240690a_102515433106_100000211992 [1,0,1,0,0,0|2,0,0]=4 1747 B14R0.393 CCCC(=O)OCNCCCCCCO 2230a_100000686447_100000034017 [1,0,1,0,0,0|2,0,0]=4 1748 B14R0.393 CCCC(=O)OCNCCCCCCO 34a_100000686447_100000034017 [1,0,1,0,0,0|2,0,0]=4 1749 B14R0.393 CCCC(=O)OCNCCCCCOC 2230a_100000747528_100000034017 [1,0,1,0,0,0|2,0,0]=4 1750 B14R0.393 CCCC(=O)OCNCCCCCOC 34a_100000747528_100000034017 [1,0,1,0,0,0|2,0,0]=4 1751 B14R0.393 CCCC(=O)OCOCCCCCCBr 34a_100011215345_100000034017 [1,0,1,0,0,0|2,0,0]=4 1752 B14R0.393 CCCC(=O)OCOCCCCCCCl 34a_100000766143_100000034017 [1,0,1,0,0,0|2,0,0]=4 1753 B14R0.393 CCCC(=O)OCOCCCCCCF 34a_100000732779_100000034017 [1,0,1,0,0,0|2,0,0]=4 1754 B14R0.393 CCCC(=O)OCOCCCCCCN 34a_100000686447_100000034017 [1,0,1,0,0,0|2,0,0]=4 1755 B14R0.393 CCCC(=O)OCOCCCCCNC 34a_100000722520_100000034017 [1,0,1,0,0,0|2,0,0]=4 1756 B14R0.393 CCCC(=O)OCSCCCCCCF 62a_100015922095_100000034017 [1,0,1,0,0,0|2,0,0]=4 1757 B14R0.393 CCCC(=O)OCSCCCCCCO 62a_100000766143_100000034017 [1,0,1,0,0,0|2,0,0]=4 1758 B14R0.393 CCCCCCCCC=CC(=O)CCC 1458a_100015345288_100000210303 [1,0,1,0,0,0|0,0,2]=4 1759 B14R0.393 CCCCCCCCCCC(=O)CC#N 1458a_100000210375_100011214920 [1,0,1,0,0,0|1,0,1]=4 1760 B14R0.393 CCCCCCCCCCC(=O)CC#N 1458a_100051588842_100000210319 [1,0,1,0,0,0|1,0,1]=4 1761 B14R0.393 CCCCCCCCCCC(=O)CCC 1458a_100000210375_100000210303 [1,0,1,0,0,0|0,0,0]=2 1762 B14R0.393 CCCCCCCCCCC(=O)CCC 1458a_100000211992_100000210319 [1,0,1,0,0,0|0,0,0]=2 1763 B14R0.393 CCCCCCCCCCC(=O)CCF 1458a_100000210375_100011217306 [1,0,1,0,0,0|1,0,0]=3 1764 B14R0.393 CCCCCCCCCCC(=O)CCO 1458a_100000210375_100000211926 [1,0,1,0,0,0|1,0,0]=3 1765 B14R0.393 CCCCCCCCCCC(=O)CCO 1458a_100011216618_100000210319 [1,0,1,0,0,0|1,0,0]=3 1766 B14R0.393 CCCCCCCCCCC(=O)COC 1458a_100000210968_100000210319 [1,0,1,0,0,0|1,0,0]=3 1767 B14R0.393 CCCCCCCCCCC(=O)CSC 1458a_100000184570_100000210319 [1,0,1,0,0,0|1,0,0]=3 1768 B14R0.393 CCCCCCCCCCC(=O)NCC 11a_100015525214_100000210375 [1,0,1,0,0,0|1,0,0]=3 1769 B14R0.393 CCCCCCCCCCC(=O)NCC 240690a_100015525214_100000210375 [1,0,1,0,0,0|1,0,0]=3 1770 B14R0.393 CCCCCCCCCCC(=O)NNC 22a_100016993582_100000210375 [1,0,1,0,0,0|2,0,0]=4 1771 B14R0.393 CCCCCCCCCCN(C)CCC 2230a_100000207566_100000210303 [1,0,1,0,0,0|2,0,0]=4 1772 B14R0.393 CCCCCCCCCCN(C)CCC 2230a_100000747261_100000210320 [1,0,1,0,0,0|2,0,0]=4 1773 B14R0.393 CCCCCCCCCCN(C)CCC 269982a_100000207566_100000210303 [1,0,1,0,0,0|2,0,0]=4 1774 B14R0.393 CCCCCCCCCCN(C)CCC 269982a_100000747261_100000210320 [1,0,1,0,0,0|2,0,0]=4 1775 B14R0.393 CCCCCCCCCNC(=O)CCC 11a_100000212291_100000211992 [1,0,1,0,0,0|1,0,0]=3 1776 B14R0.393 CCCCCCCCCNC(=O)CCC 1626a_100000212291_100000211992 [1,0,1,0,0,0|1,0,0]=3 1777 B14R0.393 CCCCCCCCCNC(=O)CCC 240690a_100000212291_100000211992 [1,0,1,0,0,0|1,0,0]=3 1778 B14R0.393 CCCCCCCCCNC(=O)CCC 527a_100000212291_100000211992 [1,0,1,0,0,0|1,0,0]=3 1779 B14R0.393 CCCCCCCCCNC(=O)CCO 240690a_100000212291_100011216618 [1,0,1,0,0,0|2,0,0]=4 1780 B14R0.393 CCCCCCCCCNC(=O)COC 11a_100000212291_100000210968 [1,0,1,0,0,0|2,0,0]=4 1781 B14R0.393 CCCCCCCCCNC(=O)COC 1626a_100000212291_100000210968 [1,0,1,0,0,0|2,0,0]=4 1782 B14R0.393 CCCCCCCCCNC(=O)COC 240690a_100000212291_100000210968 [1,0,1,0,0,0|2,0,0]=4 1783 B14R0.393 CCCCCCCCCNC(=O)COC 527a_100000212291_100000210968 [1,0,1,0,0,0|2,0,0]=4 1784 B14R0.393 CCCCCCCCCNC(=O)CSC 11a_100000212291_100000184570 [1,0,1,0,0,0|2,0,0]=4 1785 B14R0.393 CCCCCCCCCNC(=O)CSC 1626a_100000212291_100000184570 [1,0,1,0,0,0|2,0,0]=4 1786 B14R0.393 CCCCCCCCCNC(=O)CSC 240690a_100000212291_100000184570 [1,0,1,0,0,0|2,0,0]=4 1787 B14R0.393 CCCCCCCCCNC(=O)CSC 527a_100000212291_100000184570 [1,0,1,0,0,0|2,0,0]=4 1788 B14R0.393 CCCCCCCCCNC(=O)NCC 2708a_100000212291_100015525214 [1,0,1,0,0,0|2,0,0]=4 1789 B14R0.393 CCCCCCCCCNC(=O)NCC 2708a_100015525214_100000212291 [1,0,1,0,0,0|2,0,0]=4 1790 B14R0.393 CCCCCCCCCNC(=O)NCC 273464a_100000212291_100015525214 [1,0,1,0,0,0|2,0,0]=4 1791 B14R0.393 CCCCCCCCCNC(=O)NCC 273464a_100015525214_100000212291 [1,0,1,0,0,0|2,0,0]=4 1792 B14R0.393 CCCCCCCCCNC(=O)NCC 512a_100000212291_100015525214 [1,0,1,0,0,0|2,0,0]=4 1793 B14R0.393 CCCCCCCCCNC(=O)NCC 512a_100015525214_100000212291 [1,0,1,0,0,0|2,0,0]=4 1794 B14R0.393 CCCCCCCCCOC(C)CCC 34a_100000210712_100000766640 [1,0,1,0,0,0|1,0,1]=4 1795 B14R0.393 CCCCCCCCCOC(C)CCC 34a_100000764384_100011214924 [1,0,1,0,0,0|1,0,1]=4 1796 B14R0.393 CCCCCCCCCOC(C)CCC 7a_100000210712_100000766640 [1,0,1,0,0,0|1,0,1]=4 1797 B14R0.393 CCCCCCCCCOC(C)CCC 7a_100000764384_100000210328 [1,0,1,0,0,0|1,0,1]=4 1798 B14R0.393 CCCCCCCCNCC(=O)CCC 2230a_100000229939_100000747444 [1,0,1,0,0,0|1,0,0]=3 1799 B14R0.393 CCCCCCCCNCC(=O)NCC 2230a_100000229939_100000183381 [1,0,1,0,0,0|2,0,0]=4 1800 B14R0.393 CCCCCCCCNCC(=O)NCC 2230a_100016988866_100000210759 [1,0,1,0,0,0|2,0,0]=4 1801 B14R0.393 CCCCCCCCNCC(=O)NCC 34a_100000229939_100000183381 [1,0,1,0,0,0|2,0,0]=4 1802 B14R0.393 CCCCCCCCNCC(=O)OCC 2230a_100000229939_100000188475 [1,0,1,0,0,0|2,0,0]=4 1803 B14R0.393 CCCCCCCCNCC(=O)OCC 34a_100000229939_100000188475 [1,0,1,0,0,0|2,0,0]=4 1804 B14R0.393 CCCCCCCCOCC(=O)CCC 1458a_100000759886_100000210303 [1,0,1,0,0,0|1,0,0]=3 1805 B14R0.393 CCCCCCCCOCC(=O)CCC 7a_100000210232_100000747444 [1,0,1,0,0,0|1,0,0]=3 1806 B14R0.393 CCCCCCCCOCC(=O)CCF 1458a_100000759886_100011217306 [1,0,1,0,0,0|2,0,0]=4 1807 B14R0.393 CCCCCCCCOCC(=O)CCO 1458a_100000759886_100000211926 [1,0,1,0,0,0|2,0,0]=4 1808 B14R0.393 CCCCCCCCOCC(=O)NCC 11a_100015525214_100000759886 [1,0,1,0,0,0|2,0,0]=4 1809 B14R0.393 CCCCCCCCOCC(=O)NCC 240690a_100015525214_100000759886 [1,0,1,0,0,0|2,0,0]=4 1810 B14R0.393 CCCCCCCCOCC(=O)NCC 34a_100000210232_100000183381 [1,0,1,0,0,0|2,0,0]=4 1811 B14R0.393 CCCCCCCCOCC(=O)NCC 527a_100015525214_100000759886 [1,0,1,0,0,0|2,0,0]=4 1812 B14R0.393 CCCCCCCCOCC(=O)NCC 7a_100000210232_100000183381 [1,0,1,0,0,0|2,0,0]=4 1813 B14R0.393 CCCCCCCCOCC(=O)OCC 34a_100000210232_100000188475 [1,0,1,0,0,0|2,0,0]=4 1814 B14R0.393 CCCCCCCCOCC(=O)OCC 7a_100000210232_100000188475 [1,0,1,0,0,0|2,0,0]=4 1815 B14R0.393 CCCCCCCCSCC(=O)CCC 62a_100000210759_100000747444 [1,0,1,0,0,0|1,0,0]=3 1816 B14R0.393 CCCCCCCCSCC(=O)CCC 62a_100000747444_100000210317 [1,0,1,0,0,0|1,0,0]=3 1817 B14R0.393 CCCCCCCCSCC(=O)NCC 62a_100000183381_100000210317 [1,0,1,0,0,0|2,0,0]=4 1818 B14R0.393 CCCCCCCCSCC(=O)NCC 62a_100000210759_100000183381 [1,0,1,0,0,0|2,0,0]=4 1819 B14R0.393 CCCCCCCCSCC(=O)OCC 62a_100000188475_100000210317 [1,0,1,0,0,0|2,0,0]=4 1820 B14R0.393 CCCCCCCCSCC(=O)OCC 62a_100000210759_100000188475 [1,0,1,0,0,0|2,0,0]=4 1821 B14R0.393 CCCCCCCNCCC(=O)NCC 2230a_100000229938_100000737597 [1,0,1,0,0,0|2,0,0]=4 1822 B14R0.393 CCCCCCCNCCC(=O)NCC 34a_100025743525_100000210614 [1,0,1,0,0,0|2,0,0]=4 1823 B14R0.393 CCCCCCCNCCC(=O)OCC 2230a_100000229938_100011206558 [1,0,1,0,0,0|2,0,0]=4 1824 B14R0.393 CCCCCCCNCOC(=O)CCC 2230a_100000229938_100000034017 [1,0,1,0,0,0|1,0,0]=3 1825 B14R0.393 CCCCCCCOCCC(=O)NCC 7a_100000210272_100000737597 [1,0,1,0,0,0|2,0,0]=4 1826 B14R0.393 CCCCCCCOCCC(=O)OCC 34a_100000210272_100000765890 [1,0,1,0,0,0|2,0,0]=4 1827 B14R0.393 CCCCCCCOCCC(=O)OCC 7a_100000210272_100011206558 [1,0,1,0,0,0|2,0,0]=4 1828 B14R0.393 CCCCCCCOCOC(=O)CCC 34a_100000210272_100000034017 [1,0,1,0,0,0|1,0,0]=3 1829 B14R0.393 CCCCCCCSCCC(=O)NCC 62a_100000210614_100000737597 [1,0,1,0,0,0|2,0,0]=4 1830 B14R0.393 CCCCCCCSCCC(=O)NCC 62a_100000737597_100000210316 [1,0,1,0,0,0|2,0,0]=4 1831 B14R0.393 CCCCCCCSCCC(=O)OCC 62a_100000210614_100000765890 [1,0,1,0,0,0|2,0,0]=4 1832 B14R0.393 CCCCCCCSCCC(=O)OCC 62a_100000765890_100000210316 [1,0,1,0,0,0|2,0,0]=4 1833 B14R0.393 CCCCCCCSCOC(=O)CCC 62a_100000210614_100000034017 [1,0,1,0,0,0|1,0,0]=3 1834 B14R0.393 CCCCCCCSCOC(=O)OCC 62a_100000210614_100000075025 [1,0,1,0,0,0|2,0,0]=4 1835 B14R0.393 CCCCCCNCCCC(=O)OCC 2230a_100000210581_100009991533 [1,0,1,0,0,0|2,0,0]=4 1836 B14R0.393 CCCCCCOCCCC(=O)OCC 34a_100000210259_100009991533 [1,0,1,0,0,0|2,0,0]=4 1837 B14R0.393 CCCCCCOCCCC(=O)OCC 7a_100000210259_100011215271 [1,0,1,0,0,0|2,0,0]=4 1838 B14R0.393 CCCCCCOCCCC(=O)OCC 7a_100012001163_100000210314 [1,0,1,0,0,0|2,0,0]=4 1839 B14R0.393 CCCCCCSCCCC(=O)OCC 62a_100000210314_100009991533 [1,0,1,0,0,0|2,0,0]=4 1840 B14R0.393 CCCCCCSCCCC(=O)OCC 62a_100009991533_100000210757 [1,0,1,0,0,0|2,0,0]=4 1841 B14R0.393 CCCCCNCCCCC(=O)OCC 2230a_100000209983_100000750268 [1,0,1,0,0,0|2,0,0]=4 1842 B14R0.393 CCCCCOCCCCC(=O)OCC 34a_100000210253_100000750268 [1,0,1,0,0,0|2,0,0]=4 1843 B14R0.393 CCCCCOCCCCC(=O)OCC 7a_100000210253_100000750268 [1,0,1,0,0,0|2,0,0]=4 1844 B14R0.393 CCCCCOCCOCC(=O)CCC 7a_100011215259_100000747444 [1,0,1,0,0,0|2,0,0]=4 1845 B14R0.393 CCCCCSCCCCC(=O)OCC 62a_100000210326_100000750268 [1,0,1,0,0,0|2,0,0]=4 1846 B14R0.393 CCCCCSCCCCC(=O)OCC 62a_100000750268_100000210326 [1,0,1,0,0,0|2,0,0]=4 1847 B14R0.393 CCCCNCCCCCC(=O)OCC 2230a_100000102301_100000755133 [1,0,1,0,0,0|2,0,0]=4 1848 B14R0.393 CCCCNCCCCCC(=O)OCC 7a_106832991798_100000755133 [1,0,1,0,0,0|2,0,0]=4 1849 B14R0.393 CCCCOCCCCCC(=O)OCC 34a_100000210227_100000755133 [1,0,1,0,0,0|2,0,0]=4 1850 B14R0.393 CCCCOCCCCCC(=O)OCC 7a_100000210227_100000755133 [1,0,1,0,0,0|2,0,0]=4 1851 B14R0.393 CCCCOCCCCCC(=O)OCC 7a_100011214988_100000210211 [1,0,1,0,0,0|2,0,0]=4 1852 B14R0.393 CCCCOCCCNCC(=O)CCC 2230a_200000211371_100000747444 [1,0,1,0,0,0|2,0,0]=4 1853 B14R0.393 CCCCOCCCOCC(=O)CCC 7a_200011215613_100000747444 [1,0,1,0,0,0|2,0,0]=4 1854 B14R0.393 CCCCOCCOCOC(=O)CCC 34a_100000210238_100000034017 [1,0,1,0,0,0|2,0,0]=4 1855 B14R0.393 CCCCOCCSCOC(=O)CCC 62a_100000743108_100000034017 [1,0,1,0,0,0|2,0,0]=4 1856 B14R0.393 CCCCSCCCCCC(=O)OCC 62a_100000210211_100000755133 [1,0,1,0,0,0|2,0,0]=4 1857 B14R0.393 CCCCSCCCCCC(=O)OCC 62a_100000755133_100000210210 [1,0,1,0,0,0|2,0,0]=4 1858 B14R0.393 CCCCSCCNCOC(=O)CCC 2230a_100025743550_100000034017 [1,0,1,0,0,0|2,0,0]=4 1859 B14R0.393 CCCCSCCOCOC(=O)CCC 34a_200000230436_100000034017 [1,0,1,0,0,0|2,0,0]=4 1860 B14R0.393 CCCOCCCCCCC(=O)OCC 34a_100000210258_100009814379 [1,0,1,0,0,0|2,0,0]=4 1861 B14R0.393 CCCOCCCNCOC(=O)CCC 2230a_100011217757_100000034017 [1,0,1,0,0,0|2,0,0]=4 1862 B14R0.393 CCCOCCCNCOC(=O)CCC 34a_100011217757_100000034017 [1,0,1,0,0,0|2,0,0]=4 1863 B14R0.393 CCCSCCCCCCC(=O)OCC 62a_100000210303_100009814379 [1,0,1,0,0,0|2,0,0]=4 1864 B14R0.393 CCNC(=O)CCCCCCCCCF 11a_100015525214_200009909015 [1,0,1,0,0,0|2,0,0]=4 1865 B14R0.393 CCNC(=O)CCCCCCCCCF 240690a_100015525214_200009909015 [1,0,1,0,0,0|2,0,0]=4 1866 B14R0.393 CCNC(=O)CCCCCCCCCF 527a_100015525214_200009909015 [1,0,1,0,0,0|2,0,0]=4 1867 B14R0.393 CCNC(=O)CCCCCCCCCO 240690a_100015525214_100000032657 [1,0,1,0,0,0|2,0,0]=4 1868 B14R0.393 CCNCCCCCCCC(=O)OCC 2230a_100015525214_100009991516 [1,0,1,0,0,0|2,0,0]=4 1869 B14R0.393 CCOC(=O)CCCCCCCCNC 2230a_106832991635_100010175975 [1,0,1,0,0,0|2,0,0]=4 1870 B14R0.393 CCOC(=O)CCCCCCCCNC 34a_100102657272_100010175975 [1,0,1,0,0,0|2,0,0]=4 1871 B14R0.393 CCOC(=O)CCCCCCCCNC 7a_106832991635_100010175975 [1,0,1,0,0,0|2,0,0]=4 1872 B14R0.393 CCOC(=O)CCCCCCCCOC 34a_100138415774_100010175975 [1,0,1,0,0,0|2,0,0]=4 1873 B14R0.393 CCOC(=O)CCCCCCCCSC 62a_200000210301_100010175975 [1,0,1,0,0,0|2,0,0]=4 1874 B14R0.393 CCOC(=O)CCCCCCCCS[13CH3] 62a_200025704644_100010175975 [1,0,1,0,0,0|2,0,0]=4 1875 B14R0.393 CCOC(=O)CCCCCCCSCC 62a_100000210202_100009991516 [1,0,1,0,0,0|2,0,0]=4 1876 B14R0.393 CCOCCCCCCCC(=O)OCC 34a_100121572206_100009991516 [1,0,1,0,0,0|2,0,0]=4 1877 B14R0.393 COCC(=O)CCCCCCCCCO 1458a_100000210968_100009813782 [1,0,1,0,0,0|2,0,0]=4 1878 B14R0.393 CSCC(=O)CCCCCCCCCO 1458a_100000184570_100009813782 [1,0,1,0,0,0|2,0,0]=4 1879 B14R0.393 O=C(CCF)CCCCCCCCCF 1458a_200009909015_100011217306 [1,0,1,0,0,0|2,0,0]=4 1880 B14R0.393 O=C(CCO)CCCCCCCCCF 1458a_200009909015_100000211926 [1,0,1,0,0,0|2,0,0]=4 1881 B14R0.393 O=C(CCO)CCCCCCCCCO 1458a_100011216618_100009813782 [1,0,1,0,0,0|2,0,0]=4 1882 B14R0.90 C=CC(CCC)OCCCCCCCC 34a_100011216692_100000210759 [1,0,1,0,0,0|2,0,0]=4 1883 B14R0.90 C=CC(CCC)OCCCCCCCC 7a_100011216692_100000210759 [1,0,1,0,0,0|2,0,0]=4 1884 B14R0.90 CCCCCCCNCC(CC)OCC 2230a_100015183923_100000210681 [1,0,1,0,0,0|1,0,1]=4 1885 B14R0.90 CCCCCCCNCC(CC)OCC 34a_100015183923_100000210614 [1,0,1,0,0,0|1,0,1]=4 1886 B14R0.391 CC(=O)OC(C)SCCCCCCCO 62a_100000760002_100009818208 [1,0,1,0,0,0|2,0,0]=4 1887 B14R0.391 CC(=O)OC(C)SCCCCCCCO 62a_100009818208_100000760002 [1,0,1,0,0,0|2,0,0]=4 1888 B14R0.391 CCCCCCCCCC(C)OC(C)C 34a_100011218016_100000210206 [1,0,1,0,0,0|1,0,1]=4 1889 B14R0.391 CCCCCCCCCC(C)OC(C)C 7a_100011218016_100000210206 [1,0,1,0,0,0|1,0,1]=4 1890 B14R0.391 CCCCCCCCSC(C)OC(=O)C 62a_100000210759_100009818208 [1,0,1,0,0,0|1,0,0]=3 1891 B14R0.391 CCCCCCCCSC(C)OC(=O)C 62a_100009818208_100000210317 [1,0,1,0,0,0|1,0,0]=3 1892 B14R0.391 COCCCCCCSC(C)OC(=O)C 62a_100009818208_100011998445 [1,0,1,0,0,0|2,0,0]=4 1893 B14R0.391 COCCCCCCSC(C)OC(=O)C 62a_100011998445_100009818208 [1,0,1,0,0,0|2,0,0]=4 1894 B14R0.489 CCCCCCCCC(CC)OC(C)C 34a_200011216270_100000210206 [1,0,1,0,0,0|1,0,1]=4 1895 B14R0.489 CCCCCCCCC(CC)OC(C)C 7a_200011216270_100000210206 [1,0,1,0,0,0|1,0,1]=4 1896 B14R0.492 CCCCCCCCC(CCC)OCC 34a_200011218034_100000210202 [1,0,1,0,0,0|1,0,1]=4 1897 B14R0.492 CCCCCCCCC(CCC)OCC 7a_200011218034_100000210202 [1,0,1,0,0,0|1,0,1]=4 1898 B14R0.492 CCCCCCCCC(CCC)OCF 34a_200011218034_100015361967 [1,0,1,0,0,0|1,0,1]=4 1899 B14R0.492 CCCCCCCCC(CCC)OCF 7a_200011218034_100015361967 [1,0,1,0,0,0|1,0,1]=4 1900 B14R0.82 CCCCCCCCC(C)OC(C)CC 34a_100000210740_100011215416 [1,0,1,0,0,0|1,0,1]=4 1901 B14R0.82 CCCCCCCCC(C)OC(C)CC 7a_100000210740_100000758301 [1,0,1,0,0,0|1,0,1]=4 1902 B14R0.82 CCCCCCCCN(C)CC(=O)CC 269982a_100000207567_100000747405 [1,0,1,0,0,0|2,0,0]=4 1903 B14R1.123 CCCCCCCNC1C=CCCC1 2230a_100000229938_100000751183 [2,0,0,0,0,0|2,0,0]=4 1904 B14R1.123 CCCCCCCOC1C=CCCC1 34a_100011215024_100000210614 [2,0,0,0,0,0|2,0,0]=4 1905 B14R1.123 CCCCCCCOC1C=CCCC1 7a_100000210272_100000751183 [2,0,0,0,0,0|2,0,0]=4 1906 B14R1.123 CCCCCCCOC1CCCCO1 34a_100000033831_100000210614 [2,0,0,0,0,0|1,0,1]=4 1907 B14R1.123 CCCCCCCSC1C=CCCC1 62a_100000210614_100000751183 [2,0,0,0,0,0|2,0,0]=4 1908 B14R1.123 CCCCCCCSC1C=CCCC1 62a_100000751183_100000210316 [2,0,0,0,0,0|2,0,0]=4 1909 B14R1.123 CCCCCCNCC1CCCCO1 2230a_100000174945_100000210314 [2,0,0,0,0,0|1,0,1]=4 1910 B14R1.123 CCCCCCNCC1CCCCO1 2230a_100000210581_100000211543 [2,0,0,0,0,0|1,0,1]=4 1911 B14R1.123 CCCCCCNCC1CCCCO1 34a_100000174945_100000210314 [2,0,0,0,0,0|1,0,1]=4 1912 B14R1.123 CCCCCCOCC1CCC=CO1 34a_100011217868_100000210314 [2,0,0,0,0,0|1,0,1]=4 1913 B14R1.123 CCCCCCOCC1CCCCO1 34a_100000210259_100000211543 [2,0,0,0,0,0|1,0,1]=4 1914 B14R1.123 CCCCCCOCC1CCCCO1 34a_100000211370_100000210314 [2,0,0,0,0,0|1,0,1]=4 1915 B14R1.123 CCCCCCOCC1CCCCO1 7a_100000210259_100000211543 [2,0,0,0,0,0|1,0,1]=4 1916 B14R1.123 CCCCCCOCC1CCCCO1 7a_100000211370_100000210314 [2,0,0,0,0,0|1,0,1]=4 1917 B14R1.123 CCCCCCSCC1CCCCO1 62a_100000210314_100000211543 [2,0,0,0,0,0|1,0,1]=4 1918 B14R1.123 CCCCCCSCC1CCCCO1 62a_100000211543_100000210757 [2,0,0,0,0,0|1,0,1]=4 1919 B14R1.123 CCCCCNCCC1CCCCO1 2230a_100015183643_100000210326 [2,0,0,0,0,0|1,0,1]=4 1920 B14R1.123 CCCCCNCCC1CCCCO1 34a_100015183643_100000718602 [2,0,0,0,0,0|1,0,1]=4 1921 B14R1.26 CCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210314 [2,0,0,0,0,0|2,0,0]=4 1922 B14R1.26 CCCCCOCC1CCCC(=O)N1 34a_200000102386_100000718602 [2,0,0,0,0,0|2,0,0]=4 1923 B16R0.41 CCCC(C)CCCOCCCCCC(=O)N 34a_100011713154_100009817443 [0,1,1,0,0,0|2,0,0]=4 1924 B16R0.41 CCCC(C)CCCOCCCCCC(=O)N 7a_100011713154_100009817443 [0,1,1,0,0,0|2,0,0]=4 1925 B16R0.114 CCCCCCCC(=O)CCCCCC(=O)N 1458a_100000211969_100009817443 [0,1,1,0,0,0|1,0,1]=4 1926 B16R0.114 CCCCCCCC(C)NCCCCC(=O)N 270004a_100000696515_100000210596 [0,1,1,0,0,0|2,0,0]=4 1927 B16R0.114 CCCCCCCC(C)NCCCCC(=O)N 34a_100000696515_200011218727 [0,1,1,0,0,0|2,0,0]=4 1928 B16R0.114 CCCCCCCC(C)NCCOCC(=O)O 269956a_100000700818_200011218727 [0,1,1,0,0,0|2,0,0]=4 1929 B16R0.114 CCCCCCCC(C)OCCCCC(=O)C 34a_200011215852_100009817362 [0,1,1,0,0,0|2,0,0]=4 1930 B16R0.114 CCCCCCCC(C)OCCCCC(=O)C 7a_200011215852_100000735457 [0,1,1,0,0,0|2,0,0]=4 1931 B16R0.114 CCCCCCCC(C)OCCCCC(=O)N 34a_100012022536_200011218727 [0,1,1,0,0,0|2,0,0]=4 1932 B16R0.114 CCCCCCCC(C)OCCCCC(=O)N 7a_100012022536_200011218727 [0,1,1,0,0,0|2,0,0]=4 1933 B16R0.114 CCCCCCCC(C)SCCCCC(=O)C 62a_100000735457_200011218727 [0,1,1,0,0,0|2,0,0]=4 1934 B16R0.114 CCCCCCCC(C)SCCCCC(=O)C 62a_200011218727_100000735457 [0,1,1,0,0,0|2,0,0]=4 1935 B16R0.114 CCCCCCCN(C)CCCCCC(=O)N 2230a_100000228206_100009817443 [0,1,1,0,0,0|2,0,0]=4 1936 B16R0.114 CCCCCCCN(C)CCCCCC(=O)N 269982a_100000228206_100009817443 [0,1,1,0,0,0|2,0,0]=4 1937 B16R0.131 CCCCC(C)CCCCOCCCC(=O)C 34a_200011021034_100000685027 [0,1,1,0,0,0|2,0,0]=4 1938 B16R0.131 CCCCC(C)CCCCOCCCC(=O)C 7a_200011021034_100011215641 [0,1,1,0,0,0|2,0,0]=4 1939 B16R0.131 CCCCC(C)CCCCOCCCC(=O)N 34a_200011021034_100102525003 [0,1,1,0,0,0|2,0,0]=4 1940 B16R0.131 CCCCC(C)CCCCOCCCC(=O)N 7a_200011021034_100102525003 [0,1,1,0,0,0|2,0,0]=4 1941 B16R0.165 CCC(=O)CCCCCCCCCCC(=O)N 1458a_100000210414_200010167045 [0,1,1,0,0,0|1,0,1]=4 1942 B16R0.165 CCC(C)CCCCCOCCCCC(=O)C 7a_200000035636_100000735457 [0,1,1,0,0,0|2,0,0]=4 1943 B16R0.165 CCN(C)CCCCCCCCCCC(=O)N 2230a_100000225621_200010167045 [0,1,1,0,0,0|2,0,0]=4 1944 B16R0.165 CCN(C)CCCCCCCCCCC(=O)N 269982a_100000225621_200010167045 [0,1,1,0,0,0|2,0,0]=4 1945 B16R0.177 CCCCCCC(C)CCOCCCC(=O)C 34a_200011024964_100000685027 [0,1,1,0,0,0|2,0,0]=4 1946 B16R0.177 CCCCCCC(C)CCOCCCC(=O)C 7a_200011024964_100011215641 [0,1,1,0,0,0|2,0,0]=4 1947 B16R0.177 CCCCCCC(C)CCOCCCC(=O)N 34a_200011024964_100102525003 [0,1,1,0,0,0|2,0,0]=4 1948 B16R0.177 CCCCCCC(C)CCOCCCC(=O)N 7a_200011024964_100102525003 [0,1,1,0,0,0|2,0,0]=4 1949 B16R0.177 CCCCCCC(C)NCCCCCC(=O)N 2230a_100000210919_100009817443 [0,1,1,0,0,0|2,0,0]=4 1950 B16R0.177 CCCCCCC(C)NCCCCCC(=O)N 34a_100000210919_100009817443 [0,1,1,0,0,0|2,0,0]=4 1951 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 34a_100000123541_100011215978 [0,1,1,0,0,0|2,0,0]=4 1952 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 34a_100000210265_100009817443 [0,1,1,0,0,0|2,0,0]=4 1953 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 7a_100000123541_100011215978 [0,1,1,0,0,0|2,0,0]=4 1954 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 7a_100000210265_100009817443 [0,1,1,0,0,0|2,0,0]=4 1955 B16R0.177 CCCCCCC(C)OCCCCCC(=O)[O-] 7a_100102619762_100011215978 [0,1,1,0,0,0|1,0,1]=4 1956 B16R0.177 CCCCCCC(C)SCCCCCC(=O)N 62a_100009817443_100011215978 [0,1,1,0,0,0|2,0,0]=4 1957 B16R0.177 CCCCCCC(C)SCCCCCC(=O)N 62a_100011215978_100009817443 [0,1,1,0,0,0|2,0,0]=4 1958 B16R0.221 C#CC(=O)CCCCCCCCCCCCC 1458a_100000211873_100000210684 [0,1,1,0,0,0|1,0,0]=3 1959 B16R0.221 C#CC(=O)CCCCCCCCCCCCO 1458a_100000211873_100009813331 [0,1,1,0,0,0|2,0,0]=4 1960 B16R0.221 C=CC(=O)CCCCCCCCCCCCC 1458a_100000185746_100000210684 [0,1,1,0,0,0|1,0,0]=3 1961 B16R0.221 C=CC(=O)CCCCCCCCCCCCO 1458a_100000185746_100009813331 [0,1,1,0,0,0|2,0,0]=4 1962 B16R0.221 C=CC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000185746 [0,1,1,0,0,0|2,0,0]=4 1963 B16R0.221 C=CC(=O)NCCCCCCCCCCCC 240690a_100000210451_200121576911 [0,1,1,0,0,0|2,0,0]=4 1964 B16R0.221 C=CCCCCCCCCCCCC(=O)CO 1458a_100000210174_102130925996 [0,1,1,0,0,0|0,0,2]=4 1965 B16R0.221 CCC(=O)CCCCCCCCCCCCO 1458a_100000210414_100009813331 [0,1,1,0,0,0|2,0,0]=4 1966 B16R0.221 CCCCCCCCCCCCCC(=O)CC 1458a_100000210414_100000210684 [0,1,1,0,0,0|1,0,0]=3 1967 B16R0.221 CCCCCCCCCCCCCC(=O)CC 1458a_100000756256_100000210202 [0,1,1,0,0,0|1,0,0]=3 1968 B16R0.221 CCCCCCCCCCCCCC(=O)CF 1458a_100000756256_100015361967 [0,1,1,0,0,0|1,0,0]=3 1969 B16R0.221 CCCCCCCCCCCCCC(=O)CO 1458a_100000210174_100000210684 [0,1,1,0,0,0|0,0,0]=2 1970 B16R0.221 CCCCCCCCCCCCCC(=O)NC 11a_106832991635_100000756256 [0,1,1,0,0,0|1,0,0]=3 1971 B16R0.221 CCCCCCCCCCCCCC(=O)NC 1626a_100102657272_100000756256 [0,1,1,0,0,0|1,0,0]=3 1972 B16R0.221 CCCCCCCCCCCCCC(=O)NC 240690a_100102657272_100000756256 [0,1,1,0,0,0|1,0,0]=3 1973 B16R0.221 CCCCCCCCCCCCNC(=O)CC 11a_100000210451_100000210414 [0,1,1,0,0,0|2,0,0]=4 1974 B16R0.221 CCCCCCCCCCCCNC(=O)CC 1626a_100000210451_100000210414 [0,1,1,0,0,0|2,0,0]=4 1975 B16R0.221 CCCCCCCCCCCCNC(=O)CC 240690a_100000210451_100000210414 [0,1,1,0,0,0|2,0,0]=4 1976 B16R0.221 CCCCCCCCCCCCNC(=O)CC 527a_100000210451_100000210414 [0,1,1,0,0,0|2,0,0]=4 1977 B16R0.221 CCCCCCCCCCCCNC(=O)CO 240690a_100000210451_100000210174 [0,1,1,0,0,0|1,0,0]=3 1978 B16R0.221 CCCCCCCCCCCCNC(=O)CO 527a_100000210451_100000210174 [0,1,1,0,0,0|1,0,0]=3 1979 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100000210451_106832991635 [0,1,1,0,0,0|2,0,0]=4 1980 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100102657272_100000210451 [0,1,1,0,0,0|2,0,0]=4 1981 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100000210451_100102657272 [0,1,1,0,0,0|2,0,0]=4 1982 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100102657272_100000210451 [0,1,1,0,0,0|2,0,0]=4 1983 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_100000210451_100102657272 [0,1,1,0,0,0|2,0,0]=4 1984 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_106832991638_100000210451 [0,1,1,0,0,0|2,0,0]=4 1985 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_100000693194_100011215454 [0,1,1,0,0,0|2,0,0]=4 1986 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_200011215754_100000183359 [0,1,1,0,0,0|2,0,0]=4 1987 B16R0.221 CCCCCCCCCCCNCC(=O)NC 34a_200011215754_100000183359 [0,1,1,0,0,0|2,0,0]=4 1988 B16R0.221 CCCCCCCCCCCNCC(=O)OC 2230a_200011215754_100000747449 [0,1,1,0,0,0|1,0,0]=3 1989 B16R0.221 CCCCCCCCCCCNCC(=O)OC 34a_200011215754_100000747449 [0,1,1,0,0,0|1,0,0]=3 1990 B16R0.221 CCCCCCCCCCCOCC(=O)CC 34a_100000725409_100011215454 [0,1,1,0,0,0|2,0,0]=4 1991 B16R0.221 CCCCCCCCCCCOCC(=O)CC 7a_100000210809_100000747405 [0,1,1,0,0,0|2,0,0]=4 1992 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000210809_100000183359 [0,1,1,0,0,0|2,0,0]=4 1993 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000750040_100011215454 [0,1,1,0,0,0|2,0,0]=4 1994 B16R0.221 CCCCCCCCCCCOCC(=O)NC 7a_100000210809_100000183359 [0,1,1,0,0,0|2,0,0]=4 1995 B16R0.221 CCCCCCCCCCCOCC(=O)OC 34a_100000210809_100000747449 [0,1,1,0,0,0|1,0,0]=3 1996 B16R0.221 CCCCCCCCCCCOCC(=O)OC 7a_100000210809_100000747449 [0,1,1,0,0,0|1,0,0]=3 1997 B16R0.221 CCCCCCCCCCCSCC(=O)CC 62a_100000747405_100011215454 [0,1,1,0,0,0|2,0,0]=4 1998 B16R0.221 CCCCCCCCCCCSCC(=O)NC 62a_100000183359_100011215454 [0,1,1,0,0,0|2,0,0]=4 1999 B16R0.221 CCCCCCCCCCCSCC(=O)OC 62a_100000747449_100011215454 [0,1,1,0,0,0|1,0,0]=3 2000 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000684558_100000737683 [0,1,1,0,0,0|2,0,0]=4 2001 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100000210320 [0,1,1,0,0,0|2,0,0]=4 2002 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000684558_100012179268 [0,1,1,0,0,0|2,0,0]=4 2003 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000738227_100000210320 [0,1,1,0,0,0|2,0,0]=4 2004 B16R0.221 CCCCCCCCCCNCCC(=O)OC 2230a_100000684558_100000204255 [0,1,1,0,0,0|1,0,0]=3 2005 B16R0.221 CCCCCCCCCCNCCC(=O)OC 34a_100000684558_100000742370 [0,1,1,0,0,0|1,0,0]=3 2006 B16R0.221 CCCCCCCCCCOCCC(=NO)N 34a_100000749954_100000210320 [0,1,1,0,0,0|2,0,0]=4 2007 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000210711_100012179268 [0,1,1,0,0,0|2,0,0]=4 2008 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000754576_100000210320 [0,1,1,0,0,0|2,0,0]=4 2009 B16R0.221 CCCCCCCCCCOCCC(=O)NC 7a_100000210711_100000737683 [0,1,1,0,0,0|2,0,0]=4 2010 B16R0.221 CCCCCCCCCCOCCC(=O)OC 34a_100000210711_100000742370 [0,1,1,0,0,0|1,0,0]=3 2011 B16R0.221 CCCCCCCCCCOCCC(=O)OC 7a_100000210711_100000204255 [0,1,1,0,0,0|1,0,0]=3 2012 B16R0.221 CCCCCCCCCCSCCC(=O)NC 62a_100000737683_100000210320 [0,1,1,0,0,0|2,0,0]=4 2013 B16R0.221 CCCCCCCCCCSCCC(=O)OC 62a_100000204255_100000210320 [0,1,1,0,0,0|1,0,0]=3 2014 B16R0.221 CCCCCCCCCNCCCC(=O)NC 2230a_100000212291_100000741757 [0,1,1,0,0,0|2,0,0]=4 2015 B16R0.221 CCCCCCCCCNCCCC(=O)NC 2230a_100000740002_100011214924 [0,1,1,0,0,0|2,0,0]=4 2016 B16R0.221 CCCCCCCCCNCCCC(=O)NC 34a_100000212291_100000741757 [0,1,1,0,0,0|2,0,0]=4 2017 B16R0.221 CCCCCCCCCNCCCC(=O)NC 34a_100000740002_100011214924 [0,1,1,0,0,0|2,0,0]=4 2018 B16R0.221 CCCCCCCCCNCCCC(=O)OC 2230a_100000212291_100011218270 [0,1,1,0,0,0|1,0,0]=3 2019 B16R0.221 CCCCCCCCCNCCCC(=O)OC 34a_100000212291_100000742333 [0,1,1,0,0,0|1,0,0]=3 2020 B16R0.221 CCCCCCCCCOCCCC(=O)NC 34a_100000210712_100000741757 [0,1,1,0,0,0|2,0,0]=4 2021 B16R0.221 CCCCCCCCCOCCCC(=O)NC 7a_100000210712_100000741757 [0,1,1,0,0,0|2,0,0]=4 2022 B16R0.221 CCCCCCCCCOCCCC(=O)NN 34a_100000211488_100011214924 [0,1,1,0,0,0|2,0,0]=4 2023 B16R0.221 CCCCCCCCCOCCCC(=O)OC 34a_100000210712_100000742333 [0,1,1,0,0,0|1,0,0]=3 2024 B16R0.221 CCCCCCCCCOCCCC(=O)OC 7a_100000210712_100011218270 [0,1,1,0,0,0|1,0,0]=3 2025 B16R0.221 CCCCCCCCCOCCNC(=O)OC 34a_100000757965_100011214924 [0,1,1,0,0,0|2,0,0]=4 2026 B16R0.221 CCCCCCCCCOCCOC(=O)OC 34a_100010262106_100011214924 [0,1,1,0,0,0|2,0,0]=4 2027 B16R0.221 CCCCCCCCCSCCCC(=O)NC 62a_100000741757_100000210670 [0,1,1,0,0,0|2,0,0]=4 2028 B16R0.221 CCCCCCCCCSCCCC(=O)OC 62a_100011218270_100000210670 [0,1,1,0,0,0|1,0,0]=3 2029 B16R0.221 CCCCCCCCNCCCCC(=O)OC 2230a_100000229939_100000204269 [0,1,1,0,0,0|1,0,0]=3 2030 B16R0.221 CCCCCCCCNCCCCC(=O)OC 34a_100000229939_100000204269 [0,1,1,0,0,0|1,0,0]=3 2031 B16R0.221 CCCCCCCCNCCOCC(=O)OC 2230a_100000229939_100000090808 [0,1,1,0,0,0|2,0,0]=4 2032 B16R0.221 CCCCCCCCNCCOCC(=O)OC 34a_100000229939_100000090808 [0,1,1,0,0,0|2,0,0]=4 2033 B16R0.221 CCCCCCCCOCCCCC(=O)OC 34a_100000059025_100000210759 [0,1,1,0,0,0|1,0,0]=3 2034 B16R0.221 CCCCCCCCOCCCCC(=O)OC 34a_100000210232_100000204269 [0,1,1,0,0,0|1,0,0]=3 2035 B16R0.221 CCCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210759 [0,1,1,0,0,0|1,0,0]=3 2036 B16R0.221 CCCCCCCCOCCCCC(=O)OC 7a_100000210232_100000204269 [0,1,1,0,0,0|1,0,0]=3 2037 B16R0.221 CCCCCCCCOCCOCC(=O)OC 34a_100000210232_100000090808 [0,1,1,0,0,0|2,0,0]=4 2038 B16R0.221 CCCCCCCCOCCOCC(=O)OC 7a_100000210232_100000090808 [0,1,1,0,0,0|2,0,0]=4 2039 B16R0.221 CCCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210317 [0,1,1,0,0,0|1,0,0]=3 2040 B16R0.221 CCCCCCCCSCCCCC(=O)OC 62a_100000210759_100000204269 [0,1,1,0,0,0|1,0,0]=3 2041 B16R0.221 CCCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210317 [0,1,1,0,0,0|2,0,0]=4 2042 B16R0.221 CCCCCCCCSCCOCC(=O)OC 62a_100000210759_100000090808 [0,1,1,0,0,0|2,0,0]=4 2043 B16R0.221 CCCCCCCNCCCCCC(=O)OC 2230a_100000229938_100009816466 [0,1,1,0,0,0|1,0,0]=3 2044 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000074720_100000210614 [0,1,1,0,0,0|1,0,0]=3 2045 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000210272_100009816466 [0,1,1,0,0,0|1,0,0]=3 2046 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210614 [0,1,1,0,0,0|1,0,0]=3 2047 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000210272_100009816466 [0,1,1,0,0,0|1,0,0]=3 2048 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100000210614_100009816466 [0,1,1,0,0,0|1,0,0]=3 2049 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210316 [0,1,1,0,0,0|1,0,0]=3 2050 B16R0.221 CCCCCCNCCCCCCC(=O)OC 2230a_100000210581_100009815986 [0,1,1,0,0,0|1,0,0]=3 2051 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100000210259_100009815986 [0,1,1,0,0,0|1,0,0]=3 2052 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000210314 [0,1,1,0,0,0|1,0,0]=3 2053 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100000210259_100009815986 [0,1,1,0,0,0|1,0,0]=3 2054 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210314 [0,1,1,0,0,0|1,0,0]=3 2055 B16R0.221 CCCCCCOCCOCCCC(=O)OC 34a_100000691444_100000742333 [0,1,1,0,0,0|2,0,0]=4 2056 B16R0.221 CCCCCCOCCOCCCC(=O)OC 7a_100000691444_100011218270 [0,1,1,0,0,0|2,0,0]=4 2057 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100000210314_100009815986 [0,1,1,0,0,0|1,0,0]=3 2058 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210757 [0,1,1,0,0,0|1,0,0]=3 2059 B16R0.221 CCCCCNCCCCCCCC(=O)OC 2230a_100000209983_100010004213 [0,1,1,0,0,0|1,0,0]=3 2060 B16R0.221 CCCCCNCCOCCCCC(=O)OC 34a_100000224656_100000204269 [0,1,1,0,0,0|2,0,0]=4 2061 B16R0.221 CCCCCOCCCCCCCC(=O)OC 34a_100000210253_100010004213 [0,1,1,0,0,0|1,0,0]=3 2062 B16R0.221 CCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000718602 [0,1,1,0,0,0|1,0,0]=3 2063 B16R0.221 CCCCCOCCCCCCCC(=O)OC 7a_100000210253_100010004213 [0,1,1,0,0,0|1,0,0]=3 2064 B16R0.221 CCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210326 [0,1,1,0,0,0|1,0,0]=3 2065 B16R0.221 CCCCCOCCOCCCCC(=O)OC 34a_100011215259_100000204269 [0,1,1,0,0,0|2,0,0]=4 2066 B16R0.221 CCCCCOCCOCCCCC(=O)OC 7a_100011215259_100000204269 [0,1,1,0,0,0|2,0,0]=4 2067 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100000210326_100010004213 [0,1,1,0,0,0|1,0,0]=3 2068 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210326 [0,1,1,0,0,0|1,0,0]=3 2069 B16R0.221 CCCCNCCCCCCCCC(=O)OC 2230a_100000102301_100010282707 [0,1,1,0,0,0|1,0,0]=3 2070 B16R0.221 CCCCNCCCCCCCCC(=O)OC 7a_106832991798_100010282707 [0,1,1,0,0,0|1,0,0]=3 2071 B16R0.221 CCCCNCCCCOCCCC(=O)OC 34a_200011216965_100000742333 [0,1,1,0,0,0|2,0,0]=4 2072 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210210 [0,1,1,0,0,0|1,0,0]=3 2073 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000210227_100010282707 [0,1,1,0,0,0|1,0,0]=3 2074 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210211 [0,1,1,0,0,0|1,0,0]=3 2075 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000210227_100010282707 [0,1,1,0,0,0|1,0,0]=3 2076 B16R0.221 CCCCOCCCCOCCCC(=O)OC 34a_200000760531_100000742333 [0,1,1,0,0,0|2,0,0]=4 2077 B16R0.221 CCCCOCCCCOCCCC(=O)OC 7a_200000760531_100011218270 [0,1,1,0,0,0|2,0,0]=4 2078 B16R0.221 CCCCOCCCNCCCCC(=O)OC 2230a_200000211371_100000204269 [0,1,1,0,0,0|2,0,0]=4 2079 B16R0.221 CCCCOCCCNCCCCC(=O)OC 34a_200000211371_100000204269 [0,1,1,0,0,0|2,0,0]=4 2080 B16R0.221 CCCCOCCCOCCCCC(=O)OC 34a_200011215613_100000204269 [0,1,1,0,0,0|2,0,0]=4 2081 B16R0.221 CCCCOCCCOCCCCC(=O)OC 7a_200011215613_100000204269 [0,1,1,0,0,0|2,0,0]=4 2082 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000074720_100000743108 [0,1,1,0,0,0|2,0,0]=4 2083 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000210238_100009816466 [0,1,1,0,0,0|2,0,0]=4 2084 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000074720_100000743108 [0,1,1,0,0,0|2,0,0]=4 2085 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000210238_100009816466 [0,1,1,0,0,0|2,0,0]=4 2086 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100000743108_100009816466 [0,1,1,0,0,0|2,0,0]=4 2087 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100009816466_100000743108 [0,1,1,0,0,0|2,0,0]=4 2088 B16R0.221 CCCCOCOCCCCCCC(=O)OC 34a_100009863599_100011995733 [0,1,1,0,0,0|2,0,0]=4 2089 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100009815986_100011995733 [0,1,1,0,0,0|2,0,0]=4 2090 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100011995733_100009815986 [0,1,1,0,0,0|2,0,0]=4 2091 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100000210211_100010282707 [0,1,1,0,0,0|1,0,0]=3 2092 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210210 [0,1,1,0,0,0|1,0,0]=3 2093 B16R0.221 CCCCSCCNCCCCCC(=O)OC 2230a_100025743550_100009816466 [0,1,1,0,0,0|2,0,0]=4 2094 B16R0.221 CCCCSCCOCCCCCC(=O)OC 34a_200000230436_100009816466 [0,1,1,0,0,0|2,0,0]=4 2095 B16R0.221 CCCCSCCOCCCCCC(=O)OC 7a_200000230436_100009816466 [0,1,1,0,0,0|2,0,0]=4 2096 B16R0.221 CCCOCCCCCCCCCC(=O)OC 34a_100000210258_100009813843 [0,1,1,0,0,0|1,0,0]=3 2097 B16R0.221 CCCOCCCNCCCCCC(=O)OC 2230a_100011217757_100009816466 [0,1,1,0,0,0|2,0,0]=4 2098 B16R0.221 CCCOCCCNCCCCCC(=O)OC 34a_100011217757_100009816466 [0,1,1,0,0,0|2,0,0]=4 2099 B16R0.221 CCCOCCNCCCCCCC(=O)OC 2230a_100161115042_100009815986 [0,1,1,0,0,0|2,0,0]=4 2100 B16R0.221 CCCOCCNCCCCCCC(=O)OC 34a_100161115042_100009815986 [0,1,1,0,0,0|2,0,0]=4 2101 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100000752267_100009815986 [0,1,1,0,0,0|2,0,0]=4 2102 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100009863599_100011215938 [0,1,1,0,0,0|2,0,0]=4 2103 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100000752267_100009815986 [0,1,1,0,0,0|2,0,0]=4 2104 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100009863599_100011215938 [0,1,1,0,0,0|2,0,0]=4 2105 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100009815986_100011215938 [0,1,1,0,0,0|2,0,0]=4 2106 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100011215938_100009815986 [0,1,1,0,0,0|2,0,0]=4 2107 B16R0.221 CCCSCCCCCCCCCC(=O)OC 62a_100000210303_100009813843 [0,1,1,0,0,0|1,0,0]=3 2108 B16R0.221 CCCSCCNCCCCCCC(=O)OC 2230a_100020603323_100009815986 [0,1,1,0,0,0|2,0,0]=4 2109 B16R0.221 CCCSCCOCCCCCCC(=O)OC 34a_200000230433_100009815986 [0,1,1,0,0,0|2,0,0]=4 2110 B16R0.221 CCCSCCOCCCCCCC(=O)OC 7a_200000230433_100009815986 [0,1,1,0,0,0|2,0,0]=4 2111 B16R0.221 CCNCCCCCCCCCCC(=O)OC 2230a_100015525214_100009812566 [0,1,1,0,0,0|1,0,0]=3 2112 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000210202 [0,1,1,0,0,0|1,0,0]=3 2113 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100121572206_100009812566 [0,1,1,0,0,0|1,0,0]=3 2114 B16R0.221 CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000210202 [0,1,1,0,0,0|1,0,0]=3 2115 B16R0.221 CCOCCCNCCCCCCC(=O)OC 2230a_100000210961_100009815986 [0,1,1,0,0,0|2,0,0]=4 2116 B16R0.221 CCOCCCNCCCCCCC(=O)OC 34a_100000210961_100009815986 [0,1,1,0,0,0|2,0,0]=4 2117 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100000757476_100009815986 [0,1,1,0,0,0|2,0,0]=4 2118 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100009863599_100012232248 [0,1,1,0,0,0|2,0,0]=4 2119 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100000757476_100009815986 [0,1,1,0,0,0|2,0,0]=4 2120 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100009863599_100012232248 [0,1,1,0,0,0|2,0,0]=4 2121 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100009815986_100012232248 [0,1,1,0,0,0|2,0,0]=4 2122 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100012232248_100009815986 [0,1,1,0,0,0|2,0,0]=4 2123 B16R0.221 CCOCCNCCCCCCCC(=O)OC 2230a_102516460346_100010004213 [0,1,1,0,0,0|2,0,0]=4 2124 B16R0.221 CCOCCNCCCCCCCC(=O)OC 34a_102516460346_100010004213 [0,1,1,0,0,0|2,0,0]=4 2125 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100000210136_100010004213 [0,1,1,0,0,0|2,0,0]=4 2126 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100011022521_100000210147 [0,1,1,0,0,0|2,0,0]=4 2127 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100000210136_100010004213 [0,1,1,0,0,0|2,0,0]=4 2128 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100011022521_100011215890 [0,1,1,0,0,0|2,0,0]=4 2129 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100000210147_100010004213 [0,1,1,0,0,0|2,0,0]=4 2130 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100010004213_100011215890 [0,1,1,0,0,0|2,0,0]=4 2131 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100000739092_100010282707 [0,1,1,0,0,0|2,0,0]=4 2132 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100010282707_100000739092 [0,1,1,0,0,0|2,0,0]=4 2133 B16R0.221 CCSCCCCCCCCCCC(=O)OC 62a_100000210202_100009812566 [0,1,1,0,0,0|1,0,0]=3 2134 B16R0.221 CCSCCCOCCCCCCC(=O)OC 34a_100011216438_100009815986 [0,1,1,0,0,0|2,0,0]=4 2135 B16R0.221 CCSCCCOCCCCCCC(=O)OC 7a_100011216438_100009815986 [0,1,1,0,0,0|2,0,0]=4 2136 B16R0.221 CCSCCNCCCCCCCC(=O)OC 2230a_100000106463_100010004213 [0,1,1,0,0,0|2,0,0]=4 2137 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100000212035_100010004213 [0,1,1,0,0,0|2,0,0]=4 2138 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100011022521_100000757381 [0,1,1,0,0,0|2,0,0]=4 2139 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100000212035_100010004213 [0,1,1,0,0,0|2,0,0]=4 2140 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100011022521_100000757381 [0,1,1,0,0,0|2,0,0]=4 2141 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100000757381_100010004213 [0,1,1,0,0,0|2,0,0]=4 2142 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100010004213_100000757381 [0,1,1,0,0,0|2,0,0]=4 2143 B16R0.221 CNC(=O)CCCCCCCCCCCCO 240690a_100102657272_100102582631 [0,1,1,0,0,0|2,0,0]=4 2144 B16R0.221 CNCCCCCCCCCCCC(=O)OC 2230a_106832991635_100010983606 [0,1,1,0,0,0|1,0,0]=3 2145 B16R0.221 CNCCCCCCCCCCCC(=O)OC 34a_100102657272_100010983606 [0,1,1,0,0,0|1,0,0]=3 2146 B16R0.221 CNCCCCCCCCCCCC(=O)OC 7a_106832991635_100010983606 [0,1,1,0,0,0|1,0,0]=3 2147 B16R0.221 CNCCCCCOCCCCCC(=O)OC 34a_100000722520_100009816466 [0,1,1,0,0,0|2,0,0]=4 2148 B16R0.221 CNCCCOCCCCCCCC(=O)OC 34a_100000213112_100010004213 [0,1,1,0,0,0|2,0,0]=4 2149 B16R0.221 COC(=O)CCCCCCCCCCCSC 62a_200000210301_100010983606 [0,1,1,0,0,0|1,0,0]=3 2150 B16R0.221 COC(=O)CCCCCCCCCCCS[13CH3] 62a_200025704644_100010983606 [0,1,1,0,0,0|1,0,0]=3 2151 B16R0.221 COC(=O)CCCCCCCCCCOCF 34a_100011003013_100015361967 [0,1,1,0,0,0|2,0,0]=4 2152 B16R0.221 COC(=O)CCCCCCCCCCOCF 7a_100011003013_100015361967 [0,1,1,0,0,0|2,0,0]=4 2153 B16R0.221 COC(=O)CCCCCCCCCCSCF 62a_100015361967_100009812566 [0,1,1,0,0,0|2,0,0]=4 2154 B16R0.221 COC(=O)CCCCCCCCCNCCF 34a_100000724931_100009813843 [0,1,1,0,0,0|2,0,0]=4 2155 B16R0.221 COC(=O)CCCCCCCCCNCCO 2230a_100016997473_100009813843 [0,1,1,0,0,0|2,0,0]=4 2156 B16R0.221 COC(=O)CCCCCCCCCNCCO 34a_100016990907_100009813843 [0,1,1,0,0,0|2,0,0]=4 2157 B16R0.221 COC(=O)CCCCCCCCCOCCBr 34a_100000211926_100009813843 [0,1,1,0,0,0|2,0,0]=4 2158 B16R0.221 COC(=O)CCCCCCCCCOCCN 34a_100000210304_100009813843 [0,1,1,0,0,0|2,0,0]=4 2159 B16R0.221 COC(=O)CCCCCCCCCSCCF 62a_100011217306_100009813843 [0,1,1,0,0,0|2,0,0]=4 2160 B16R0.221 COC(=O)CCCCCCCCCSCCO 62a_100000211926_100009813843 [0,1,1,0,0,0|2,0,0]=4 2161 B16R0.221 COC(=O)CCCCCCCCCSCSC 62a_100011218213_100009813843 [0,1,1,0,0,0|2,0,0]=4 2162 B16R0.221 COC(=O)CCCCCCCCNCCCF 2230a_100015189416_100010282707 [0,1,1,0,0,0|2,0,0]=4 2163 B16R0.221 COC(=O)CCCCCCCCNCCCF 34a_100015189416_100010282707 [0,1,1,0,0,0|2,0,0]=4 2164 B16R0.221 COC(=O)CCCCCCCCNCCSC 2230a_100020590264_100010282707 [0,1,1,0,0,0|2,0,0]=4 2165 B16R0.221 COC(=O)CCCCCCCCOCCCBr 34a_100011217188_100010282707 [0,1,1,0,0,0|2,0,0]=4 2166 B16R0.221 COC(=O)CCCCCCCCOCCCCl 34a_100000230001_100010282707 [0,1,1,0,0,0|2,0,0]=4 2167 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000035544_100011934791 [0,1,1,0,0,0|2,0,0]=4 2168 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000759539_100010282707 [0,1,1,0,0,0|2,0,0]=4 2169 B16R0.221 COC(=O)CCCCCCCCOCCCF 7a_100000035544_100011934791 [0,1,1,0,0,0|2,0,0]=4 2170 B16R0.221 COC(=O)CCCCCCCCOCCCN 34a_100000182051_100010282707 [0,1,1,0,0,0|2,0,0]=4 2171 B16R0.221 COC(=O)CCCCCCCCOCCCO 34a_100000035544_100000230001 [0,1,1,0,0,0|2,0,0]=4 2172 B16R0.221 COC(=O)CCCCCCCCOCCCO 7a_100000035544_100011215043 [0,1,1,0,0,0|2,0,0]=4 2173 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000035544_100000212216 [0,1,1,0,0,0|2,0,0]=4 2174 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000230434_100010282707 [0,1,1,0,0,0|2,0,0]=4 2175 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000035544_100000212216 [0,1,1,0,0,0|2,0,0]=4 2176 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000230434_100010282707 [0,1,1,0,0,0|2,0,0]=4 2177 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100010282707_100011934791 [0,1,1,0,0,0|2,0,0]=4 2178 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100011934791_100010282707 [0,1,1,0,0,0|2,0,0]=4 2179 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100010282707_100011215043 [0,1,1,0,0,0|2,0,0]=4 2180 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100011215043_100010282707 [0,1,1,0,0,0|2,0,0]=4 2181 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100000212216_100010282707 [0,1,1,0,0,0|2,0,0]=4 2182 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100010282707_100000751147 [0,1,1,0,0,0|2,0,0]=4 2183 B16R0.221 COC(=O)CCCCCCCNCCCCO 2230a_100000750430_100010004213 [0,1,1,0,0,0|2,0,0]=4 2184 B16R0.221 COC(=O)CCCCCCCNCCCCO 34a_100000750430_100010004213 [0,1,1,0,0,0|2,0,0]=4 2185 B16R0.221 COC(=O)CCCCCCCNCCCSC 2230a_100000749238_100010004213 [0,1,1,0,0,0|2,0,0]=4 2186 B16R0.221 COC(=O)CCCCCCCOCCCCBr 34a_100011216708_100010004213 [0,1,1,0,0,0|2,0,0]=4 2187 B16R0.221 COC(=O)CCCCCCCOCCCCCl 34a_100000210776_100010004213 [0,1,1,0,0,0|2,0,0]=4 2188 B16R0.221 COC(=O)CCCCCCCOCCCCCl 7a_100000210776_100010004213 [0,1,1,0,0,0|2,0,0]=4 2189 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011022521_100000729493 [0,1,1,0,0,0|2,0,0]=4 2190 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011995726_100010004213 [0,1,1,0,0,0|2,0,0]=4 2191 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011022521_100000729493 [0,1,1,0,0,0|2,0,0]=4 2192 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011995726_100010004213 [0,1,1,0,0,0|2,0,0]=4 2193 B16R0.221 COC(=O)CCCCCCCOCCCCI 34a_200012148704_100010004213 [0,1,1,0,0,0|2,0,0]=4 2194 B16R0.221 COC(=O)CCCCCCCOCCCCN 34a_100000750430_100010004213 [0,1,1,0,0,0|2,0,0]=4 2195 B16R0.221 COC(=O)CCCCCCCOCCCCO 34a_100011022521_100011216708 [0,1,1,0,0,0|2,0,0]=4 2196 B16R0.221 COC(=O)CCCCCCCOCCCCO 7a_100011022521_100000210776 [0,1,1,0,0,0|2,0,0]=4 2197 B16R0.221 COC(=O)CCCCCCCOCCCSC 34a_100000690336_100010004213 [0,1,1,0,0,0|2,0,0]=4 2198 B16R0.221 COC(=O)CCCCCCCOCCCSC 7a_100000690336_100010004213 [0,1,1,0,0,0|2,0,0]=4 2199 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100000729493_100010004213 [0,1,1,0,0,0|2,0,0]=4 2200 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100010004213_100000729493 [0,1,1,0,0,0|2,0,0]=4 2201 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100000210776_100010004213 [0,1,1,0,0,0|2,0,0]=4 2202 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100010004213_100000210776 [0,1,1,0,0,0|2,0,0]=4 2203 B16R0.221 COC(=O)CCCCCCNCCCCCO 2230a_100000762737_100009815986 [0,1,1,0,0,0|2,0,0]=4 2204 B16R0.221 COC(=O)CCCCCCNCCCCCO 34a_100000762737_100009815986 [0,1,1,0,0,0|2,0,0]=4 2205 B16R0.221 COC(=O)CCCCCCOCCCCCBr 34a_100000746331_100009815986 [0,1,1,0,0,0|2,0,0]=4 2206 B16R0.221 COC(=O)CCCCCCOCCCCCBr 7a_100000746331_100009815986 [0,1,1,0,0,0|2,0,0]=4 2207 B16R0.221 COC(=O)CCCCCCOCCCCCCl 34a_100000746330_100009815986 [0,1,1,0,0,0|2,0,0]=4 2208 B16R0.221 COC(=O)CCCCCCOCCCCCCl 7a_100000746330_100009815986 [0,1,1,0,0,0|2,0,0]=4 2209 B16R0.221 COC(=O)CCCCCCOCCCCCF 34a_100009863599_100000729378 [0,1,1,0,0,0|2,0,0]=4 2210 B16R0.221 COC(=O)CCCCCCOCCCCCF 7a_100009863599_100000729378 [0,1,1,0,0,0|2,0,0]=4 2211 B16R0.221 COC(=O)CCCCCCOCCCCCI 34a_200012148887_100009815986 [0,1,1,0,0,0|2,0,0]=4 2212 B16R0.221 COC(=O)CCCCCCOCCCCCI 7a_200012148887_100009815986 [0,1,1,0,0,0|2,0,0]=4 2213 B16R0.221 COC(=O)CCCCCCOCCCCCN 34a_100000762737_100009815986 [0,1,1,0,0,0|2,0,0]=4 2214 B16R0.221 COC(=O)CCCCCCOCCCCCO 34a_100009863599_100000746330 [0,1,1,0,0,0|2,0,0]=4 2215 B16R0.221 COC(=O)CCCCCCOCCCCCO 7a_100009863599_100000746330 [0,1,1,0,0,0|2,0,0]=4 2216 B16R0.221 COC(=O)CCCCCCOCCCCSC 34a_100011217163_100009815986 [0,1,1,0,0,0|2,0,0]=4 2217 B16R0.221 COC(=O)CCCCCCOCCCCSC 7a_100011217163_100009815986 [0,1,1,0,0,0|2,0,0]=4 2218 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100000729378_100009815986 [0,1,1,0,0,0|2,0,0]=4 2219 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100009815986_100000729378 [0,1,1,0,0,0|2,0,0]=4 2220 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100000746330_100009815986 [0,1,1,0,0,0|2,0,0]=4 2221 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100009815986_100000746330 [0,1,1,0,0,0|2,0,0]=4 2222 B16R0.221 COC(=O)CCCCCNCCCCCCO 2230a_100000686447_100009816466 [0,1,1,0,0,0|2,0,0]=4 2223 B16R0.221 COC(=O)CCCCCNCCCCCCO 34a_100000686447_100009816466 [0,1,1,0,0,0|2,0,0]=4 2224 B16R0.221 COC(=O)CCCCCOCCCCCCBr 34a_100011215345_100009816466 [0,1,1,0,0,0|2,0,0]=4 2225 B16R0.221 COC(=O)CCCCCOCCCCCCBr 7a_100011215345_100009816466 [0,1,1,0,0,0|2,0,0]=4 2226 B16R0.221 COC(=O)CCCCCOCCCCCCCl 34a_100000766143_100009816466 [0,1,1,0,0,0|2,0,0]=4 2227 B16R0.221 COC(=O)CCCCCOCCCCCCCl 7a_100000766143_100009816466 [0,1,1,0,0,0|2,0,0]=4 2228 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000074720_100015922095 [0,1,1,0,0,0|2,0,0]=4 2229 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000732779_100009816466 [0,1,1,0,0,0|2,0,0]=4 2230 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000074720_100015922095 [0,1,1,0,0,0|2,0,0]=4 2231 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000732779_100009816466 [0,1,1,0,0,0|2,0,0]=4 2232 B16R0.221 COC(=O)CCCCCOCCCCCCN 34a_100000686447_100009816466 [0,1,1,0,0,0|2,0,0]=4 2233 B16R0.221 COC(=O)CCCCCOCCCCCCO 34a_100000074720_100000766143 [0,1,1,0,0,0|2,0,0]=4 2234 B16R0.221 COC(=O)CCCCCOCCCCCCO 7a_100000074720_100000766143 [0,1,1,0,0,0|2,0,0]=4 2235 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100009816466_100015922095 [0,1,1,0,0,0|2,0,0]=4 2236 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100015922095_100009816466 [0,1,1,0,0,0|2,0,0]=4 2237 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100000766143_100009816466 [0,1,1,0,0,0|2,0,0]=4 2238 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100009816466_100000766143 [0,1,1,0,0,0|2,0,0]=4 2239 B16R0.221 COC(=O)CCCCNCCCCCCCO 2230a_100011996573_100000204269 [0,1,1,0,0,0|2,0,0]=4 2240 B16R0.221 COC(=O)CCCCNCCCCCCCO 34a_100011996573_100000204269 [0,1,1,0,0,0|2,0,0]=4 2241 B16R0.221 COC(=O)CCCCOCCCCCCCBr 34a_100000760002_100000204269 [0,1,1,0,0,0|2,0,0]=4 2242 B16R0.221 COC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000204269 [0,1,1,0,0,0|2,0,0]=4 2243 B16R0.221 COC(=O)CCCCOCCCCCCCN 34a_100011996573_100000204269 [0,1,1,0,0,0|2,0,0]=4 2244 B16R0.221 COC(=O)CCCCOCCCCCCCO 34a_100000059025_100000760002 [0,1,1,0,0,0|2,0,0]=4 2245 B16R0.221 COC(=O)CCCCOCCCCCCCO 7a_100000059025_100000760002 [0,1,1,0,0,0|2,0,0]=4 2246 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000204269_100000760002 [0,1,1,0,0,0|2,0,0]=4 2247 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000760002_100000204269 [0,1,1,0,0,0|2,0,0]=4 2248 B16R0.221 COC(=O)CCCNCCCCCCCCO 2230a_102515433106_100011218270 [0,1,1,0,0,0|2,0,0]=4 2249 B16R0.221 COC(=O)CCCNCCCCCCCCO 34a_102515433106_100000742333 [0,1,1,0,0,0|2,0,0]=4 2250 B16R0.221 COC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000742333 [0,1,1,0,0,0|2,0,0]=4 2251 B16R0.221 COC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011218270 [0,1,1,0,0,0|2,0,0]=4 2252 B16R0.221 COC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000742333 [0,1,1,0,0,0|2,0,0]=4 2253 B16R0.221 COC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011218270 [0,1,1,0,0,0|2,0,0]=4 2254 B16R0.221 COC(=O)CCCOCCCCCCCCN 34a_102515433106_100000742333 [0,1,1,0,0,0|2,0,0]=4 2255 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100000033203_100011218270 [0,1,1,0,0,0|2,0,0]=4 2256 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100011218270_100000033203 [0,1,1,0,0,0|2,0,0]=4 2257 B16R0.221 COC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000204255 [0,1,1,0,0,0|2,0,0]=4 2258 B16R0.221 COC(=O)CCNCCCCCCCCCO 34a_100000078944_100000742370 [0,1,1,0,0,0|2,0,0]=4 2259 B16R0.221 COC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000742370 [0,1,1,0,0,0|2,0,0]=4 2260 B16R0.221 COC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000204255 [0,1,1,0,0,0|2,0,0]=4 2261 B16R0.221 COC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000742370 [0,1,1,0,0,0|2,0,0]=4 2262 B16R0.221 COC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000204255 [0,1,1,0,0,0|2,0,0]=4 2263 B16R0.221 COC(=O)CCOCCCCCCCCCN 34a_100000078944_100000742370 [0,1,1,0,0,0|2,0,0]=4 2264 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100000204255_100009813782 [0,1,1,0,0,0|2,0,0]=4 2265 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100009813782_100000204255 [0,1,1,0,0,0|2,0,0]=4 2266 B16R0.221 COC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747449 [0,1,1,0,0,0|2,0,0]=4 2267 B16R0.221 COC(=O)CNCCCCCCCCCCO 34a_100000066964_100000747449 [0,1,1,0,0,0|2,0,0]=4 2268 B16R0.221 COC(=O)COCCCCCCCCCCBr 34a_100009813290_100000747449 [0,1,1,0,0,0|2,0,0]=4 2269 B16R0.221 COC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747449 [0,1,1,0,0,0|2,0,0]=4 2270 B16R0.221 COC(=O)COCCCCCCCCCCCl 34a_200000033068_100000747449 [0,1,1,0,0,0|2,0,0]=4 2271 B16R0.221 COC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747449 [0,1,1,0,0,0|2,0,0]=4 2272 B16R0.221 COC(=O)COCCCCCCCCCCN 34a_100000066964_100000747449 [0,1,1,0,0,0|2,0,0]=4 2273 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100000747449_200000033068 [0,1,1,0,0,0|2,0,0]=4 2274 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747449 [0,1,1,0,0,0|2,0,0]=4 2275 B16R0.221 COCCCCCCCCCCCC(=O)OC 34a_100138415774_100010983606 [0,1,1,0,0,0|1,0,0]=3 2276 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_100000059025_100011998445 [0,1,1,0,0,0|2,0,0]=4 2277 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_200012092642_100000204269 [0,1,1,0,0,0|2,0,0]=4 2278 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_100000059025_100011998445 [0,1,1,0,0,0|2,0,0]=4 2279 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_200012092642_100000204269 [0,1,1,0,0,0|2,0,0]=4 2280 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100000204269_100011998445 [0,1,1,0,0,0|2,0,0]=4 2281 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100011998445_100000204269 [0,1,1,0,0,0|2,0,0]=4 2282 B16R0.221 COCCCCCNCCCCCC(=O)OC 2230a_100000747528_100009816466 [0,1,1,0,0,0|2,0,0]=4 2283 B16R0.221 COCCCCCNCCCCCC(=O)OC 34a_100000747528_100009816466 [0,1,1,0,0,0|2,0,0]=4 2284 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100000740925_100009815986 [0,1,1,0,0,0|2,0,0]=4 2285 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100009863599_100000755781 [0,1,1,0,0,0|2,0,0]=4 2286 B16R0.221 COCCCCOCCCCCCC(=O)OC 7a_100009863599_100000730899 [0,1,1,0,0,0|2,0,0]=4 2287 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100000730899_100009815986 [0,1,1,0,0,0|2,0,0]=4 2288 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100009815986_100000730899 [0,1,1,0,0,0|2,0,0]=4 2289 B16R0.221 COCCCNCCCCCCCC(=O)OC 34a_100150723488_100010004213 [0,1,1,0,0,0|2,0,0]=4 2290 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100000740835_100010004213 [0,1,1,0,0,0|2,0,0]=4 2291 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100011022521_100000740836 [0,1,1,0,0,0|2,0,0]=4 2292 B16R0.221 COCCCOCCCCCCCC(=O)OC 7a_100011022521_100000740836 [0,1,1,0,0,0|2,0,0]=4 2293 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100000709357_100010004213 [0,1,1,0,0,0|2,0,0]=4 2294 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100010004213_100000709357 [0,1,1,0,0,0|2,0,0]=4 2295 B16R0.221 COCCNCCCCCCCCC(=O)OC 2230a_100000209980_100010282707 [0,1,1,0,0,0|2,0,0]=4 2296 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000035544_100011201679 [0,1,1,0,0,0|2,0,0]=4 2297 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000210237_100010282707 [0,1,1,0,0,0|2,0,0]=4 2298 B16R0.221 COCCOCCCCCCCCC(=O)OC 7a_100000035544_100000233755 [0,1,1,0,0,0|2,0,0]=4 2299 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100000233755_100010282707 [0,1,1,0,0,0|2,0,0]=4 2300 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100010282707_100000233755 [0,1,1,0,0,0|2,0,0]=4 2301 B16R0.221 COCSCCCCCCCCCC(=O)OC 62a_100000766300_100009813843 [0,1,1,0,0,0|2,0,0]=4 2302 B16R0.221 O=C(CO)CCCCCCCCCCCCO 1458a_100000210174_100009813331 [0,1,1,0,0,0|1,0,0]=3 2303 B16R0.221 O=C(CO)CCCCCCOCCCCCO 1458a_100000210174_200132310570 [0,1,1,0,0,0|2,0,0]=4 2304 B16R0.224 CC(CNCCCCCCCCCO)C(=O)O 269956a_100000749485_100009813782 [0,1,1,0,0,0|2,0,0]=4 2305 B16R0.224 CCCCCCCCCCCCC(C)C(=O)C 1458a_100000070787_200011217028 [0,1,1,0,0,0|1,0,0]=3 2306 B16R0.224 CCCCCCCCCCCCN(C)C(=O)C 11a_100000227908_100015343762 [0,1,1,0,0,0|2,0,0]=4 2307 B16R0.224 CCCCCCCCCCCCN(C)C(=O)C 1626a_100000227908_100015343762 [0,1,1,0,0,0|2,0,0]=4 2308 B16R0.224 CCCCCCCCCCCCN(C)C(=O)C 240690a_100000227908_100015343762 [0,1,1,0,0,0|2,0,0]=4 2309 B16R0.224 CCCCCCCCCCCCN(C)C(=O)C 527a_100000227908_100103153847 [0,1,1,0,0,0|2,0,0]=4 2310 B16R0.224 CCCCCCCCCCCNC(C)C(=O)C 2230a_200011215754_100009814033 [0,1,1,0,0,0|2,0,0]=4 2311 B16R0.224 CCCCCCCCCCCNC(C)C(=O)N 2230a_200011215754_100000702099 [0,1,1,0,0,0|2,0,0]=4 2312 B16R0.224 CCCCCCCCCCCNC(C)C(=O)N 34a_200011215754_100000702099 [0,1,1,0,0,0|2,0,0]=4 2313 B16R0.224 CCCCCCCCCCCNC(F)C(=O)N 2230a_200011215754_100009813875 [0,1,1,0,0,0|2,0,0]=4 2314 B16R0.224 CCCCCCCCCCCNC(F)C(=O)N 34a_200011215754_100009813875 [0,1,1,0,0,0|2,0,0]=4 2315 B16R0.224 CCCCCCCCCCCNC(F)C(=O)[O-] 34a_200011215754_100020610796 [0,1,1,0,0,0|1,0,1]=4 2316 B16R0.224 CCCCCCCCCCCN[C@@H](C)C(=O)O 269956a_100000743915_100011215454 [0,1,1,0,0,0|1,0,0]=3 2317 B16R0.224 CCCCCCCCCCCN[C@H](C)C(=O)N 2230a_100000119354_100011215454 [0,1,1,0,0,0|2,0,0]=4 2318 B16R0.224 CCCCCCCCCCCN[C@H](C)C(=O)N 34a_100000119354_100011215454 [0,1,1,0,0,0|2,0,0]=4 2319 B16R0.224 CCCCCCCCCCCOC(C)C(=O)C 34a_100000212229_100011215454 [0,1,1,0,0,0|2,0,0]=4 2320 B16R0.224 CCCCCCCCCCCOC(C)C(=O)C 7a_100000210809_100000179758 [0,1,1,0,0,0|2,0,0]=4 2321 B16R0.224 CCCCCCCCCCCOC(C)C(=O)N 34a_100000210809_100000702099 [0,1,1,0,0,0|2,0,0]=4 2322 B16R0.224 CCCCCCCCCCCOC(C)C(=O)N 7a_100000210809_100000702099 [0,1,1,0,0,0|2,0,0]=4 2323 B16R0.224 CCCCCCCCCCCOC(F)C(=O)N 34a_100000210809_100009813875 [0,1,1,0,0,0|2,0,0]=4 2324 B16R0.224 CCCCCCCCCCCOC(F)C(=O)N 7a_100000210809_100009813875 [0,1,1,0,0,0|2,0,0]=4 2325 B16R0.224 CCCCCCCCCCCOC(F)C(=O)[O-] 34a_100000210809_100020610796 [0,1,1,0,0,0|1,0,1]=4 2326 B16R0.224 CCCCCCCCCCCO[C@@H](C)C(=O)[O-] 7a_217856618621_100011215454 [0,1,1,0,0,0|1,0,1]=4 2327 B16R0.224 CCCCCCCCCCCO[C@H](C)C(=O)N 34a_100000731257_100011215454 [0,1,1,0,0,0|2,0,0]=4 2328 B16R0.224 CCCCCCCCCCCO[C@H](C)C(=O)N 7a_100000731257_100011215454 [0,1,1,0,0,0|2,0,0]=4 2329 B16R0.224 CCCCCCCCCCCSC(C)C(=O)C 62a_100009814033_100011215454 [0,1,1,0,0,0|2,0,0]=4 2330 B16R0.224 CCCCCCCCCCCSC(C)C(=O)N 62a_100000702099_100011215454 [0,1,1,0,0,0|2,0,0]=4 2331 B16R0.224 CCCCCCCCCCCSC(F)C(=O)N 62a_100009813875_100011215454 [0,1,1,0,0,0|2,0,0]=4 2332 B16R0.224 CCCCCCCCCCCSC(F)C(=O)[O-] 62a_100020610796_100011215454 [0,1,1,0,0,0|1,0,1]=4 2333 B16R0.224 CCCCCCCCCCNCC(C)C(=O)O 269956a_100000749485_100000210320 [0,1,1,0,0,0|1,0,0]=3 2334 B16R0.224 CCCCCCCCCCNCC(F)C(=O)O 269956a_100000084737_100000210320 [0,1,1,0,0,0|1,0,0]=3 2335 B16R0.224 CCCCCCCCCCOCC(C)C(=O)C 34a_100000032740_100000210320 [0,1,1,0,0,0|2,0,0]=4 2336 B16R0.224 CCCCCCCCCCOCC(C)C(=O)C 7a_100000032740_100000210320 [0,1,1,0,0,0|2,0,0]=4 2337 B16R0.224 CCCCCCCCCCOC[C@H](N)C(=O)N 34a_100000729942_100000210320 [0,1,1,0,0,0|2,0,0]=4 2338 B16R0.224 C[C@H](NCCCCCCCCCCO)C(=O)O 269956a_100000743915_100009813290 [0,1,1,0,0,0|2,0,0]=4 2339 B16R0.224 O=C(O)C(F)CNCCCCCCCCCO 269956a_100000084737_100009813782 [0,1,1,0,0,0|2,0,0]=4 2340 B16R0.274 C=C(Br)CCOCCCCCCCCCCC 34a_100009813270_100011215454 [0,1,1,0,0,0|2,0,0]=4 2341 B16R0.274 C=C(C)CCNCCCCCCCCCCC 2230a_200011215754_100000730704 [0,1,1,0,0,0|2,0,0]=4 2342 B16R0.274 C=C(C)CCNCCCCCCCCCCC 34a_200011215754_100000730704 [0,1,1,0,0,0|2,0,0]=4 2343 B16R0.274 C=C(C)CCOCCCCCCCCCCC 34a_100000210809_100000730704 [0,1,1,0,0,0|2,0,0]=4 2344 B16R0.274 C=C(C)CCOCCCCCCCCCCC 34a_100000764851_100011215454 [0,1,1,0,0,0|2,0,0]=4 2345 B16R0.274 C=C(C)CCOCCCCCCCCCCC 7a_100000210809_100000730704 [0,1,1,0,0,0|2,0,0]=4 2346 B16R0.274 C=C(C)CNCCCCCCCCCCCC 2230a_100000210451_100000748629 [0,1,1,0,0,0|2,0,0]=4 2347 B16R0.274 C=C(C)CNCCCCCCCCCCCC 34a_100000210451_100000748629 [0,1,1,0,0,0|2,0,0]=4 2348 B16R0.274 C=C(C)COCCCCCCCCCCCC 34a_100000210245_100000759014 [0,1,1,0,0,0|2,0,0]=4 2349 B16R0.274 C=C(C)COCCCCCCCCCCCC 34a_100000210810_100000748629 [0,1,1,0,0,0|2,0,0]=4 2350 B16R0.274 C=C(C)COCCCCCCCCCCCC 7a_100000210810_100000748629 [0,1,1,0,0,0|2,0,0]=4 2351 B16R0.274 C=C(F)CNCCCCCCCCCCCC 2230a_100000210451_100009893438 [0,1,1,0,0,0|2,0,0]=4 2352 B16R0.274 C=C(F)CNCCCCCCCCCCCC 34a_100000210451_100009893438 [0,1,1,0,0,0|2,0,0]=4 2353 B16R0.274 C=C(F)COCCCCCCCCCCCC 34a_100000210810_100009893438 [0,1,1,0,0,0|2,0,0]=4 2354 B16R0.274 C=C(F)COCCCCCCCCCCCC 34a_200010262243_100000759014 [0,1,1,0,0,0|2,0,0]=4 2355 B16R0.274 C=C(F)COCCCCCCCCCCCC 7a_100000210810_100000042424 [0,1,1,0,0,0|2,0,0]=4 2356 B16R0.274 C=CCCCCCCCCCCNCC(=O)O 269956a_100016091260_100011093070 [0,1,1,0,0,0|0,0,2]=4 2357 B16R0.274 CC(=O)CCCCCCCCCCCCCO 1458a_100000070787_100009812470 [0,1,1,0,0,0|1,0,0]=3 2358 B16R0.274 CC(=O)CCCCNCCCCCCCCO 34a_102515433106_100009817362 [0,1,1,0,0,0|2,0,0]=4 2359 B16R0.274 CC(=O)CCCCOCCCCCCCCBr 34a_100009813846_100009817362 [0,1,1,0,0,0|2,0,0]=4 2360 B16R0.274 CC(=O)CCCCOCCCCCCCCBr 7a_100009813846_100000735457 [0,1,1,0,0,0|2,0,0]=4 2361 B16R0.274 CC(=O)CCCCOCCCCCCCCCl 34a_100000033203_100009817362 [0,1,1,0,0,0|2,0,0]=4 2362 B16R0.274 CC(=O)CCCCOCCCCCCCCCl 7a_100000033203_100000735457 [0,1,1,0,0,0|2,0,0]=4 2363 B16R0.274 CC(=O)CCCCOCCCCCCCCN 34a_102515433106_100009817362 [0,1,1,0,0,0|2,0,0]=4 2364 B16R0.274 CC(=O)CCCCSCCCCCCCCO 62a_100000033203_100000735457 [0,1,1,0,0,0|2,0,0]=4 2365 B16R0.274 CC(=O)CCCCSCCCCCCCCO 62a_100000735457_100000033203 [0,1,1,0,0,0|2,0,0]=4 2366 B16R0.274 CC(=O)CCCNCCCCCCCCCO 34a_100000078944_100000685027 [0,1,1,0,0,0|2,0,0]=4 2367 B16R0.274 CC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100000685027 [0,1,1,0,0,0|2,0,0]=4 2368 B16R0.274 CC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100011215641 [0,1,1,0,0,0|2,0,0]=4 2369 B16R0.274 CC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100000685027 [0,1,1,0,0,0|2,0,0]=4 2370 B16R0.274 CC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100011215641 [0,1,1,0,0,0|2,0,0]=4 2371 B16R0.274 CC(=O)CCCOCCCCCCCCCN 34a_100000078944_100000685027 [0,1,1,0,0,0|2,0,0]=4 2372 B16R0.274 CC(=O)CCCOCCCCCCCCCO 34a_100000759063_100009813782 [0,1,1,0,0,0|2,0,0]=4 2373 B16R0.274 CC(=O)CCCOCCCCCCCCCO 7a_100000759063_100009813782 [0,1,1,0,0,0|2,0,0]=4 2374 B16R0.274 CC(=O)CCCSCCCCCCCCCO 62a_100009813782_100011215641 [0,1,1,0,0,0|2,0,0]=4 2375 B16R0.274 CC(=O)CCCSCCCCCCCCCO 62a_100011215641_100009813782 [0,1,1,0,0,0|2,0,0]=4 2376 B16R0.274 CC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000053229 [0,1,1,0,0,0|2,0,0]=4 2377 B16R0.274 CC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000053229 [0,1,1,0,0,0|2,0,0]=4 2378 B16R0.274 CC(=O)CCOCCCCCCCCCCO 34a_100000759926_100009813290 [0,1,1,0,0,0|2,0,0]=4 2379 B16R0.274 CC(=O)CCOCCCCCCCCCCO 7a_100000759926_100009813290 [0,1,1,0,0,0|2,0,0]=4 2380 B16R0.274 CC(=O)CCSCCCCCCCCCCO 62a_100000053229_200000033068 [0,1,1,0,0,0|2,0,0]=4 2381 B16R0.274 CC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000053229 [0,1,1,0,0,0|2,0,0]=4 2382 B16R0.274 CC(=O)COCCCCCCCCCCCO 34a_100000211253_100009812471 [0,1,1,0,0,0|2,0,0]=4 2383 B16R0.274 CC(=O)NCCCCCCCCCCCCO 240690a_100000066677_100015343762 [0,1,1,0,0,0|2,0,0]=4 2384 B16R0.274 CC(=O)SCCCCCCCCCCCS[13CH3] 62a_100010140907_200025704644 [0,1,1,0,0,0|2,0,0]=4 2385 B16R0.274 CC(=O)SCCCCCCCCCCCS[13CH3] 62a_200025704644_100010140907 [0,1,1,0,0,0|2,0,0]=4 2386 B16R0.274 CCCCC#CCCCCCCNCC(=O)O 269956a_100016091260_200000043322 [0,1,1,0,0,0|0,0,2]=4 2387 B16R0.274 CCCCCCCCCCCCCCC(=O)C 1458a_100000070787_100011215471 [0,1,1,0,0,0|1,0,0]=3 2388 B16R0.274 CCCCCCCCCCCCCCC(=O)C 1458a_100000297455_200000210301 [0,1,1,0,0,0|1,0,0]=3 2389 B16R0.274 CCCCCCCCCCCCCCC(=O)[13CH3] 1458a_100000297455_200025704644 [0,1,1,0,0,0|1,0,0]=3 2390 B16R0.274 CCCCCCCCCCCCCNC(=O)C 11a_100011215765_100015343762 [0,1,1,0,0,0|1,0,0]=3 2391 B16R0.274 CCCCCCCCCCCCCNC(=O)C 1626a_100011215765_100015343762 [0,1,1,0,0,0|1,0,0]=3 2392 B16R0.274 CCCCCCCCCCCCCNC(=O)C 240690a_100011215765_100015343762 [0,1,1,0,0,0|1,0,0]=3 2393 B16R0.274 CCCCCCCCCCCCCNC(=O)C 527a_100011215765_100103153847 [0,1,1,0,0,0|1,0,0]=3 2394 B16R0.274 CCCCCCCCCCCCNCC(=O)N 2230a_100000210451_100000747473 [0,1,1,0,0,0|1,0,0]=3 2395 B16R0.274 CCCCCCCCCCCCNCC(=O)N 2230a_100000711301_100011215052 [0,1,1,0,0,0|1,0,0]=3 2396 B16R0.274 CCCCCCCCCCCCNCC(=O)N 34a_100000210451_100000187820 [0,1,1,0,0,0|1,0,0]=3 2397 B16R0.274 CCCCCCCCCCCCNCC(=O)O 269956a_100016091260_100000759014 [0,1,1,0,0,0|0,0,0]=2 2398 B16R0.274 CCCCCCCCCCCCNCC(=O)[O-] 34a_100000210451_100020667443 [0,1,1,0,0,0|0,0,1]=3 2399 B16R0.274 CCCCCCCCCCCCNCC(C)O 2230a_100000210451_100011218427 [0,1,1,0,0,0|1,0,1]=4 2400 B16R0.274 CCCCCCCCCCCCNCC(C)O 2230a_100000210904_100011215052 [0,1,1,0,0,0|1,0,1]=4 2401 B16R0.274 CCCCCCCCCCCCNCC(C)O 270004a_100000210904_100011218549 [0,1,1,0,0,0|1,0,1]=4 2402 B16R0.274 CCCCCCCCCCCCNCC(C)O 34a_100000210451_100011218427 [0,1,1,0,0,0|1,0,1]=4 2403 B16R0.274 CCCCCCCCCCCCNCC(C)O 34a_100000210904_100000759014 [0,1,1,0,0,0|1,0,1]=4 2404 B16R0.274 CCCCCCCCCCCCNC[C@@H](C)O 2230a_100000210451_100009817552 [0,1,1,0,0,0|1,0,1]=4 2405 B16R0.274 CCCCCCCCCCCCNC[C@@H](C)O 34a_100000210451_100009817552 [0,1,1,0,0,0|1,0,1]=4 2406 B16R0.274 CCCCCCCCCCCCNC[N+](=O)[O-] 34a_100000210451_100000761209 [0,1,1,0,0,0|1,0,1]=4 2407 B16R0.274 CCCCCCCCCCCCOCC(=O)C 34a_100000211253_100000759014 [0,1,1,0,0,0|1,0,0]=3 2408 B16R0.274 CCCCCCCCCCCCOCC(=O)N 34a_100000210810_100000187820 [0,1,1,0,0,0|1,0,0]=3 2409 B16R0.274 CCCCCCCCCCCCOCC(=O)N 7a_100000210810_100000187820 [0,1,1,0,0,0|1,0,0]=3 2410 B16R0.274 CCCCCCCCCCCCOCC(=O)[O-] 34a_100000210810_100020667443 [0,1,1,0,0,0|0,0,1]=3 2411 B16R0.274 CCCCCCCCCCCCOCC(C)O 34a_100000210810_100011218427 [0,1,1,0,0,0|1,0,1]=4 2412 B16R0.274 CCCCCCCCCCCCOCC(C)O 7a_100000210810_100011218427 [0,1,1,0,0,0|1,0,1]=4 2413 B16R0.274 CCCCCCCCCCCCOC[C@@H](C)O 34a_100000210810_100009817552 [0,1,1,0,0,0|1,0,1]=4 2414 B16R0.274 CCCCCCCCCCCCOC[C@@H](C)O 7a_100000210810_100009817552 [0,1,1,0,0,0|1,0,1]=4 2415 B16R0.274 CCCCCCCCCCCCOC[N+](=O)[O-] 34a_100000210810_100000761209 [0,1,1,0,0,0|1,0,1]=4 2416 B16R0.274 CCCCCCCCCCCCSCC(=O)N 62a_100000747473_100000759014 [0,1,1,0,0,0|1,0,0]=3 2417 B16R0.274 CCCCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100000759014 [0,1,1,0,0,0|0,0,1]=3 2418 B16R0.274 CCCCCCCCCCCCSCC(C)O 62a_100011218427_100000759014 [0,1,1,0,0,0|1,0,1]=4 2419 B16R0.274 CCCCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100000759014 [0,1,1,0,0,0|1,0,1]=4 2420 B16R0.274 CCCCCCCCCCCNCCC(=O)N 2230a_200011215754_100000744528 [0,1,1,0,0,0|1,0,0]=3 2421 B16R0.274 CCCCCCCCCCCNCCC(=O)N 34a_200011215754_100000731001 [0,1,1,0,0,0|1,0,0]=3 2422 B16R0.274 CCCCCCCCCCCNCCC(C)O 2230a_200000755665_100011215454 [0,1,1,0,0,0|1,0,1]=4 2423 B16R0.274 CCCCCCCCCCCNCCC(C)O 2230a_200011215754_100012276601 [0,1,1,0,0,0|1,0,1]=4 2424 B16R0.274 CCCCCCCCCCCNCCC(C)O 34a_200011215754_100012276601 [0,1,1,0,0,0|1,0,1]=4 2425 B16R0.274 CCCCCCCCCCCNCOC(=O)C 34a_200011215754_100009813279 [0,1,1,0,0,0|2,0,0]=4 2426 B16R0.274 CCCCCCCCCCCNOCC(=O)O 269956a_100000106656_100011215454 [0,1,1,0,0,0|1,0,0]=3 2427 B16R0.274 CCCCCCCCCCCOCCC(=O)C 34a_100000759926_100011215454 [0,1,1,0,0,0|1,0,0]=3 2428 B16R0.274 CCCCCCCCCCCOCCC(=O)C 7a_100000210809_100000053229 [0,1,1,0,0,0|1,0,0]=3 2429 B16R0.274 CCCCCCCCCCCOCCC(=O)C 7a_100000759926_100011215454 [0,1,1,0,0,0|1,0,0]=3 2430 B16R0.274 CCCCCCCCCCCOCCC(=O)N 34a_100000210809_100000731001 [0,1,1,0,0,0|1,0,0]=3 2431 B16R0.274 CCCCCCCCCCCOCCC(=O)N 34a_100000757172_100011215454 [0,1,1,0,0,0|1,0,0]=3 2432 B16R0.274 CCCCCCCCCCCOCCC(=O)N 7a_100000210809_100000744528 [0,1,1,0,0,0|1,0,0]=3 2433 B16R0.274 CCCCCCCCCCCOCCC(=O)N 7a_100000757172_100011215454 [0,1,1,0,0,0|1,0,0]=3 2434 B16R0.274 CCCCCCCCCCCOCCC(C)O 34a_100000210809_100012276601 [0,1,1,0,0,0|1,0,1]=4 2435 B16R0.274 CCCCCCCCCCCOCCC(C)O 7a_100000210809_100012276601 [0,1,1,0,0,0|1,0,1]=4 2436 B16R0.274 CCCCCCCCCCCOCOC(=O)C 34a_100000210809_100009813279 [0,1,1,0,0,0|2,0,0]=4 2437 B16R0.274 CCCCCCCCCCCSCCC(=O)C 62a_100000053229_100011215454 [0,1,1,0,0,0|1,0,0]=3 2438 B16R0.274 CCCCCCCCCCCSCCC(=O)N 62a_100000744528_100011215454 [0,1,1,0,0,0|1,0,0]=3 2439 B16R0.274 CCCCCCCCCCCSCCC(C)O 62a_100012276601_100011215454 [0,1,1,0,0,0|1,0,1]=4 2440 B16R0.274 CCCCCCCCCCCSCOC(=O)C 62a_100000076356_100011215454 [0,1,1,0,0,0|2,0,0]=4 2441 B16R0.274 CCCCCCCCCCNCCCC(=O)C 34a_100000684558_100000685027 [0,1,1,0,0,0|1,0,0]=3 2442 B16R0.274 CCCCCCCCCCNCCCC(=O)N 34a_100000684558_100102525003 [0,1,1,0,0,0|1,0,0]=3 2443 B16R0.274 CCCCCCCCCCNCCCC(=O)N 34a_100000739312_100000210320 [0,1,1,0,0,0|1,0,0]=3 2444 B16R0.274 CCCCCCCCCCNCCCC(C)O 2230a_100000684558_200000718107 [0,1,1,0,0,0|1,0,1]=4 2445 B16R0.274 CCCCCCCCCCNCCCC(C)O 34a_100000684558_200000718107 [0,1,1,0,0,0|1,0,1]=4 2446 B16R0.274 CCCCCCCCCCNCCCS(=O)C 2230a_200000753449_100000210320 [0,1,1,0,0,0|2,0,0]=4 2447 B16R0.274 CCCCCCCCCCNCCNC(=O)C 2230a_100000209853_100000210320 [0,1,1,0,0,0|2,0,0]=4 2448 B16R0.274 CCCCCCCCCCNCCNC(=O)C 2230a_100000684558_100000189650 [0,1,1,0,0,0|2,0,0]=4 2449 B16R0.274 CCCCCCCCCCNCCNC(=O)N 2230a_100000684558_200000034859 [0,1,1,0,0,0|2,0,0]=4 2450 B16R0.274 CCCCCCCCCCNCCNC(=O)N 34a_100020590234_100000210320 [0,1,1,0,0,0|2,0,0]=4 2451 B16R0.274 CCCCCCCCCCNCCOC(=O)C 34a_100000684558_100009814007 [0,1,1,0,0,0|2,0,0]=4 2452 B16R0.274 CCCCCCCCCCNCCOC(=O)N 34a_100000684558_200011214921 [0,1,1,0,0,0|2,0,0]=4 2453 B16R0.274 CCCCCCCCCCOCCCC(=O)C 34a_100000210711_100000685027 [0,1,1,0,0,0|1,0,0]=3 2454 B16R0.274 CCCCCCCCCCOCCCC(=O)C 34a_100000759063_100000210320 [0,1,1,0,0,0|1,0,0]=3 2455 B16R0.274 CCCCCCCCCCOCCCC(=O)C 7a_100000210711_100011215641 [0,1,1,0,0,0|1,0,0]=3 2456 B16R0.274 CCCCCCCCCCOCCCC(=O)C 7a_100000759063_100000210320 [0,1,1,0,0,0|1,0,0]=3 2457 B16R0.274 CCCCCCCCCCOCCCC(=O)N 34a_100000210711_100102525003 [0,1,1,0,0,0|1,0,0]=3 2458 B16R0.274 CCCCCCCCCCOCCCC(=O)N 7a_100000210711_100102525003 [0,1,1,0,0,0|1,0,0]=3 2459 B16R0.274 CCCCCCCCCCOCCCC(C)O 34a_100000210711_200000718107 [0,1,1,0,0,0|1,0,1]=4 2460 B16R0.274 CCCCCCCCCCOCCCC(C)O 7a_100000210711_200000718107 [0,1,1,0,0,0|1,0,1]=4 2461 B16R0.274 CCCCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210320 [0,1,1,0,0,0|1,0,1]=4 2462 B16R0.274 CCCCCCCCCCOCCNC(=O)C 34a_100000158858_100000210320 [0,1,1,0,0,0|2,0,0]=4 2463 B16R0.274 CCCCCCCCCCOCCNC(=O)C 7a_100000210711_100000189650 [0,1,1,0,0,0|2,0,0]=4 2464 B16R0.274 CCCCCCCCCCOCCNC(=O)N 34a_100000181757_100000210320 [0,1,1,0,0,0|2,0,0]=4 2465 B16R0.274 CCCCCCCCCCOCCNC(=O)N 7a_100000210711_200000034859 [0,1,1,0,0,0|2,0,0]=4 2466 B16R0.274 CCCCCCCCCCOCCOC(=O)C 34a_100000210711_100009814007 [0,1,1,0,0,0|2,0,0]=4 2467 B16R0.274 CCCCCCCCCCOCCOC(=O)C 7a_100000210711_100009814007 [0,1,1,0,0,0|2,0,0]=4 2468 B16R0.274 CCCCCCCCCCOCCOC(=O)N 34a_100000210711_200011214921 [0,1,1,0,0,0|2,0,0]=4 2469 B16R0.274 CCCCCCCCCCOCCOC(=O)N 7a_100000210711_200011214921 [0,1,1,0,0,0|2,0,0]=4 2470 B16R0.274 CCCCCCCCCCOCCOC(=O)N 7a_100000766696_100000210320 [0,1,1,0,0,0|2,0,0]=4 2471 B16R0.274 CCCCCCCCCCSCCCC(=O)C 62a_100011215641_100000210320 [0,1,1,0,0,0|1,0,0]=3 2472 B16R0.274 CCCCCCCCCCSCCCC(=O)N 62a_100102525003_100000210320 [0,1,1,0,0,0|1,0,0]=3 2473 B16R0.274 CCCCCCCCCCSCCCC(C)O 62a_200000718107_100000210320 [0,1,1,0,0,0|1,0,1]=4 2474 B16R0.274 CCCCCCCCCCSCCNC(=O)C 62a_100000189650_100000210320 [0,1,1,0,0,0|2,0,0]=4 2475 B16R0.274 CCCCCCCCCCSCCNC(=O)N 62a_200000034859_100000210320 [0,1,1,0,0,0|2,0,0]=4 2476 B16R0.274 CCCCCCCCCCSCCOC(=O)C 62a_100009814007_100000210320 [0,1,1,0,0,0|2,0,0]=4 2477 B16R0.274 CCCCCCCCCCSCCOC(=O)N 62a_200011214921_100000210320 [0,1,1,0,0,0|2,0,0]=4 2478 B16R0.274 CCCCCCCCCNCCCCB(O)O 2230a_100000212291_200009817182 [0,1,1,0,0,0|1,0,1]=4 2479 B16R0.274 CCCCCCCCCNCCCCB(O)O 34a_100000212291_200009817182 [0,1,1,0,0,0|1,0,1]=4 2480 B16R0.274 CCCCCCCCCNCCCCC(=O)C 34a_100000212291_100009817362 [0,1,1,0,0,0|1,0,0]=3 2481 B16R0.274 CCCCCCCCCNCCCCC(=O)N 34a_100000696515_100011214924 [0,1,1,0,0,0|1,0,0]=3 2482 B16R0.274 CCCCCCCCCNCCCNC(=O)C 34a_100000736810_100011214924 [0,1,1,0,0,0|2,0,0]=4 2483 B16R0.274 CCCCCCCCCNCCCOC(=O)C 34a_100000212291_100000042594 [0,1,1,0,0,0|2,0,0]=4 2484 B16R0.274 CCCCCCCCCNCCCSC(=O)C 2230a_100000212291_100000038929 [0,1,1,0,0,0|2,0,0]=4 2485 B16R0.274 CCCCCCCCCNCCCSC(=O)C 34a_100000212291_100000038929 [0,1,1,0,0,0|2,0,0]=4 2486 B16R0.274 CCCCCCCCCNCCOCC(=O)N 2230a_100000212291_100000076697 [0,1,1,0,0,0|2,0,0]=4 2487 B16R0.274 CCCCCCCCCNCCOCC(=O)N 34a_100000212291_100000076697 [0,1,1,0,0,0|2,0,0]=4 2488 B16R0.274 CCCCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210670 [0,1,1,0,0,0|1,0,0]=3 2489 B16R0.274 CCCCCCCCCOCCCCB(O)O 34a_100000210712_200009817182 [0,1,1,0,0,0|1,0,1]=4 2490 B16R0.274 CCCCCCCCCOCCCCB(O)O 7a_100000210712_200009817182 [0,1,1,0,0,0|1,0,1]=4 2491 B16R0.274 CCCCCCCCCOCCCCC(=O)C 34a_100000210712_100009817362 [0,1,1,0,0,0|1,0,0]=3 2492 B16R0.274 CCCCCCCCCOCCCCC(=O)C 7a_100000210712_100000735457 [0,1,1,0,0,0|1,0,0]=3 2493 B16R0.274 CCCCCCCCCOCCCCC(=O)N 34a_100012022536_100011214924 [0,1,1,0,0,0|1,0,0]=3 2494 B16R0.274 CCCCCCCCCOCCCCC(=O)N 7a_100012022536_100000210328 [0,1,1,0,0,0|1,0,0]=3 2495 B16R0.274 CCCCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100011214924 [0,1,1,0,0,0|1,0,1]=4 2496 B16R0.274 CCCCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210328 [0,1,1,0,0,0|1,0,1]=4 2497 B16R0.274 CCCCCCCCCOCCCNC(=O)C 34a_100000752032_100011214924 [0,1,1,0,0,0|2,0,0]=4 2498 B16R0.274 CCCCCCCCCOCCCOC(=O)C 34a_100000210712_100000042594 [0,1,1,0,0,0|2,0,0]=4 2499 B16R0.274 CCCCCCCCCOCCCOC(=O)C 7a_100000210712_100000042594 [0,1,1,0,0,0|2,0,0]=4 2500 B16R0.274 CCCCCCCCCOCCCSC(=O)C 34a_100000210712_100000038929 [0,1,1,0,0,0|2,0,0]=4 2501 B16R0.274 CCCCCCCCCOCCCSC(=O)C 7a_100000210712_100000038929 [0,1,1,0,0,0|2,0,0]=4 2502 B16R0.274 CCCCCCCCCOCCOCC(=O)N 34a_100000210712_100000076697 [0,1,1,0,0,0|2,0,0]=4 2503 B16R0.274 CCCCCCCCCOCCOCC(=O)N 7a_100000210712_100000076697 [0,1,1,0,0,0|2,0,0]=4 2504 B16R0.274 CCCCCCCCCSCCCCB(O)O 62a_200009817182_100000210670 [0,1,1,0,0,0|1,0,1]=4 2505 B16R0.274 CCCCCCCCCSCCCCC(=O)C 62a_100000735457_100000210670 [0,1,1,0,0,0|1,0,0]=3 2506 B16R0.274 CCCCCCCCCSCCCOC(=O)C 62a_100000042594_100000210670 [0,1,1,0,0,0|2,0,0]=4 2507 B16R0.274 CCCCCCCCCSCCCSC(=O)C 62a_100000038929_100000210670 [0,1,1,0,0,0|2,0,0]=4 2508 B16R0.274 CCCCCCCCCSCCOCC(=O)N 62a_100000076697_100000210670 [0,1,1,0,0,0|2,0,0]=4 2509 B16R0.274 CCCCCCCCNCCCCCB(O)O 2230a_100000229939_200009817188 [0,1,1,0,0,0|1,0,1]=4 2510 B16R0.274 CCCCCCCCNCCCCCB(O)O 34a_100000229939_200009817188 [0,1,1,0,0,0|1,0,1]=4 2511 B16R0.274 CCCCCCCCNCCCCCC(=O)N 2230a_100000229939_100009817443 [0,1,1,0,0,0|1,0,0]=3 2512 B16R0.274 CCCCCCCCNCCCCCC(=O)N 34a_100000229939_100009817443 [0,1,1,0,0,0|1,0,0]=3 2513 B16R0.274 CCCCCCCCNCCCCNC(=O)C 2230a_200011368371_100000210759 [0,1,1,0,0,0|2,0,0]=4 2514 B16R0.274 CCCCCCCCNCCCCNC(=O)C 34a_200011368371_100000210759 [0,1,1,0,0,0|2,0,0]=4 2515 B16R0.274 CCCCCCCCNCCCCOC(=O)C 34a_100000229939_100000033659 [0,1,1,0,0,0|2,0,0]=4 2516 B16R0.274 CCCCCCCCNCCCCSC(=O)C 2230a_100000229939_200010402107 [0,1,1,0,0,0|2,0,0]=4 2517 B16R0.274 CCCCCCCCNCCCCSC(=O)C 34a_100000229939_200010402107 [0,1,1,0,0,0|2,0,0]=4 2518 B16R0.274 CCCCCCCCOCCCCCB(O)O 34a_100000210232_200009817188 [0,1,1,0,0,0|1,0,1]=4 2519 B16R0.274 CCCCCCCCOCCCCCB(O)O 7a_100000210232_200009817188 [0,1,1,0,0,0|1,0,1]=4 2520 B16R0.274 CCCCCCCCOCCCCCC(=O)N 34a_100000123541_100000210759 [0,1,1,0,0,0|1,0,0]=3 2521 B16R0.274 CCCCCCCCOCCCCCC(=O)N 34a_100000210232_100009817443 [0,1,1,0,0,0|1,0,0]=3 2522 B16R0.274 CCCCCCCCOCCCCCC(=O)N 7a_100000123541_100000210759 [0,1,1,0,0,0|1,0,0]=3 2523 B16R0.274 CCCCCCCCOCCCCCC(=O)N 7a_100000210232_100009817443 [0,1,1,0,0,0|1,0,0]=3 2524 B16R0.274 CCCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210759 [0,1,1,0,0,0|0,0,1]=3 2525 B16R0.274 CCCCCCCCOCCCCOC(=O)C 34a_100000073216_100000210759 [0,1,1,0,0,0|2,0,0]=4 2526 B16R0.274 CCCCCCCCOCCCCOC(=O)C 34a_100000210232_100000033659 [0,1,1,0,0,0|2,0,0]=4 2527 B16R0.274 CCCCCCCCOCCCCOC(=O)C 7a_100000073216_100000210759 [0,1,1,0,0,0|2,0,0]=4 2528 B16R0.274 CCCCCCCCOCCCCOC(=O)C 7a_100000210232_100000033659 [0,1,1,0,0,0|2,0,0]=4 2529 B16R0.274 CCCCCCCCOCCCCSC(=O)C 34a_100000210232_200010402107 [0,1,1,0,0,0|2,0,0]=4 2530 B16R0.274 CCCCCCCCOCCCCSC(=O)C 7a_100000210232_200010402107 [0,1,1,0,0,0|2,0,0]=4 2531 B16R0.274 CCCCCCCCSCCCCCB(O)O 62a_100000210759_200009817188 [0,1,1,0,0,0|1,0,1]=4 2532 B16R0.274 CCCCCCCCSCCCCCB(O)O 62a_200009817188_100000210317 [0,1,1,0,0,0|1,0,1]=4 2533 B16R0.274 CCCCCCCCSCCCCCC(=O)N 62a_100000210759_100009817443 [0,1,1,0,0,0|1,0,0]=3 2534 B16R0.274 CCCCCCCCSCCCCCC(=O)N 62a_100009817443_100000210317 [0,1,1,0,0,0|1,0,0]=3 2535 B16R0.274 CCCCCCCCSCCCCOC(=O)C 62a_100000033659_100000210317 [0,1,1,0,0,0|2,0,0]=4 2536 B16R0.274 CCCCCCCCSCCCCOC(=O)C 62a_100000210759_100000033659 [0,1,1,0,0,0|2,0,0]=4 2537 B16R0.274 CCCCCCCCSCCCCSC(=O)C 62a_100000210759_200010402107 [0,1,1,0,0,0|2,0,0]=4 2538 B16R0.274 CCCCCCCCSCCCCSC(=O)C 62a_200010402107_100000210317 [0,1,1,0,0,0|2,0,0]=4 2539 B16R0.274 CCCCCCCNCCCCCCB(O)O 2230a_100000229938_100009817187 [0,1,1,0,0,0|1,0,1]=4 2540 B16R0.274 CCCCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210681 [0,1,1,0,0,0|2,0,0]=4 2541 B16R0.274 CCCCCCCNCCCCCNC(=O)C 34a_200012022750_100000210614 [0,1,1,0,0,0|2,0,0]=4 2542 B16R0.274 CCCCCCCNCCCCCOC(=O)C 2230a_100000229938_100009813381 [0,1,1,0,0,0|2,0,0]=4 2543 B16R0.274 CCCCCCCOCCCCCCB(O)O 34a_100000210272_100009817187 [0,1,1,0,0,0|1,0,1]=4 2544 B16R0.274 CCCCCCCOCCCCCCB(O)O 7a_100000210272_100009817187 [0,1,1,0,0,0|1,0,1]=4 2545 B16R0.274 CCCCCCCOCCCCCOC(=O)C 34a_100000210272_100000033007 [0,1,1,0,0,0|2,0,0]=4 2546 B16R0.274 CCCCCCCOCCCCCOC(=O)C 7a_100000210272_100000033007 [0,1,1,0,0,0|2,0,0]=4 2547 B16R0.274 CCCCCCCSCCCCCCB(O)O 62a_100000210614_100009817187 [0,1,1,0,0,0|1,0,1]=4 2548 B16R0.274 CCCCCCCSCCCCCCB(O)O 62a_100009817187_100000210316 [0,1,1,0,0,0|1,0,1]=4 2549 B16R0.274 CCCCCCCSCCCCCOC(=O)C 62a_100000033007_100000210316 [0,1,1,0,0,0|2,0,0]=4 2550 B16R0.274 CCCCCCCSCCCCCOC(=O)C 62a_100000210614_100000033007 [0,1,1,0,0,0|2,0,0]=4 2551 B16R0.274 CCCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210314 [0,1,1,0,0,0|2,0,0]=4 2552 B16R0.274 CCCCCCNCCCCCCNC(=O)C 34a_200011996284_100000210314 [0,1,1,0,0,0|2,0,0]=4 2553 B16R0.274 CCCCCCNCCOCCOCC(=O)O 269956a_100009854275_100000210757 [0,1,1,0,0,0|2,0,0]=4 2554 B16R0.274 CCCCCCOCCOCCCCC(=O)C 34a_100000691444_100009817362 [0,1,1,0,0,0|2,0,0]=4 2555 B16R0.274 CCCCCCOCCOCCCCC(=O)C 7a_100000691444_100000735457 [0,1,1,0,0,0|2,0,0]=4 2556 B16R0.274 CCCCCNCCOCCCCCC(=O)N 34a_100000224656_100009817443 [0,1,1,0,0,0|2,0,0]=4 2557 B16R0.274 CCCCCOCCOCCCCCC(=O)N 34a_100011215259_100009817443 [0,1,1,0,0,0|2,0,0]=4 2558 B16R0.274 CCCCCOCCOCCCCCC(=O)N 7a_100011215259_100009817443 [0,1,1,0,0,0|2,0,0]=4 2559 B16R0.274 CCCCNCCCCOCCCCC(=O)C 34a_200011216965_100009817362 [0,1,1,0,0,0|2,0,0]=4 2560 B16R0.274 CCCCOCCCCOCCCCC(=O)C 34a_200000760531_100009817362 [0,1,1,0,0,0|2,0,0]=4 2561 B16R0.274 CCCCOCCCCOCCCCC(=O)C 7a_200000760531_100000735457 [0,1,1,0,0,0|2,0,0]=4 2562 B16R0.274 CCCCOCCCNCCCCCC(=O)N 2230a_200000211371_100009817443 [0,1,1,0,0,0|2,0,0]=4 2563 B16R0.274 CCCCOCCCNCCCCCC(=O)N 34a_200000211371_100009817443 [0,1,1,0,0,0|2,0,0]=4 2564 B16R0.274 CCCCOCCCOCCCCCC(=O)N 34a_200011215613_100009817443 [0,1,1,0,0,0|2,0,0]=4 2565 B16R0.274 CCCCOCCCOCCCCCC(=O)N 7a_200011215613_100009817443 [0,1,1,0,0,0|2,0,0]=4 2566 B16R0.274 CCCOCCCCCCCCCCC(=O)N 34a_100000210258_200010167045 [0,1,1,0,0,0|1,0,0]=3 2567 B16R0.274 CCCSCCCCCCCCCCC(=O)N 62a_100000210303_200010167045 [0,1,1,0,0,0|1,0,0]=3 2568 B16R0.274 CCCSCCCCCCCCCCC(=O)N 62a_200010167045_100000210303 [0,1,1,0,0,0|1,0,0]=3 2569 B16R0.274 CCOCCCCCCCCCOCC(=O)N 34a_100009875440_100000187820 [0,1,1,0,0,0|2,0,0]=4 2570 B16R0.274 CCOCCCCCCCCCOCC(=O)N 7a_100009875440_100000187820 [0,1,1,0,0,0|2,0,0]=4 2571 B16R0.274 CCOCCCCCCCCCOCC(=O)[O-] 34a_100009875440_100020667443 [0,1,1,0,0,0|1,0,1]=4 2572 B16R0.274 CNCCCCCCCCCCCSC(=O)C 2230a_106832991635_100010140907 [0,1,1,0,0,0|2,0,0]=4 2573 B16R0.274 CNCCCCCCCCCCCSC(=O)C 34a_100102657272_100010140907 [0,1,1,0,0,0|2,0,0]=4 2574 B16R0.274 CNCCCCCCCCCCCSC(=O)C 7a_106832991635_100010140907 [0,1,1,0,0,0|2,0,0]=4 2575 B16R0.274 COCCCCCCCCCCCSC(=O)C 34a_100138415774_100010140907 [0,1,1,0,0,0|2,0,0]=4 2576 B16R0.274 COCCCCCCOCCCCCC(=O)N 34a_100000123541_100011998445 [0,1,1,0,0,0|2,0,0]=4 2577 B16R0.274 COCCCCCCOCCCCCC(=O)N 34a_200012092642_100009817443 [0,1,1,0,0,0|2,0,0]=4 2578 B16R0.274 COCCCCCCOCCCCCC(=O)N 7a_100000123541_100011998445 [0,1,1,0,0,0|2,0,0]=4 2579 B16R0.274 COCCCCCCOCCCCCC(=O)N 7a_200012092642_100009817443 [0,1,1,0,0,0|2,0,0]=4 2580 B16R0.274 COCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100011998445 [0,1,1,0,0,0|1,0,1]=4 2581 B16R0.274 COCCCCCCSCCCCCC(=O)N 62a_100009817443_100011998445 [0,1,1,0,0,0|2,0,0]=4 2582 B16R0.274 COCCCCCCSCCCCCC(=O)N 62a_100011998445_100009817443 [0,1,1,0,0,0|2,0,0]=4 2583 B16R0.274 COCSCCCCCCCCCCC(=O)N 62a_100000766300_200010167045 [0,1,1,0,0,0|2,0,0]=4 2584 B16R0.274 COCSCCCCCCCCCCC(=O)N 62a_200010167045_100000766300 [0,1,1,0,0,0|2,0,0]=4 2585 B16R0.274 CSCCCCCCCCCCCSC(=O)C 62a_100010140907_200000210301 [0,1,1,0,0,0|2,0,0]=4 2586 B16R0.274 CSCCCCCCCCCCCSC(=O)C 62a_200000210301_100010140907 [0,1,1,0,0,0|2,0,0]=4 2587 B16R0.274 CSCSCCCCCCCCCCC(=O)N 62a_100011218213_200010167045 [0,1,1,0,0,0|2,0,0]=4 2588 B16R0.274 CSCSCCCCCCCCCCC(=O)N 62a_200010167045_100011218213 [0,1,1,0,0,0|2,0,0]=4 2589 B16R0.274 NC(=O)CCCCCCCCCCNCCF 34a_100000724931_200010167045 [0,1,1,0,0,0|2,0,0]=4 2590 B16R0.274 NC(=O)CCCCCCCCCCNCCO 2230a_100016997473_200010167045 [0,1,1,0,0,0|2,0,0]=4 2591 B16R0.274 NC(=O)CCCCCCCCCCNCCO 34a_100016990907_200010167045 [0,1,1,0,0,0|2,0,0]=4 2592 B16R0.274 NC(=O)CCCCCCCCCCOCCBr 34a_100000211926_200010167045 [0,1,1,0,0,0|2,0,0]=4 2593 B16R0.274 NC(=O)CCCCCCCCCCSCCF 62a_100011217306_200010167045 [0,1,1,0,0,0|2,0,0]=4 2594 B16R0.274 NC(=O)CCCCCCCCCCSCCF 62a_200010167045_100011217306 [0,1,1,0,0,0|2,0,0]=4 2595 B16R0.274 NC(=O)CCCCCCCCCCSCCO 62a_100000211926_200010167045 [0,1,1,0,0,0|2,0,0]=4 2596 B16R0.274 NC(=O)CCCCCCCCCCSCCO 62a_200010167045_100000211926 [0,1,1,0,0,0|2,0,0]=4 2597 B16R0.274 NC(=O)CCCCCNCCCCCCCO 2230a_100011996573_100009817443 [0,1,1,0,0,0|2,0,0]=4 2598 B16R0.274 NC(=O)CCCCCNCCCCCCCO 34a_100011996573_100009817443 [0,1,1,0,0,0|2,0,0]=4 2599 B16R0.274 NC(=O)CCCCCOCCCCCCCBr 34a_100000760002_100009817443 [0,1,1,0,0,0|2,0,0]=4 2600 B16R0.274 NC(=O)CCCCCOCCCCCCCBr 7a_100000760002_100009817443 [0,1,1,0,0,0|2,0,0]=4 2601 B16R0.274 NC(=O)CCCCCOCCCCCCCO 34a_100000123541_100000760002 [0,1,1,0,0,0|2,0,0]=4 2602 B16R0.274 NC(=O)CCCCCOCCCCCCCO 7a_100000123541_100000760002 [0,1,1,0,0,0|2,0,0]=4 2603 B16R0.274 NC(=O)CCCCCSCCCCCCCO 62a_100000760002_100009817443 [0,1,1,0,0,0|2,0,0]=4 2604 B16R0.274 NC(=O)CCCCCSCCCCCCCO 62a_100009817443_100000760002 [0,1,1,0,0,0|2,0,0]=4 2605 B16R0.274 NC(=O)CCCCNCCCCCCCCO 34a_100000696515_100000033203 [0,1,1,0,0,0|2,0,0]=4 2606 B16R0.274 NC(=O)CCCCOCCCCCCCCO 34a_100012022536_100000033203 [0,1,1,0,0,0|2,0,0]=4 2607 B16R0.274 NC(=O)CCCCOCCCCCCCCO 7a_100012022536_100000033203 [0,1,1,0,0,0|2,0,0]=4 2608 B16R0.274 NC(=O)CCCNCCCCCCCCCO 34a_100000078944_100102525003 [0,1,1,0,0,0|2,0,0]=4 2609 B16R0.274 NC(=O)CCCNCCCCCCCCCO 34a_100000739312_100009813782 [0,1,1,0,0,0|2,0,0]=4 2610 B16R0.274 NC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100102525003 [0,1,1,0,0,0|2,0,0]=4 2611 B16R0.274 NC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100102525003 [0,1,1,0,0,0|2,0,0]=4 2612 B16R0.274 NC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100102525003 [0,1,1,0,0,0|2,0,0]=4 2613 B16R0.274 NC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100102525003 [0,1,1,0,0,0|2,0,0]=4 2614 B16R0.274 NC(=O)CCCSCCCCCCCCCO 62a_100009813782_100102525003 [0,1,1,0,0,0|2,0,0]=4 2615 B16R0.274 NC(=O)CCCSCCCCCCCCCO 62a_100102525003_100009813782 [0,1,1,0,0,0|2,0,0]=4 2616 B16R0.274 NC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100000744528 [0,1,1,0,0,0|2,0,0]=4 2617 B16R0.274 NC(=O)CCNCCCCCCCCCCO 34a_100000066964_100000731001 [0,1,1,0,0,0|2,0,0]=4 2618 B16R0.274 NC(=O)CCOCCCCCCCCCCBr 34a_100009813290_100000731001 [0,1,1,0,0,0|2,0,0]=4 2619 B16R0.274 NC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000744528 [0,1,1,0,0,0|2,0,0]=4 2620 B16R0.274 NC(=O)CCOCCCCCCCCCCCl 34a_200000033068_100000731001 [0,1,1,0,0,0|2,0,0]=4 2621 B16R0.274 NC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000744528 [0,1,1,0,0,0|2,0,0]=4 2622 B16R0.274 NC(=O)CCOCCCCCCCCCCO 34a_100000757172_100009813290 [0,1,1,0,0,0|2,0,0]=4 2623 B16R0.274 NC(=O)CCOCCCCCCCCCCO 7a_100000757172_100009813290 [0,1,1,0,0,0|2,0,0]=4 2624 B16R0.274 NC(=O)CCSCCCCCCCCCCO 62a_100000744528_200000033068 [0,1,1,0,0,0|2,0,0]=4 2625 B16R0.274 NC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000744528 [0,1,1,0,0,0|2,0,0]=4 2626 B16R0.274 NC(=O)CNCCCCCCCCCCCO 2230a_100000711301_100009812471 [0,1,1,0,0,0|2,0,0]=4 2627 B16R0.274 NC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000187820 [0,1,1,0,0,0|2,0,0]=4 2628 B16R0.274 NC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000187820 [0,1,1,0,0,0|2,0,0]=4 2629 B16R0.274 NC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000747473 [0,1,1,0,0,0|2,0,0]=4 2630 B16R0.274 NCCCCCCCCCCOCCC(=O)N 34a_100000066964_100000731001 [0,1,1,0,0,0|2,0,0]=4 2631 B16R0.274 NCCCCCCCCCOCCCC(=O)N 34a_100000078944_100102525003 [0,1,1,0,0,0|2,0,0]=4 2632 B16R0.274 NCCCCCCCOCCCCCC(=O)N 34a_100011996573_100009817443 [0,1,1,0,0,0|2,0,0]=4 2633 B16R0.274 NCCOCCCCCCCCCCC(=O)N 34a_100000210304_200010167045 [0,1,1,0,0,0|2,0,0]=4 2634 B16R0.274 O=C(O)CNCCCCCCCCCCCO 269956a_100016091260_100009812471 [0,1,1,0,0,0|1,0,0]=3 2635 B16R0.274 O=C(O)COCCNCCCCCCCCO 269956a_100000700818_100000033203 [0,1,1,0,0,0|2,0,0]=4 2636 B16R0.274 O=C(O)CONCCCCCCCCCCO 269956a_100000106656_100009813290 [0,1,1,0,0,0|2,0,0]=4 2637 B16R0.274 O=C([O-])CCCCCOCCCCCCCO 7a_100102619762_100000760002 [0,1,1,0,0,0|1,0,1]=4 2638 B16R0.274 O=C([O-])COCCCCCCCCCCCBr 34a_100009812471_100020667443 [0,1,1,0,0,0|1,0,1]=4 2639 B16R0.274 O=C([O-])CSCCCCCCCCCCCO 62a_100009812471_100020667443 [0,1,1,0,0,0|1,0,1]=4 2640 B16R0.297 CCCCCCCCCC(=O)CCCC(=O)C 1458a_100000210558_100011215641 [0,1,1,0,0,0|1,0,1]=4 2641 B16R0.297 CCCCCCCCCC(=O)CCCC(=O)N 1458a_100000210558_100102525003 [0,1,1,0,0,0|1,0,1]=4 2642 B16R0.297 CCCCCCCCCC(C)OCCC(=O)C 7a_100011218016_100000053229 [0,1,1,0,0,0|2,0,0]=4 2643 B16R0.297 CCCCCCCCCC(C)OCCC(=O)N 34a_100011218016_100000731001 [0,1,1,0,0,0|2,0,0]=4 2644 B16R0.297 CCCCCCCCCC(C)OCCC(=O)N 7a_100011218016_100000744528 [0,1,1,0,0,0|2,0,0]=4 2645 B16R0.297 CCCCCCCCCN(C)CCCC(=O)C 269982a_100000232482_100011215641 [0,1,1,0,0,0|2,0,0]=4 2646 B16R0.297 CCCCCCCCCN(C)CCCC(=O)N 269982a_100000232482_100102525003 [0,1,1,0,0,0|2,0,0]=4 2647 B16R0.297 CCCCCCCCCN(C)CCCC(=O)O 269956a_100000719178_100000210670 [0,1,1,0,0,0|1,0,0]=3 2648 B16R0.297 CCCCCCCCOC(C)CCCC(=O)[O-] 7a_100000761597_100000210759 [0,1,1,0,0,0|1,0,1]=4 2649 B16R0.297 CN(CCCCCCCCO)CCCC(=O)O 269956a_100000719178_100000033203 [0,1,1,0,0,0|2,0,0]=4 2650 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)N 1458a_100000210736_100000187820 [0,1,1,0,0,0|1,0,1]=4 2651 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)N 1458a_100134613110_100011215454 [0,1,1,0,0,0|1,0,1]=4 2652 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)[O-] 1458a_100000210736_100020667443 [0,1,1,0,0,0|0,0,2]=4 2653 B16R0.302 CCCCCCCCCCCN(C)CC(=O)N 2230a_100000739694_100011215454 [0,1,1,0,0,0|2,0,0]=4 2654 B16R0.302 CCCCCCCCCCCN(C)CC(=O)O 269956a_100000746989_100011215454 [0,1,1,0,0,0|1,0,0]=3 2655 B16R0.302 CCCCCCCCCNCC(O)CC(=O)O 269956a_100011218706_100000210670 [0,1,1,0,0,0|1,0,0]=3 2656 B16R0.302 CN(CCCCCCCCCCO)CC(=O)O 269956a_100000746989_100009813290 [0,1,1,0,0,0|2,0,0]=4 2657 B16R0.302 O=C(O)CC(O)CNCCCCCCCCO 269956a_100011218706_100000033203 [0,1,1,0,0,0|2,0,0]=4 2658 B16R0.1820 CCCCCCCCC(=O)CCCCC(=O)C 1458a_100000210188_100000735457 [0,1,1,0,0,0|1,0,1]=4 2659 B16R0.1820 CCCCCCCCC(C)COCCC(=O)C 7a_200012125181_100000053229 [0,1,1,0,0,0|2,0,0]=4 2660 B16R0.1820 CCCCCCCCC(C)COCCC(=O)N 34a_200012125181_100000731001 [0,1,1,0,0,0|2,0,0]=4 2661 B16R0.1820 CCCCCCCCC(C)COCCC(=O)N 7a_200012125181_100000744528 [0,1,1,0,0,0|2,0,0]=4 2662 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)C 34a_100000210740_100000685027 [0,1,1,0,0,0|2,0,0]=4 2663 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)C 7a_100000210740_100011215641 [0,1,1,0,0,0|2,0,0]=4 2664 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)N 34a_100000210740_100102525003 [0,1,1,0,0,0|2,0,0]=4 2665 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)N 7a_100000210740_100102525003 [0,1,1,0,0,0|2,0,0]=4 2666 B16R0.1820 CCCCCCCCN(C)CCCCC(=O)C 269982a_100000207567_100000735457 [0,1,1,0,0,0|2,0,0]=4 2667 B16R0.3183 CCCCCCCCCCC(=O)CCC(=O)N 1458a_100011215257_100000210319 [0,1,1,0,0,0|1,0,1]=4 2668 B16R0.3183 CCCCCCCCCCC(C)OCC(=O)N 34a_100011215000_100000187820 [0,1,1,0,0,0|2,0,0]=4 2669 B16R0.3183 CCCCCCCCCCC(C)OCC(=O)N 7a_100011215000_100000187820 [0,1,1,0,0,0|2,0,0]=4 2670 B16R0.3183 CCCCCCCCCCC(C)OCC(=O)[O-] 34a_100011215000_100020667443 [0,1,1,0,0,0|1,0,1]=4 2671 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)C 269982a_100000207566_100000053229 [0,1,1,0,0,0|2,0,0]=4 2672 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)N 2230a_100000207566_100000744528 [0,1,1,0,0,0|2,0,0]=4 2673 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)N 2230a_100000730477_100000210320 [0,1,1,0,0,0|2,0,0]=4 2674 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)N 269982a_100000207566_100000744528 [0,1,1,0,0,0|2,0,0]=4 2675 B16R0.3288 CC(=O)CCCCNCCCCCCC(C)C 34a_100000211014_100009817362 [0,1,1,0,0,0|2,0,0]=4 2676 B16R0.3288 CC(=O)CCCOCCCCCCCC(C)C 34a_200000210741_100000685027 [0,1,1,0,0,0|2,0,0]=4 2677 B16R0.3288 CC(=O)CCCOCCCCCCCC(C)C 7a_200000210741_100011215641 [0,1,1,0,0,0|2,0,0]=4 2678 B16R0.3288 CC(C)CCCCCCCOCCCC(=O)N 34a_200000210741_100102525003 [0,1,1,0,0,0|2,0,0]=4 2679 B16R0.3288 CC(C)CCCCCCCOCCCC(=O)N 7a_200000210741_100102525003 [0,1,1,0,0,0|2,0,0]=4 2680 B16R0.3288 CC(C)CCCCCNCCCCCC(=O)N 2230a_100011290863_100009817443 [0,1,1,0,0,0|2,0,0]=4 2681 B16R0.3288 CC(C)CCCCCNCCCCCC(=O)N 34a_100011290863_100009817443 [0,1,1,0,0,0|2,0,0]=4 2682 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 34a_100000123541_100000210682 [0,1,1,0,0,0|2,0,0]=4 2683 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 34a_100011995859_100009817443 [0,1,1,0,0,0|2,0,0]=4 2684 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 7a_100000123541_100000210682 [0,1,1,0,0,0|2,0,0]=4 2685 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 7a_100011995859_100009817443 [0,1,1,0,0,0|2,0,0]=4 2686 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210682 [0,1,1,0,0,0|1,0,1]=4 2687 B16R0.3288 CC(C)CCCCCSCCCCCC(=O)N 62a_100000210682_100009817443 [0,1,1,0,0,0|2,0,0]=4 2688 B16R0.3288 CC(C)CCCCCSCCCCCC(=O)N 62a_100009817443_100000210682 [0,1,1,0,0,0|2,0,0]=4 2689 B16R0.3288 CC(C)NCCCCCCCCCCC(=O)N 2230a_100138425928_200010167045 [0,1,1,0,0,0|2,0,0]=4 2690 B16R0.3288 CC(C)NCCCCCCCCCCC(=O)N 34a_100138425928_200010167045 [0,1,1,0,0,0|2,0,0]=4 2691 B16R0.3288 CC(C)OCCCCCCCCCCC(=O)N 34a_100000212225_200010167045 [0,1,1,0,0,0|2,0,0]=4 2692 B16R0.3288 CC(C)SCCCCCCCCCCC(=O)N 62a_100000210206_200010167045 [0,1,1,0,0,0|2,0,0]=4 2693 B16R0.3288 CC(C)SCCCCCCCCCCC(=O)N 62a_200010167045_100000210206 [0,1,1,0,0,0|2,0,0]=4 2694 B16R0.68 CCCCCCCCCCN(C)CCCC=O 2230a_100000207566_200011292268 [0,1,1,0,0,0|2,0,0]=4 2695 B16R0.68 CCCCCCCCCCN(C)CCCC=O 269982a_100000207566_200011292268 [0,1,1,0,0,0|2,0,0]=4 2696 B16R0.6603 C=CCCCNC(C)CCCCCCCCC 270004a_100000700776_100011215753 [0,1,1,0,0,0|2,0,0]=4 2697 B16R0.6603 C=CCCCOC(C)CCCCCCCCC 34a_100011218016_100000757094 [0,1,1,0,0,0|2,0,0]=4 2698 B16R0.6603 C=CCCCOC(C)CCCCCCCCC 7a_100011218016_100000757094 [0,1,1,0,0,0|2,0,0]=4 2699 B16R0.6603 C=CCCNCC(C)CCCCCCCCC 270004a_100015191253_200011218516 [0,1,1,0,0,0|2,0,0]=4 2700 B16R0.6603 CCCCCCCCCC(C)OCCCC=O 7a_100011218016_200011292268 [0,1,1,0,0,0|1,0,0]=3 2701 B16R0.6603 CCCCCCCCCN(C)CCCCC=O 2230a_100000232482_100000139335 [0,1,1,0,0,0|2,0,0]=4 2702 B16R0.6603 CCCCCCCCCN(C)CCCCC=O 269982a_100000232482_100000139335 [0,1,1,0,0,0|2,0,0]=4 2703 B16R0.61 C#CCCCCCCCCOCC(=O)CCC 7a_100000065265_100000747444 [0,1,1,0,0,0|0,0,2]=4 2704 B16R0.61 C#CCCCCCCCOCOC(=O)CCC 34a_100000054614_100000034017 [0,1,1,0,0,0|0,0,2]=4 2705 B16R0.61 C#CCCCCCCCSCOC(=O)CCC 62a_100153394163_100000034017 [0,1,1,0,0,0|0,0,2]=4 2706 B16R0.61 C=CCCCCCCCCCCC(=O)CCC 1458a_100000211992_100011093070 [0,1,1,0,0,0|1,0,1]=4 2707 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 11a_100000081888_100000211992 [0,1,1,0,0,0|1,0,1]=4 2708 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 1626a_100000081888_100000211992 [0,1,1,0,0,0|1,0,1]=4 2709 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 240690a_100000081888_100000211992 [0,1,1,0,0,0|1,0,1]=4 2710 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 527a_100000081888_100000211992 [0,1,1,0,0,0|1,0,1]=4 2711 B16R0.61 C=CCCCCCCCCOCC(=O)CCC 7a_100011215194_100000747444 [0,1,1,0,0,0|0,0,2]=4 2712 B16R0.61 C=CCCCCCCCOCOC(=O)CCC 34a_100000730831_100000034017 [0,1,1,0,0,0|0,0,2]=4 2713 B16R0.61 C=CCCCCCCCSCOC(=O)CCC 62a_100012355270_100000034017 [0,1,1,0,0,0|0,0,2]=4 2714 B16R0.61 CC/C=C\CCCCCOCOC(=O)CCC 34a_100016268722_100000034017 [0,1,1,0,0,0|0,0,2]=4 2715 B16R0.61 CCCC(=O)CCCCCCCCCCCO 1458a_100000211992_100009812471 [0,1,1,0,0,0|1,0,0]=3 2716 B16R0.61 CCCC(=O)CNCCCCCCCCCO 2230a_100000078944_100000747444 [0,1,1,0,0,0|2,0,0]=4 2717 B16R0.61 CCCC(=O)COCCCCCCCCCBr 7a_100009813782_100000747444 [0,1,1,0,0,0|1,0,0]=3 2718 B16R0.61 CCCC(=O)COCCCCCCCCCCl 7a_100009868337_100000747444 [0,1,1,0,0,0|1,0,0]=3 2719 B16R0.61 CCCC(=O)CSCCCCCCCCCO 62a_100000747444_100009813782 [0,1,1,0,0,0|1,1,0]=4 2720 B16R0.61 CCCC(=O)CSCCCCCCCCCO 62a_100009813782_100000747444 [0,1,1,0,0,0|1,1,0]=4 2721 B16R0.61 CCCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000211992 [0,1,1,0,0,0|1,0,0]=3 2722 B16R0.61 CCCC(=O)OCNCCCCCCCCO 2230a_102515433106_100000034017 [0,1,1,0,0,0|1,0,0]=3 2723 B16R0.61 CCCC(=O)OCNCCCCCCCCO 34a_102515433106_100000034017 [0,1,1,0,0,0|1,0,0]=3 2724 B16R0.61 CCCC(=O)OCOCCCCCCCCBr 34a_100009813846_100000034017 [0,1,1,0,0,0|1,0,0]=3 2725 B16R0.61 CCCC(=O)OCOCCCCCCCCCl 34a_100000033203_100000034017 [0,1,1,0,0,0|1,0,0]=3 2726 B16R0.61 CCCC(=O)OCOCCCCCCCCN 34a_102515433106_100000034017 [0,1,1,0,0,0|1,0,0]=3 2727 B16R0.61 CCCC(=O)OCOCCCCCNCCN 34a_103619048469_100000034017 [0,1,1,0,0,0|2,0,0]=4 2728 B16R0.61 CCCC(=O)OCOCCCOCCCOC 34a_200011215475_100000034017 [0,1,1,0,0,0|2,0,0]=4 2729 B16R0.61 CCCC(=O)OCSCCCCCCCCO 62a_100000033203_100000034017 [0,1,1,0,0,0|1,0,0]=3 2730 B16R0.61 CCCC(C)OCCCCCCCCCCBr 34a_100009813290_100000766640 [0,1,1,0,0,0|1,0,1]=4 2731 B16R0.61 CCCC(C)OCCCCCCCCCCBr 7a_100009813290_100000766640 [0,1,1,0,0,0|1,0,1]=4 2732 B16R0.61 CCCC(C)OCCCCCCCCCCCl 34a_200000033068_100000766640 [0,1,1,0,0,0|1,0,1]=4 2733 B16R0.61 CCCC(C)OCCCCCCCCCCCl 7a_200000033068_100000766640 [0,1,1,0,0,0|1,0,1]=4 2734 B16R0.61 CCCC(C)OCCCCCCCCCCN 34a_100000066964_100000766640 [0,1,1,0,0,0|1,0,1]=4 2735 B16R0.61 CCCC(C)OCCCCCCCCCCO 34a_100000764384_100009813290 [0,1,1,0,0,0|1,0,1]=4 2736 B16R0.61 CCCC(C)OCCCCCCCCCCO 7a_100000764384_100009813290 [0,1,1,0,0,0|1,0,1]=4 2737 B16R0.61 CCCC/C=C/CCCCOCC(=O)CCC 7a_200020645093_100000747444 [0,1,1,0,0,0|0,0,2]=4 2738 B16R0.61 CCCCC#CCCCCCCC(=O)CCC 1458a_100000211992_200000043322 [0,1,1,0,0,0|1,0,1]=4 2739 B16R0.61 CCCCC#CCCCCOCC(=O)CCC 7a_200000066234_100000747444 [0,1,1,0,0,0|0,0,2]=4 2740 B16R0.61 CCCCC#CCCCSCOC(=O)CCC 62a_200000047210_100000034017 [0,1,1,0,0,0|0,0,2]=4 2741 B16R0.61 CCCCC/C=C\CCCOCC(=O)CCC 7a_100020655193_100000747444 [0,1,1,0,0,0|0,0,2]=4 2742 B16R0.61 CCCCC/C=C\CCOCOC(=O)CCC 34a_100016277358_100000034017 [0,1,1,0,0,0|0,0,2]=4 2743 B16R0.61 CCCCCC#CCCOCOC(=O)CCC 34a_200000042877_100000034017 [0,1,1,0,0,0|0,0,2]=4 2744 B16R0.61 CCCCCC/C=C/COCOC(=O)CCC 34a_200016276170_100000034017 [0,1,1,0,0,0|0,0,2]=4 2745 B16R0.61 CCCCCCC#CCCOCC(=O)CCC 7a_200000033163_100000747444 [0,1,1,0,0,0|0,0,2]=4 2746 B16R0.61 CCCCCCC#CCOCOC(=O)CCC 34a_200000037284_100000034017 [0,1,1,0,0,0|0,0,2]=4 2747 B16R0.61 CCCCCCCC#CCOCC(=O)CCC 7a_200000061759_100000747444 [0,1,1,0,0,0|0,0,2]=4 2748 B16R0.61 CCCCCCCCCC=NNC(=O)CCC 4a_100000189770_100000210895 [0,1,1,0,0,0|1,0,1]=4 2749 B16R0.61 CCCCCCCCCCC=CC(=O)NCC 11a_100015525214_100015291182 [0,1,1,0,0,0|2,0,0]=4 2750 B16R0.61 CCCCCCCCCCC=CC(=O)NCC 240690a_100015525214_100015291182 [0,1,1,0,0,0|2,0,0]=4 2751 B16R0.61 CCCCCCCCCCCCC(=O)CCC 1458a_100000211992_100000759014 [0,1,1,0,0,0|1,0,0]=3 2752 B16R0.61 CCCCCCCCCCCCC(=O)CCC 1458a_100011215791_100000210303 [0,1,1,0,0,0|1,0,0]=3 2753 B16R0.61 CCCCCCCCCCCCC(=O)CCF 1458a_100011215791_100011217306 [0,1,1,0,0,0|2,0,0]=4 2754 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011215791_100000211926 [0,1,1,0,0,0|2,0,0]=4 2755 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011216618_100000759014 [0,1,1,0,0,0|2,0,0]=4 2756 B16R0.61 CCCCCCCCCCCCC(=O)COC 1458a_100000210968_100000759014 [0,1,1,0,0,0|2,0,0]=4 2757 B16R0.61 CCCCCCCCCCCCC(=O)CSC 1458a_100000184570_100000759014 [0,1,1,0,0,0|2,0,0]=4 2758 B16R0.61 CCCCCCCCCCCCC(=O)NCC 11a_100015525214_100011215791 [0,1,1,0,0,0|2,0,0]=4 2759 B16R0.61 CCCCCCCCCCCCC(=O)NCC 240690a_100015525214_100011215791 [0,1,1,0,0,0|2,0,0]=4 2760 B16R0.61 CCCCCCCCCCCNC(=O)CCC 11a_200011215754_100000211992 [0,1,1,0,0,0|1,0,0]=3 2761 B16R0.61 CCCCCCCCCCCNC(=O)CCC 1626a_200011215754_100000211992 [0,1,1,0,0,0|1,0,0]=3 2762 B16R0.61 CCCCCCCCCCCNC(=O)CCC 240690a_200011215754_100000211992 [0,1,1,0,0,0|1,0,0]=3 2763 B16R0.61 CCCCCCCCCCCNC(=O)CCC 527a_200011215754_100000211992 [0,1,1,0,0,0|1,0,0]=3 2764 B16R0.61 CCCCCCCCCCCNC(=O)CCO 240690a_200011215754_100011216618 [0,1,1,0,0,0|2,0,0]=4 2765 B16R0.61 CCCCCCCCCCCNC(=O)COC 11a_200011215754_100000210968 [0,1,1,0,0,0|2,0,0]=4 2766 B16R0.61 CCCCCCCCCCCNC(=O)COC 1626a_200011215754_100000210968 [0,1,1,0,0,0|2,0,0]=4 2767 B16R0.61 CCCCCCCCCCCNC(=O)COC 240690a_200011215754_100000210968 [0,1,1,0,0,0|2,0,0]=4 2768 B16R0.61 CCCCCCCCCCCNC(=O)COC 527a_200011215754_100000210968 [0,1,1,0,0,0|2,0,0]=4 2769 B16R0.61 CCCCCCCCCCCNC(=O)CSC 11a_200011215754_100000184570 [0,1,1,0,0,0|2,0,0]=4 2770 B16R0.61 CCCCCCCCCCCNC(=O)CSC 1626a_200011215754_100000184570 [0,1,1,0,0,0|2,0,0]=4 2771 B16R0.61 CCCCCCCCCCCNC(=O)CSC 240690a_200011215754_100000184570 [0,1,1,0,0,0|2,0,0]=4 2772 B16R0.61 CCCCCCCCCCCNC(=O)CSC 527a_200011215754_100000184570 [0,1,1,0,0,0|2,0,0]=4 2773 B16R0.61 CCCCCCCCCCCNC(=O)NCC 2708a_100015525214_200011215754 [0,1,1,0,0,0|2,0,0]=4 2774 B16R0.61 CCCCCCCCCCCNC(=O)NCC 2708a_200011215754_100015525214 [0,1,1,0,0,0|2,0,0]=4 2775 B16R0.61 CCCCCCCCCCCNC(=O)NCC 273464a_100015525214_200011215754 [0,1,1,0,0,0|2,0,0]=4 2776 B16R0.61 CCCCCCCCCCCNC(=O)NCC 273464a_200011215754_100015525214 [0,1,1,0,0,0|2,0,0]=4 2777 B16R0.61 CCCCCCCCCCCNC(=O)NCC 512a_100015525214_200011215754 [0,1,1,0,0,0|2,0,0]=4 2778 B16R0.61 CCCCCCCCCCCNC(=O)NCC 512a_200011215754_100015525214 [0,1,1,0,0,0|2,0,0]=4 2779 B16R0.61 CCCCCCCCCCCOC(C)CCC 34a_100000210809_100000766640 [0,1,1,0,0,0|1,0,1]=4 2780 B16R0.61 CCCCCCCCCCCOC(C)CCC 34a_100000764384_100011215454 [0,1,1,0,0,0|1,0,1]=4 2781 B16R0.61 CCCCCCCCCCCOC(C)CCC 7a_100000210809_100000766640 [0,1,1,0,0,0|1,0,1]=4 2782 B16R0.61 CCCCCCCCCCCOC(C)CCC 7a_100000764384_100011215454 [0,1,1,0,0,0|1,0,1]=4 2783 B16R0.61 CCCCCCCCCCNCC(=O)CCC 2230a_100000684558_100000747444 [0,1,1,0,0,0|1,0,0]=3 2784 B16R0.61 CCCCCCCCCCNCC(=O)NCC 2230a_100000684558_100000183381 [0,1,1,0,0,0|2,0,0]=4 2785 B16R0.61 CCCCCCCCCCNCC(=O)NCC 2230a_100016988866_100000210320 [0,1,1,0,0,0|2,0,0]=4 2786 B16R0.61 CCCCCCCCCCNCC(=O)NCC 34a_100000684558_100000183381 [0,1,1,0,0,0|2,0,0]=4 2787 B16R0.61 CCCCCCCCCCNCC(=O)OCC 2230a_100000684558_100000188475 [0,1,1,0,0,0|2,0,0]=4 2788 B16R0.61 CCCCCCCCCCNCC(=O)OCC 34a_100000684558_100000188475 [0,1,1,0,0,0|2,0,0]=4 2789 B16R0.61 CCCCCCCCCCOCC(=O)CCC 7a_100000210711_100000747444 [0,1,1,0,0,0|0,0,0]=2 2790 B16R0.61 CCCCCCCCCCOCC(=O)NCC 34a_100000210711_100000183381 [0,1,1,0,0,0|1,0,0]=3 2791 B16R0.61 CCCCCCCCCCOCC(=O)NCC 7a_100000210711_100000183381 [0,1,1,0,0,0|1,0,0]=3 2792 B16R0.61 CCCCCCCCCCOCC(=O)NCO 34a_100000210711_100000185155 [0,1,1,0,0,0|2,0,0]=4 2793 B16R0.61 CCCCCCCCCCOCC(=O)NCO 7a_100000210711_100000185155 [0,1,1,0,0,0|2,0,0]=4 2794 B16R0.61 CCCCCCCCCCOCC(=O)OCC 34a_100000210711_100000188475 [0,1,1,0,0,0|1,0,0]=3 2795 B16R0.61 CCCCCCCCCCOCC(=O)OCC 7a_100000210711_100000188475 [0,1,1,0,0,0|1,0,0]=3 2796 B16R0.61 CCCCCCCCCCOCC(C)CCC 34a_100000210711_100011216630 [0,1,1,0,0,0|1,0,1]=4 2797 B16R0.61 CCCCCCCCCCOCC(C)CCC 34a_100000688023_100000210320 [0,1,1,0,0,0|1,0,1]=4 2798 B16R0.61 CCCCCCCCCCOCC(C)CCC 7a_100000210711_100011216630 [0,1,1,0,0,0|1,0,1]=4 2799 B16R0.61 CCCCCCCCCCOCC(C)CCC 7a_100000688023_100000210320 [0,1,1,0,0,0|1,0,1]=4 2800 B16R0.61 CCCCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100000210320 [0,1,1,0,0,0|1,0,1]=4 2801 B16R0.61 CCCCCCCCCCSCC(=O)CCC 62a_100000747444_100000210320 [0,1,1,0,0,0|0,1,0]=3 2802 B16R0.61 CCCCCCCCCCSCC(=O)NCC 62a_100000183381_100000210320 [0,1,1,0,0,0|1,1,0]=4 2803 B16R0.61 CCCCCCCCCCSCC(=O)OCC 62a_100000188475_100000210320 [0,1,1,0,0,0|1,1,0]=4 2804 B16R0.61 CCCCCCCCCNCCC(=O)NCC 2230a_100000212291_100000737597 [0,1,1,0,0,0|2,0,0]=4 2805 B16R0.61 CCCCCCCCCNCCC(=O)NCC 34a_100025743525_100011214924 [0,1,1,0,0,0|2,0,0]=4 2806 B16R0.61 CCCCCCCCCNCCC(=O)OCC 2230a_100000212291_100011206558 [0,1,1,0,0,0|2,0,0]=4 2807 B16R0.61 CCCCCCCCCNCCC(=O)OCC 34a_100000212291_100000765890 [0,1,1,0,0,0|2,0,0]=4 2808 B16R0.61 CCCCCCCCCNCOC(=O)CCC 2230a_100000212291_100000034017 [0,1,1,0,0,0|0,0,0]=2 2809 B16R0.61 CCCCCCCCCNCOC(=O)CCC 34a_100000212291_100000034017 [0,1,1,0,0,0|0,0,0]=2 2810 B16R0.61 CCCCCCCCCOCCC(=O)NCC 7a_100000210712_100000737597 [0,1,1,0,0,0|2,0,0]=4 2811 B16R0.61 CCCCCCCCCOCCC(=O)OCC 34a_100000210712_100000765890 [0,1,1,0,0,0|2,0,0]=4 2812 B16R0.61 CCCCCCCCCOCCC(=O)OCC 7a_100000210712_100011206558 [0,1,1,0,0,0|2,0,0]=4 2813 B16R0.61 CCCCCCCCCOCOC(=O)CCC 34a_100000210712_100000034017 [0,1,1,0,0,0|0,0,0]=2 2814 B16R0.61 CCCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210670 [0,1,1,0,0,0|2,0,0]=4 2815 B16R0.61 CCCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210670 [0,1,1,0,0,0|2,0,0]=4 2816 B16R0.61 CCCCCCCCNCCCC(=O)OCC 2230a_100000229939_100009991533 [0,1,1,0,0,0|2,0,0]=4 2817 B16R0.61 CCCCCCCCNCCCC(=O)OCC 34a_100000229939_100009991533 [0,1,1,0,0,0|2,0,0]=4 2818 B16R0.61 CCCCCCCCOCCCC(=O)OCC 34a_100000210232_100009991533 [0,1,1,0,0,0|2,0,0]=4 2819 B16R0.61 CCCCCCCCOCCCC(=O)OCC 7a_100000210232_100011215271 [0,1,1,0,0,0|2,0,0]=4 2820 B16R0.61 CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210759 [0,1,1,0,0,0|2,0,0]=4 2821 B16R0.61 CCCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210759 [0,1,1,0,0,0|2,0,0]=4 2822 B16R0.61 CCCCCCCCOCCNC(=O)OCC 7a_100000210232_200011445536 [0,1,1,0,0,0|2,0,0]=4 2823 B16R0.61 CCCCCCCCSCCCC(=O)OCC 62a_100000210759_100009991533 [0,1,1,0,0,0|2,0,0]=4 2824 B16R0.61 CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210317 [0,1,1,0,0,0|2,0,0]=4 2825 B16R0.61 CCCCCCCCSCCNC(=O)OCC 62a_100000210759_200011445536 [0,1,1,0,0,0|2,0,0]=4 2826 B16R0.61 CCCCCCCNCCCCC(=O)OCC 2230a_100000229938_100000750268 [0,1,1,0,0,0|2,0,0]=4 2827 B16R0.61 CCCCCCCNCCOCC(=O)OCC 2230a_100000229938_100000088970 [0,1,1,0,0,0|2,0,0]=4 2828 B16R0.61 CCCCCCCOCCCCC(=O)OCC 34a_100000210272_100000750268 [0,1,1,0,0,0|2,0,0]=4 2829 B16R0.61 CCCCCCCOCCCCC(=O)OCC 7a_100000210272_100000750268 [0,1,1,0,0,0|2,0,0]=4 2830 B16R0.61 CCCCCCCOCCOCC(=O)OCC 34a_100000210272_100000088970 [0,1,1,0,0,0|2,0,0]=4 2831 B16R0.61 CCCCCCCOCCOCC(=O)OCC 7a_100000210272_100000088970 [0,1,1,0,0,0|2,0,0]=4 2832 B16R0.61 CCCCCCCSCCCCC(=O)OCC 62a_100000210614_100000750268 [0,1,1,0,0,0|2,0,0]=4 2833 B16R0.61 CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210316 [0,1,1,0,0,0|2,0,0]=4 2834 B16R0.61 CCCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210316 [0,1,1,0,0,0|2,0,0]=4 2835 B16R0.61 CCCCCCCSCCOCC(=O)OCC 62a_100000210614_100000088970 [0,1,1,0,0,0|2,0,0]=4 2836 B16R0.61 CCCCCCNCCCCCC(=O)OCC 2230a_100000210581_100000755133 [0,1,1,0,0,0|2,0,0]=4 2837 B16R0.61 CCCCCCNCCCOCC(=O)OCC 2230a_100000210581_100009893628 [0,1,1,0,0,0|2,0,0]=4 2838 B16R0.61 CCCCCCOCCCCCC(=O)OCC 34a_100000210259_100000755133 [0,1,1,0,0,0|2,0,0]=4 2839 B16R0.61 CCCCCCOCCCCCC(=O)OCC 7a_100000210259_100000755133 [0,1,1,0,0,0|2,0,0]=4 2840 B16R0.61 CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210314 [0,1,1,0,0,0|2,0,0]=4 2841 B16R0.61 CCCCCCOCCCOCC(=O)OCC 34a_100000210259_100009893628 [0,1,1,0,0,0|2,0,0]=4 2842 B16R0.61 CCCCCCOCCCOCC(=O)OCC 7a_100000210259_100009893628 [0,1,1,0,0,0|2,0,0]=4 2843 B16R0.61 CCCCCCOCCOCOC(=O)CCC 34a_100000691444_100000034017 [0,1,1,0,0,0|1,0,0]=3 2844 B16R0.61 CCCCCCSCCCCCC(=O)OCC 62a_100000210314_100000755133 [0,1,1,0,0,0|2,0,0]=4 2845 B16R0.61 CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210757 [0,1,1,0,0,0|2,0,0]=4 2846 B16R0.61 CCCCCCSCCCOCC(=O)OCC 62a_100000210314_100009893628 [0,1,1,0,0,0|2,0,0]=4 2847 B16R0.61 CCCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210757 [0,1,1,0,0,0|2,0,0]=4 2848 B16R0.61 CCCCCNCCCCCCC(=O)OCC 2230a_100000209983_100009814379 [0,1,1,0,0,0|2,0,0]=4 2849 B16R0.61 CCCCCOCCCCCCC(=O)OCC 34a_100000210253_100009814379 [0,1,1,0,0,0|2,0,0]=4 2850 B16R0.61 CCCCCOCCCCCCC(=O)OCC 7a_100000210253_100009814379 [0,1,1,0,0,0|2,0,0]=4 2851 B16R0.61 CCCCCSCCCCCCC(=O)OCC 62a_100000210326_100009814379 [0,1,1,0,0,0|2,0,0]=4 2852 B16R0.61 CCCCNCCCCCCCC(=O)OCC 2230a_100000102301_100009991516 [0,1,1,0,0,0|2,0,0]=4 2853 B16R0.61 CCCCNCCCCCCCC(=O)OCC 7a_106832991798_100009991516 [0,1,1,0,0,0|2,0,0]=4 2854 B16R0.61 CCCCNCCCCOCOC(=O)CCC 34a_200011216965_100000034017 [0,1,1,0,0,0|1,0,0]=3 2855 B16R0.61 CCCCOCCCCCCCC(=O)OCC 34a_100000210227_100009991516 [0,1,1,0,0,0|2,0,0]=4 2856 B16R0.61 CCCCOCCCCCCCC(=O)OCC 7a_100000210227_100009991516 [0,1,1,0,0,0|2,0,0]=4 2857 B16R0.61 CCCCOCCCCOCOC(=O)CCC 34a_200000760531_100000034017 [0,1,1,0,0,0|1,0,0]=3 2858 B16R0.61 CCCCOCCOCCOCC(=O)CCC 7a_100011215186_100000747444 [0,1,1,0,0,0|2,0,0]=4 2859 B16R0.61 CCCCSCCCCCCCC(=O)OCC 62a_100000210211_100009991516 [0,1,1,0,0,0|2,0,0]=4 2860 B16R0.61 CCCOCCCCCCCCC(=O)OCC 34a_100000210258_100010175975 [0,1,1,0,0,0|2,0,0]=4 2861 B16R0.61 CCCOCCOCCNCOC(=O)CCC 2230a_200011904461_100000034017 [0,1,1,0,0,0|2,0,0]=4 2862 B16R0.61 CCCOCCOCCNCOC(=O)CCC 34a_200011904461_100000034017 [0,1,1,0,0,0|2,0,0]=4 2863 B16R0.61 CCCSCCCCCCCCC(=O)OCC 62a_100000210303_100010175975 [0,1,1,0,0,0|2,0,0]=4 2864 B16R0.61 CCNC(=O)CCCCCCCCCCCO 240690a_100015525214_100000037981 [0,1,1,0,0,0|2,0,0]=4 2865 B16R0.61 CCNC(=O)COCCCCCCCCCBr 34a_100009813782_100000183381 [0,1,1,0,0,0|2,0,0]=4 2866 B16R0.61 CCNC(=O)COCCCCCCCCCBr 7a_100009813782_100000183381 [0,1,1,0,0,0|2,0,0]=4 2867 B16R0.61 CCNC(=O)COCCCCCCCCCCl 34a_100009868337_100000183381 [0,1,1,0,0,0|2,0,0]=4 2868 B16R0.61 CCNC(=O)COCCCCCCCCCCl 7a_100009868337_100000183381 [0,1,1,0,0,0|2,0,0]=4 2869 B16R0.61 CCNC(=O)COCCCCCCCCCN 34a_100000078944_100000183381 [0,1,1,0,0,0|2,0,0]=4 2870 B16R0.61 CCNC(=O)NCCCCCCCCCCO 2708a_100000066964_100015525214 [0,1,1,0,0,0|2,0,0]=4 2871 B16R0.61 CCNC(=O)NCCCCCCCCCCO 2708a_100015525214_100000066964 [0,1,1,0,0,0|2,0,0]=4 2872 B16R0.61 CCNC(=O)NCCCCCCCCCCO 273464a_100000066964_100015525214 [0,1,1,0,0,0|2,0,0]=4 2873 B16R0.61 CCNC(=O)NCCCCCCCCCCO 273464a_100015525214_100000066964 [0,1,1,0,0,0|2,0,0]=4 2874 B16R0.61 CCNC(=O)NCCCCCCCCCCO 512a_100000066964_100015525214 [0,1,1,0,0,0|2,0,0]=4 2875 B16R0.61 CCNC(=O)NCCCCCCCCCCO 512a_100015525214_100000066964 [0,1,1,0,0,0|2,0,0]=4 2876 B16R0.61 CCNCCCCCCCCCC(=O)OCC 2230a_100015525214_100009828014 [0,1,1,0,0,0|2,0,0]=4 2877 B16R0.61 CCOC(=O)CCCCCCCCCCNC 2230a_106832991635_100009827693 [0,1,1,0,0,0|2,0,0]=4 2878 B16R0.61 CCOC(=O)CCCCCCCCCCNC 34a_100102657272_100009827693 [0,1,1,0,0,0|2,0,0]=4 2879 B16R0.61 CCOC(=O)CCCCCCCCCCNC 7a_106832991635_100009827693 [0,1,1,0,0,0|2,0,0]=4 2880 B16R0.61 CCOC(=O)CCCCCCCCCCOC 34a_100138415774_100009827693 [0,1,1,0,0,0|2,0,0]=4 2881 B16R0.61 CCOC(=O)CCCCCCCCCCSC 62a_200000210301_100009827693 [0,1,1,0,0,0|2,0,0]=4 2882 B16R0.61 CCOC(=O)CCCCCCCCCCS[13CH3] 62a_200025704644_100009827693 [0,1,1,0,0,0|2,0,0]=4 2883 B16R0.61 CCOC(=O)CCCCCCCCCSCC 62a_100000210202_100009828014 [0,1,1,0,0,0|2,0,0]=4 2884 B16R0.61 CCOC(=O)COCCCCCCCCCBr 34a_100009813782_100000188475 [0,1,1,0,0,0|2,0,0]=4 2885 B16R0.61 CCOC(=O)COCCCCCCCCCBr 7a_100009813782_100000188475 [0,1,1,0,0,0|2,0,0]=4 2886 B16R0.61 CCOC(=O)COCCCCCCCCCCl 34a_100009868337_100000188475 [0,1,1,0,0,0|2,0,0]=4 2887 B16R0.61 CCOC(=O)COCCCCCCCCCCl 7a_100009868337_100000188475 [0,1,1,0,0,0|2,0,0]=4 2888 B16R0.61 CCOC(=O)COCCCCCCCCCN 34a_100000078944_100000188475 [0,1,1,0,0,0|2,0,0]=4 2889 B16R0.61 CCOC(=O)OCSCCCCCCCCO 62a_100000033203_100000075025 [0,1,1,0,0,0|2,0,0]=4 2890 B16R0.61 CCOCCCCCCCCCC(=O)OCC 34a_100121572206_100009828014 [0,1,1,0,0,0|2,0,0]=4 2891 B16R0.61 COCC(=O)CCCCCCCCCCCO 1458a_100000210968_100009812471 [0,1,1,0,0,0|2,0,0]=4 2892 B16R0.61 COCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210968 [0,1,1,0,0,0|2,0,0]=4 2893 B16R0.61 CSCC(=O)CCCCCCCCCCCO 1458a_100000184570_100009812471 [0,1,1,0,0,0|2,0,0]=4 2894 B16R0.61 CSCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000184570 [0,1,1,0,0,0|2,0,0]=4 2895 B16R0.61 O=C(CCO)CCCCCCCCCCCO 1458a_100011216618_100009812471 [0,1,1,0,0,0|2,0,0]=4 2896 B16R0.61 O=C(CCO)NCCCCCCCCCCO 240690a_100000066964_100011216618 [0,1,1,0,0,0|2,0,0]=4 2897 B16R0.70 CCC(C)C(=O)CCCCCCCCCCO 1458a_100011192722_100009813290 [0,1,1,0,0,0|2,0,0]=4 2898 B16R0.70 CCC(C)C(=O)NCCCCCCCCCO 240690a_100000078944_100011192722 [0,1,1,0,0,0|2,0,0]=4 2899 B16R0.70 CCC(O)C(=O)CCCCCCCCCCO 1458a_100011196387_100009813290 [0,1,1,0,0,0|2,0,0]=4 2900 B16R0.70 CCC(O)C(=O)NCCCCCCCCCO 240690a_100000078944_100011196387 [0,1,1,0,0,0|2,0,0]=4 2901 B16R0.70 CCCCCCCCCC=CC(=O)C(C)CC 1458a_200015352897_100000758301 [0,1,1,0,0,0|1,0,1]=4 2902 B16R0.70 CCCCCCCCCCCC(=O)C(C)CC 1458a_100000210736_100000758301 [0,1,1,0,0,0|1,0,0]=3 2903 B16R0.70 CCCCCCCCCCCC(=O)C(C)CC 1458a_100011192722_100011215454 [0,1,1,0,0,0|1,0,0]=3 2904 B16R0.70 CCCCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100011215454 [0,1,1,0,0,0|2,0,0]=4 2905 B16R0.70 CCCCCCCCCCCC(=O)C(C)SC 1458a_100000149566_100011215454 [0,1,1,0,0,0|2,0,0]=4 2906 B16R0.70 CCCCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100011215454 [0,1,1,0,0,0|1,0,0]=3 2907 B16R0.70 CCCCCCCCCCCC(=O)C(O)CO 1458a_100011215603_100011215454 [0,1,1,0,0,0|2,0,0]=4 2908 B16R0.70 CCCCCCCCCCCC(=O)N(C)CC 11a_100000225621_100000210736 [0,1,1,0,0,0|2,0,0]=4 2909 B16R0.70 CCCCCCCCCCCC(=O)N(C)CC 1626a_100000225621_100000210736 [0,1,1,0,0,0|2,0,0]=4 2910 B16R0.70 CCCCCCCCCCCC(=O)N(C)CC 240690a_100000225621_100000210736 [0,1,1,0,0,0|2,0,0]=4 2911 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 11a_100000684558_100011192722 [0,1,1,0,0,0|1,0,0]=3 2912 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 1626a_100000684558_100011192722 [0,1,1,0,0,0|1,0,0]=3 2913 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 240690a_100000684558_100011192722 [0,1,1,0,0,0|1,0,0]=3 2914 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 527a_100000684558_100011192722 [0,1,1,0,0,0|1,0,0]=3 2915 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 11a_100000684558_100000743197 [0,1,1,0,0,0|2,0,0]=4 2916 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 1626a_100000684558_100000743197 [0,1,1,0,0,0|2,0,0]=4 2917 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 240690a_100000684558_100000743197 [0,1,1,0,0,0|2,0,0]=4 2918 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 527a_100000684558_100000743197 [0,1,1,0,0,0|2,0,0]=4 2919 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 11a_100000684558_100000149566 [0,1,1,0,0,0|2,0,0]=4 2920 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 1626a_100000684558_100000149566 [0,1,1,0,0,0|2,0,0]=4 2921 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 240690a_100000684558_100000149566 [0,1,1,0,0,0|2,0,0]=4 2922 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 527a_100000684558_100000149566 [0,1,1,0,0,0|2,0,0]=4 2923 B16R0.70 CCCCCCCCCCNC(=O)C(O)CC 240690a_100000684558_100011196387 [0,1,1,0,0,0|1,0,0]=3 2924 B16R0.70 CCCCCCCCCCNC(=O)C(O)CO 240690a_100000684558_100011215603 [0,1,1,0,0,0|2,0,0]=4 2925 B16R0.70 CCCCCCCCCCNC(=O)N(C)CC 2708a_100000684558_100000225621 [0,1,1,0,0,0|2,0,0]=4 2926 B16R0.70 CCCCCCCCCCNC(=O)N(C)CC 273464a_100000684558_100000225621 [0,1,1,0,0,0|2,0,0]=4 2927 B16R0.70 CCCCCCCCCCOC(C)C(C)CC 7a_100011215189_100000210320 [0,1,1,0,0,0|1,0,1]=4 2928 B16R0.137 CCCC(=O)OCC(=O)CCCCCCCO 1458a_100011219782_100000034017 [0,1,1,0,0,0|1,0,1]=4 2929 B16R0.137 CCCCCCCCC(=O)COC(=O)CCC 1458a_100000210188_100000034017 [0,1,1,0,0,0|0,0,1]=3 2930 B16R0.137 CCCCCCCCC(C)COC(C)CCC 34a_200012125181_100000766640 [0,1,1,0,0,0|1,0,1]=4 2931 B16R0.137 CCCCCCCCC(C)COC(C)CCC 7a_200012125181_100000766640 [0,1,1,0,0,0|1,0,1]=4 2932 B16R0.137 CCCCCCCCC(C)OCC(=O)CCC 7a_100000210740_100000747444 [0,1,1,0,0,0|2,0,0]=4 2933 B16R0.137 CCCCCCCCN(C)COC(=O)CCC 2230a_100000207567_100000034017 [0,1,1,0,0,0|1,0,0]=3 2934 B16R0.137 CCCCCCCCN(C)COC(=O)CCC 269982a_100000207567_100000034017 [0,1,1,0,0,0|1,0,0]=3 2935 B16R0.183 CCCCCCC(C)CCOCC(=O)CCC 7a_200011024964_100000747444 [0,1,1,0,0,0|2,0,0]=4 2936 B16R0.195 CCCCC(C)CCCCOCC(=O)CCC 7a_200011021034_100000747444 [0,1,1,0,0,0|2,0,0]=4 2937 B16R0.220 C#CC(CCC)OCCCCCCCCCC 34a_200011217317_100000210320 [0,1,1,0,0,0|1,0,1]=4 2938 B16R0.220 C#CC(CCC)OCCCCCCCCCC 7a_200011217317_100000210320 [0,1,1,0,0,0|1,0,1]=4 2939 B16R0.220 C=CC(CCC)OCCCCCCCCCC 34a_100011216692_100000210320 [0,1,1,0,0,0|1,0,1]=4 2940 B16R0.220 C=CC(CCC)OCCCCCCCCCC 7a_100011216692_100000210320 [0,1,1,0,0,0|1,0,1]=4 2941 B16R0.220 CCCCCCCCCCOC(C#N)CCC 34a_100000686963_100000210320 [0,1,1,0,0,0|1,0,1]=4 2942 B16R0.220 CCCCCCCCCCOC(C#N)CCC 7a_100000686963_100000210320 [0,1,1,0,0,0|1,0,1]=4 2943 B16R0.220 CCCCCCCCCCOC(CC)CCC 34a_100000687864_100000210320 [0,1,1,0,0,0|1,0,1]=4 2944 B16R0.220 CCCCCCCCCCOC(CC)CCC 7a_100000210711_100011219200 [0,1,1,0,0,0|1,0,1]=4 2945 B16R0.220 CCCCCCCCCCOC(CC)CCC 7a_100000687864_100000210320 [0,1,1,0,0,0|1,0,1]=4 2946 B16R0.661 C#CCCC(=O)CCCCCCCCCCC 1458a_100000210736_100000753159 [0,1,1,0,0,0|1,0,1]=4 2947 B16R0.661 C#CCCC(=O)CCCCCCCCCCC 1458a_100000692101_100011215454 [0,1,1,0,0,0|1,0,1]=4 2948 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 11a_100000684558_100000692101 [0,1,1,0,0,0|1,0,1]=4 2949 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 1626a_100000684558_100000692101 [0,1,1,0,0,0|1,0,1]=4 2950 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 240690a_100000684558_100000692101 [0,1,1,0,0,0|1,0,1]=4 2951 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 527a_100000684558_100000692101 [0,1,1,0,0,0|1,0,1]=4 2952 B16R0.661 C/C=C/CC(=O)CCCCCCCCCCC 1458a_100000210736_100102629194 [0,1,1,0,0,0|1,0,1]=4 2953 B16R0.661 C=CCCC(=O)CCCCCCCCCCC 1458a_100000210736_100000754431 [0,1,1,0,0,0|1,0,1]=4 2954 B16R0.661 C=CCCC(=O)CCCCCCCCCCC 1458a_100000749702_100011215454 [0,1,1,0,0,0|1,0,1]=4 2955 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 11a_100000684558_100000749702 [0,1,1,0,0,0|1,0,1]=4 2956 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 1626a_100000684558_100000749702 [0,1,1,0,0,0|1,0,1]=4 2957 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 240690a_100000684558_100000749702 [0,1,1,0,0,0|1,0,1]=4 2958 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 527a_100000684558_100000749702 [0,1,1,0,0,0|1,0,1]=4 2959 B16R0.661 CC#CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000748600 [0,1,1,0,0,0|1,0,1]=4 2960 B16R0.661 CC=CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000070051 [0,1,1,0,0,0|1,0,1]=4 2961 B16R0.661 CC=CCC(=O)CCCCCCCCCCC 1458a_100121576822_100011215454 [0,1,1,0,0,0|1,0,1]=4 2962 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 11a_100000684558_100121576822 [0,1,1,0,0,0|1,0,1]=4 2963 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 1626a_100000684558_100121576822 [0,1,1,0,0,0|1,0,1]=4 2964 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 240690a_100000684558_100121576822 [0,1,1,0,0,0|1,0,1]=4 2965 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 527a_100000684558_100121576822 [0,1,1,0,0,0|1,0,1]=4 2966 B16R0.661 CCC#CC(=O)CCCCCCCCCCC 1458a_100011827653_100011215454 [0,1,1,0,0,0|1,0,1]=4 2967 B16R0.661 CCC=CC(=O)CCCCCCCCCCC 1458a_100000212282_100011215454 [0,1,1,0,0,0|1,0,1]=4 2968 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 11a_100000684558_100000212282 [0,1,1,0,0,0|1,0,1]=4 2969 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 1626a_100000684558_100000212282 [0,1,1,0,0,0|1,0,1]=4 2970 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 240690a_100000684558_100000212282 [0,1,1,0,0,0|1,0,1]=4 2971 B16R0.661 CCCCC(=O)CCCCCCCCCCO 1458a_100000210183_100009813290 [0,1,1,0,0,0|2,0,0]=4 2972 B16R0.661 CCCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000210183 [0,1,1,0,0,0|2,0,0]=4 2973 B16R0.661 CCCCCCCCCC=CC(=O)CCCC 1458a_200015352897_100000210211 [0,1,1,0,0,0|1,0,1]=4 2974 B16R0.661 CCCCCCCCCC=CC(=O)CCCF 1458a_200015352897_100011934791 [0,1,1,0,0,0|1,0,1]=4 2975 B16R0.661 CCCCCCCCCC=CC(=O)CCCO 1458a_200015352897_100011215043 [0,1,1,0,0,0|1,0,1]=4 2976 B16R0.661 CCCCCCCCCC=CC(=O)CCOC 1458a_200015352897_100000233755 [0,1,1,0,0,0|1,0,1]=4 2977 B16R0.661 CCCCCCCCCC=CC(=O)CCSC 1458a_200015352897_100000751147 [0,1,1,0,0,0|1,0,1]=4 2978 B16R0.661 CCCCCCCCCC=CC(=O)NCCC 11a_100020643023_200015352897 [0,1,1,0,0,0|1,0,1]=4 2979 B16R0.661 CCCCCCCCCC=CC(=O)NCCC 1626a_100020643023_200015352897 [0,1,1,0,0,0|1,0,1]=4 2980 B16R0.661 CCCCCCCCCC=CC(=O)NCCC 240690a_100020643023_200015352897 [0,1,1,0,0,0|1,0,1]=4 2981 B16R0.661 CCCCCCCCCCCC(=O)CCC#N 1458a_100000210736_100011215226 [0,1,1,0,0,0|1,0,1]=4 2982 B16R0.661 CCCCCCCCCCCC(=O)CCC#N 1458a_100011934036_100011215454 [0,1,1,0,0,0|1,0,1]=4 2983 B16R0.661 CCCCCCCCCCCC(=O)CCCC 1458a_100000210183_100011215454 [0,1,1,0,0,0|1,0,0]=3 2984 B16R0.661 CCCCCCCCCCCC(=O)CCCC 1458a_100000210736_100000210211 [0,1,1,0,0,0|1,0,0]=3 2985 B16R0.661 CCCCCCCCCCCC(=O)CCCF 1458a_100000210736_100011934791 [0,1,1,0,0,0|1,0,0]=3 2986 B16R0.661 CCCCCCCCCCCC(=O)CCCO 1458a_100000210736_100011215043 [0,1,1,0,0,0|1,0,0]=3 2987 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000210736_100000233755 [0,1,1,0,0,0|1,0,0]=3 2988 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000749529_100011215454 [0,1,1,0,0,0|1,0,0]=3 2989 B16R0.661 CCCCCCCCCCCC(=O)CCSC 1458a_100000174002_100011215454 [0,1,1,0,0,0|1,0,0]=3 2990 B16R0.661 CCCCCCCCCCCC(=O)CCSC 1458a_100000210736_100000751147 [0,1,1,0,0,0|1,0,0]=3 2991 B16R0.661 CCCCCCCCCCCC(=O)COCC 1458a_100000211967_100011215454 [0,1,1,0,0,0|1,0,0]=3 2992 B16R0.661 CCCCCCCCCCCC(=O)CSCC 1458a_100000230394_100011215454 [0,1,1,0,0,0|1,0,0]=3 2993 B16R0.661 CCCCCCCCCCCC(=O)NCCC 11a_100020643023_100000210736 [0,1,1,0,0,0|1,0,0]=3 2994 B16R0.661 CCCCCCCCCCCC(=O)NCCC 1626a_100020643023_100000210736 [0,1,1,0,0,0|1,0,0]=3 2995 B16R0.661 CCCCCCCCCCCC(=O)NCCC 240690a_100020643023_100000210736 [0,1,1,0,0,0|1,0,0]=3 2996 B16R0.661 CCCCCCCCCCCC(=O)NCCF 11a_100000724931_100000210736 [0,1,1,0,0,0|2,0,0]=4 2997 B16R0.661 CCCCCCCCCCCC(=O)NCCF 1626a_100000724931_100000210736 [0,1,1,0,0,0|2,0,0]=4 2998 B16R0.661 CCCCCCCCCCCC(=O)NCCF 240690a_100000724931_100000210736 [0,1,1,0,0,0|2,0,0]=4 2999 B16R0.661 CCCCCCCCCCCC(=O)NCCO 240690a_100000210304_100000210736 [0,1,1,0,0,0|2,0,0]=4 3000 B16R0.661 CCCCCCCCCCCC(=O)NNCC 22a_100000756455_100000210736 [0,1,1,0,0,0|2,0,0]=4 3001 B16R0.661 CCCCCCCCCCCC(=O)OCNC 2230a_106832991635_100020644155 [0,1,1,0,0,0|2,0,0]=4 3002 B16R0.661 CCCCCCCCCCCC(=O)OCNC 34a_100102657272_100020644155 [0,1,1,0,0,0|2,0,0]=4 3003 B16R0.661 CCCCCCCCCCCC(=O)OCNC 7a_106832991635_100020644155 [0,1,1,0,0,0|2,0,0]=4 3004 B16R0.661 CCCCCCCCCCCC(=O)OCOC 34a_100138415774_100020644155 [0,1,1,0,0,0|2,0,0]=4 3005 B16R0.661 CCCCCCCCCCCC(=O)OCSC 62a_200000210301_100020644155 [0,1,1,0,0,0|2,0,0]=4 3006 B16R0.661 CCCCCCCCCCCC(=O)OCS[13CH3] 62a_200025704644_100020644155 [0,1,1,0,0,0|2,0,0]=4 3007 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 11a_100000684558_100011934036 [0,1,1,0,0,0|1,0,1]=4 3008 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 1626a_100000684558_100011934036 [0,1,1,0,0,0|1,0,1]=4 3009 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 240690a_100000684558_100011934036 [0,1,1,0,0,0|1,0,1]=4 3010 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 527a_100000684558_100011934036 [0,1,1,0,0,0|1,0,1]=4 3011 B16R0.661 CCCCCCCCCCNC(=O)CCCC 11a_100000684558_100000210183 [0,1,1,0,0,0|1,0,0]=3 3012 B16R0.661 CCCCCCCCCCNC(=O)CCCC 1626a_100000684558_100000210183 [0,1,1,0,0,0|1,0,0]=3 3013 B16R0.661 CCCCCCCCCCNC(=O)CCCC 240690a_100000684558_100000210183 [0,1,1,0,0,0|1,0,0]=3 3014 B16R0.661 CCCCCCCCCCNC(=O)CCCC 527a_100000684558_100000210183 [0,1,1,0,0,0|1,0,0]=3 3015 B16R0.661 CCCCCCCCCCNC(=O)CCOC 11a_100000684558_100000749529 [0,1,1,0,0,0|1,0,0]=3 3016 B16R0.661 CCCCCCCCCCNC(=O)CCOC 1626a_100000684558_100000749529 [0,1,1,0,0,0|1,0,0]=3 3017 B16R0.661 CCCCCCCCCCNC(=O)CCOC 240690a_100000684558_100000749529 [0,1,1,0,0,0|1,0,0]=3 3018 B16R0.661 CCCCCCCCCCNC(=O)CCOC 527a_100000684558_100000749529 [0,1,1,0,0,0|1,0,0]=3 3019 B16R0.661 CCCCCCCCCCNC(=O)CCSC 11a_100000684558_100000174002 [0,1,1,0,0,0|1,0,0]=3 3020 B16R0.661 CCCCCCCCCCNC(=O)CCSC 1626a_100000684558_100000174002 [0,1,1,0,0,0|1,0,0]=3 3021 B16R0.661 CCCCCCCCCCNC(=O)CCSC 240690a_100000684558_100000174002 [0,1,1,0,0,0|1,0,0]=3 3022 B16R0.661 CCCCCCCCCCNC(=O)CCSC 527a_100000684558_100000174002 [0,1,1,0,0,0|1,0,0]=3 3023 B16R0.661 CCCCCCCCCCNC(=O)COCC 11a_100000684558_100000211967 [0,1,1,0,0,0|1,0,0]=3 3024 B16R0.661 CCCCCCCCCCNC(=O)COCC 1626a_100000684558_100000211967 [0,1,1,0,0,0|1,0,0]=3 3025 B16R0.661 CCCCCCCCCCNC(=O)COCC 240690a_100000684558_100000211967 [0,1,1,0,0,0|1,0,0]=3 3026 B16R0.661 CCCCCCCCCCNC(=O)COCC 527a_100000684558_100000211967 [0,1,1,0,0,0|1,0,0]=3 3027 B16R0.661 CCCCCCCCCCNC(=O)CSCC 11a_100000684558_100000230394 [0,1,1,0,0,0|1,0,0]=3 3028 B16R0.661 CCCCCCCCCCNC(=O)CSCC 1626a_100000684558_100000230394 [0,1,1,0,0,0|1,0,0]=3 3029 B16R0.661 CCCCCCCCCCNC(=O)CSCC 240690a_100000684558_100000230394 [0,1,1,0,0,0|1,0,0]=3 3030 B16R0.661 CCCCCCCCCCNC(=O)CSCC 527a_100000684558_100000230394 [0,1,1,0,0,0|1,0,0]=3 3031 B16R0.661 CCCCCCCCCCNC(=O)NCCC 2708a_100000684558_100020643023 [0,1,1,0,0,0|1,0,0]=3 3032 B16R0.661 CCCCCCCCCCNC(=O)NCCC 2708a_100020643023_100000684558 [0,1,1,0,0,0|1,0,0]=3 3033 B16R0.661 CCCCCCCCCCNC(=O)NCCC 273464a_100000684558_100020643023 [0,1,1,0,0,0|1,0,0]=3 3034 B16R0.661 CCCCCCCCCCNC(=O)NCCC 273464a_100020643023_100000684558 [0,1,1,0,0,0|1,0,0]=3 3035 B16R0.661 CCCCCCCCCCNC(=O)NCCC 512a_100000684558_100020643023 [0,1,1,0,0,0|1,0,0]=3 3036 B16R0.661 CCCCCCCCCCNC(=O)NCCC 512a_100020643023_100000684558 [0,1,1,0,0,0|1,0,0]=3 3037 B16R0.661 CCCCCCCCCCNC(=O)NCCF 2708a_100000684558_100000724931 [0,1,1,0,0,0|2,0,0]=4 3038 B16R0.661 CCCCCCCCCCNC(=O)NCCF 273464a_100000684558_100000724931 [0,1,1,0,0,0|2,0,0]=4 3039 B16R0.661 CCCCCCCCCCNC(=O)NCCF 273464a_100000724931_100000684558 [0,1,1,0,0,0|2,0,0]=4 3040 B16R0.661 CCCCCCCCCCNC(=O)NCCF 512a_100000684558_100000724931 [0,1,1,0,0,0|2,0,0]=4 3041 B16R0.661 CCCCCCCCCCNC(=O)NCCO 2708a_100000684558_100000210304 [0,1,1,0,0,0|2,0,0]=4 3042 B16R0.661 CCCCCCCCCCNC(=O)NCCO 273464a_100000210304_100000684558 [0,1,1,0,0,0|2,0,0]=4 3043 B16R0.661 CCCCCCCCCCNC(=O)NCCO 273464a_100000684558_100000210304 [0,1,1,0,0,0|2,0,0]=4 3044 B16R0.661 CCCCCCCCCCNC(=O)NCCO 512a_100000684558_100000210304 [0,1,1,0,0,0|2,0,0]=4 3045 B16R0.661 CCCCCCCCCCNC(=O)NNCC 273464a_100000684558_100000756455 [0,1,1,0,0,0|2,0,0]=4 3046 B16R0.661 CCCCCCCCCCNC(=O)NNCC 512a_100000684558_100000756455 [0,1,1,0,0,0|2,0,0]=4 3047 B16R0.661 CCCCCCCCCCNC(=O)NNCC 512a_100000756455_100000684558 [0,1,1,0,0,0|2,0,0]=4 3048 B16R0.661 CCCCCCCCCCOC(=O)CNCC 2230a_100015525214_100000210668 [0,1,1,0,0,0|0,0,0]=2 3049 B16R0.661 CCCCCCCCCCOC(=O)COCC 34a_100121572206_100000210668 [0,1,1,0,0,0|0,0,0]=2 3050 B16R0.661 CCCCCCCCCCOC(=O)CSCC 62a_100000210202_100000680656 [0,1,1,0,0,0|0,0,0]=2 3051 B16R0.661 CCCCCCCCCCOC(=O)CSCC 62a_100000680656_100000210202 [0,1,1,0,0,0|0,0,0]=2 3052 B16R0.661 CCCCCCCCCCOC(=O)CSCF 62a_100000680656_100015361967 [0,1,1,0,0,0|1,0,0]=3 3053 B16R0.661 CCCCCCCCCCOC(=O)CSCF 62a_100015361967_100000680656 [0,1,1,0,0,0|1,0,0]=3 3054 B16R0.661 CCCCCCCCCCOC(C)CCCC 34a_100000210711_200011215066 [0,1,1,0,0,0|1,0,1]=4 3055 B16R0.661 CCCCCCCCCCOC(C)CCCC 34a_100000687866_100000210320 [0,1,1,0,0,0|1,0,1]=4 3056 B16R0.661 CCCCCCCCCCOC(C)CCCC 7a_100000210711_200011215066 [0,1,1,0,0,0|1,0,1]=4 3057 B16R0.661 CCCCCCCCCCOC(C)CCCC 7a_100000687866_100000210320 [0,1,1,0,0,0|1,0,1]=4 3058 B16R0.661 CCCCCCCCCCOC(C)CCCCl 34a_200000718107_100000210320 [0,1,1,0,0,0|1,0,1]=4 3059 B16R0.661 CCCCCCCCCCOC(C)CCCCl 7a_200000718107_100000210320 [0,1,1,0,0,0|1,0,1]=4 3060 B16R0.661 CCCCCCCCCCOC(C)COCC 34a_100000718985_100000210320 [0,1,1,0,0,0|1,0,1]=4 3061 B16R0.661 CCCCCCCCCCOC(C)COCC 7a_100000718985_100000210320 [0,1,1,0,0,0|1,0,1]=4 3062 B16R0.661 CCCCCCCCCNCC(=O)NCCC 2230a_100000174927_100011214924 [0,1,1,0,0,0|2,0,0]=4 3063 B16R0.661 CCCCCCCCCNCC(=O)NCCC 2230a_100000212291_100000183358 [0,1,1,0,0,0|2,0,0]=4 3064 B16R0.661 CCCCCCCCCNCC(=O)NCCC 34a_100000212291_100000183358 [0,1,1,0,0,0|2,0,0]=4 3065 B16R0.661 CCCCCCCCCNCC(=O)OCCC 2230a_100000212291_200011215008 [0,1,1,0,0,0|2,0,0]=4 3066 B16R0.661 CCCCCCCCCNCC(=O)OCCC 34a_100000212291_200011215008 [0,1,1,0,0,0|2,0,0]=4 3067 B16R0.661 CCCCCCCCCOCC(=O)NCCC 34a_100000210712_100000183358 [0,1,1,0,0,0|2,0,0]=4 3068 B16R0.661 CCCCCCCCCOCC(=O)NCCC 7a_100000210712_100000183358 [0,1,1,0,0,0|2,0,0]=4 3069 B16R0.661 CCCCCCCCCOCC(=O)OCCC 34a_100000210712_200011215008 [0,1,1,0,0,0|2,0,0]=4 3070 B16R0.661 CCCCCCCCCOCC(=O)OCCC 7a_100000210712_200011215008 [0,1,1,0,0,0|2,0,0]=4 3071 B16R0.661 CCCCCCCCCSCC(=O)NCCC 62a_100000183358_100000210670 [0,1,1,0,0,0|2,0,0]=4 3072 B16R0.661 CCCCCCCCCSCC(=O)OCCC 62a_200011215008_100000210670 [0,1,1,0,0,0|2,0,0]=4 3073 B16R0.661 CCCCCCCCNCOC(=O)OCCC 34a_100000229939_200000139673 [0,1,1,0,0,0|1,0,0]=3 3074 B16R0.661 CCCCCCCCOCOC(=O)OCCC 34a_100000210232_200000139673 [0,1,1,0,0,0|1,0,0]=3 3075 B16R0.661 CCCCCCCCOCOC(=O)OCCC 7a_100000210232_200000139673 [0,1,1,0,0,0|1,0,0]=3 3076 B16R0.661 CCCCCCCCSCOC(=O)OCCC 62a_100000210759_200000139673 [0,1,1,0,0,0|1,0,0]=3 3077 B16R0.661 CCCCCCCNCCCC(=O)NCCC 2230a_100000229938_100011194427 [0,1,1,0,0,0|2,0,0]=4 3078 B16R0.661 CCCCCCCOCCCC(=O)NCCC 7a_100000210272_100011194427 [0,1,1,0,0,0|2,0,0]=4 3079 B16R0.661 CCCCCCCSCCCC(=O)NCCC 62a_100000210614_100011194427 [0,1,1,0,0,0|2,0,0]=4 3080 B16R0.661 CCCCCCCSCCCC(=O)NCCC 62a_100011194427_100000210316 [0,1,1,0,0,0|2,0,0]=4 3081 B16R0.661 CCCCCNCCOCOC(=O)OCCC 34a_100000224656_200000139673 [0,1,1,0,0,0|2,0,0]=4 3082 B16R0.661 CCCCCOCCOCOC(=O)OCCC 34a_100011215259_200000139673 [0,1,1,0,0,0|2,0,0]=4 3083 B16R0.661 CCCCCOCCOCOC(=O)OCCC 7a_100011215259_200000139673 [0,1,1,0,0,0|2,0,0]=4 3084 B16R0.661 CCCCOCCCNCOC(=O)OCCC 34a_200000211371_200000139673 [0,1,1,0,0,0|2,0,0]=4 3085 B16R0.661 CCCCOCCCOCOC(=O)OCCC 34a_200011215613_200000139673 [0,1,1,0,0,0|2,0,0]=4 3086 B16R0.661 CCCCOCCCOCOC(=O)OCCC 7a_200011215613_200000139673 [0,1,1,0,0,0|2,0,0]=4 3087 B16R0.661 CCCNC(=O)CCCCCCCCCCO 240690a_100020643023_200000016029 [0,1,1,0,0,0|2,0,0]=4 3088 B16R0.661 CCCNC(=O)NCCCCCCCCCO 2708a_100000078944_100020643023 [0,1,1,0,0,0|2,0,0]=4 3089 B16R0.661 CCCNC(=O)NCCCCCCCCCO 2708a_100020643023_100000078944 [0,1,1,0,0,0|2,0,0]=4 3090 B16R0.661 CCCNC(=O)NCCCCCCCCCO 273464a_100000078944_100020643023 [0,1,1,0,0,0|2,0,0]=4 3091 B16R0.661 CCCNC(=O)NCCCCCCCCCO 273464a_100020643023_100000078944 [0,1,1,0,0,0|2,0,0]=4 3092 B16R0.661 CCCNC(=O)NCCCCCCCCCO 512a_100000078944_100020643023 [0,1,1,0,0,0|2,0,0]=4 3093 B16R0.661 CCCNC(=O)NCCCCCCCCCO 512a_100020643023_100000078944 [0,1,1,0,0,0|2,0,0]=4 3094 B16R0.661 CCCOC(=O)OCNCCCCCCCO 34a_100011996573_200000139673 [0,1,1,0,0,0|2,0,0]=4 3095 B16R0.661 CCCOC(=O)OCOCCCCCCCBr 34a_100000760002_200000139673 [0,1,1,0,0,0|2,0,0]=4 3096 B16R0.661 CCCOC(=O)OCOCCCCCCCBr 7a_100000760002_200000139673 [0,1,1,0,0,0|2,0,0]=4 3097 B16R0.661 CCCOC(=O)OCOCCCCCCCN 34a_100011996573_200000139673 [0,1,1,0,0,0|2,0,0]=4 3098 B16R0.661 CCCOC(=O)OCOCCCCCCOC 34a_200012092642_200000139673 [0,1,1,0,0,0|2,0,0]=4 3099 B16R0.661 CCCOC(=O)OCOCCCCCCOC 7a_200012092642_200000139673 [0,1,1,0,0,0|2,0,0]=4 3100 B16R0.661 CCCOC(=O)OCSCCCCCCCO 62a_100000760002_200000139673 [0,1,1,0,0,0|2,0,0]=4 3101 B16R0.661 CCCOC(=O)OCSCCCCCCOC 62a_100011998445_200000139673 [0,1,1,0,0,0|2,0,0]=4 3102 B16R0.661 CCOCC(=O)CCCCCCCCCCO 1458a_100000211967_100009813290 [0,1,1,0,0,0|2,0,0]=4 3103 B16R0.661 CCOCC(=O)NCCCCCCCCCO 240690a_100000078944_100000211967 [0,1,1,0,0,0|2,0,0]=4 3104 B16R0.661 CCSCC(=O)CCCCCCCCCCO 1458a_100000230394_100009813290 [0,1,1,0,0,0|2,0,0]=4 3105 B16R0.661 CCSCC(=O)NCCCCCCCCCO 240690a_100000078944_100000230394 [0,1,1,0,0,0|2,0,0]=4 3106 B16R0.661 COCCC(=O)CCCCCCCCCCO 1458a_100000749529_100009813290 [0,1,1,0,0,0|2,0,0]=4 3107 B16R0.661 COCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000749529 [0,1,1,0,0,0|2,0,0]=4 3108 B16R0.661 CSCCC(=O)CCCCCCCCCCO 1458a_100000174002_100009813290 [0,1,1,0,0,0|2,0,0]=4 3109 B16R0.661 CSCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000174002 [0,1,1,0,0,0|2,0,0]=4 3110 B16R0.1183 CCCCCCCCCCC(=O)C(=O)NCC 1458a_200011297158_100000210319 [0,1,1,0,0,0|2,0,0]=4 3111 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 11a_100000207566_100000211992 [0,1,1,0,0,0|1,0,0]=3 3112 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 1626a_100000207566_100000211992 [0,1,1,0,0,0|1,0,0]=3 3113 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 240690a_100000207566_100000211992 [0,1,1,0,0,0|1,0,0]=3 3114 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 527a_100000207566_100000211992 [0,1,1,0,0,0|1,0,0]=3 3115 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCO 240690a_100000207566_100011216618 [0,1,1,0,0,0|2,0,0]=4 3116 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 11a_100000207566_100000210968 [0,1,1,0,0,0|2,0,0]=4 3117 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 1626a_100000207566_100000210968 [0,1,1,0,0,0|2,0,0]=4 3118 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 240690a_100000207566_100000210968 [0,1,1,0,0,0|2,0,0]=4 3119 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 527a_100000207566_100000210968 [0,1,1,0,0,0|2,0,0]=4 3120 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 11a_100000207566_100000184570 [0,1,1,0,0,0|2,0,0]=4 3121 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 1626a_100000207566_100000184570 [0,1,1,0,0,0|2,0,0]=4 3122 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 240690a_100000207566_100000184570 [0,1,1,0,0,0|2,0,0]=4 3123 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 527a_100000207566_100000184570 [0,1,1,0,0,0|2,0,0]=4 3124 B16R0.1183 CCCCCCCCCCN(C)C(=O)NCC 2708a_100015525214_100000207566 [0,1,1,0,0,0|2,0,0]=4 3125 B16R0.1183 CCCCCCCCCCN(C)C(=O)NCC 273464a_100015525214_100000207566 [0,1,1,0,0,0|2,0,0]=4 3126 B16R0.5205 CCCCCCCC(C)OCOC(=O)CCC 34a_200011215852_100000034017 [0,1,1,0,0,0|1,0,0]=3 3127 B16R0.5205 CCCCCCCC(C)SCOC(=O)CCC 62a_200011218727_100000034017 [0,1,1,0,0,0|1,0,0]=3 3128 B16R0.5205 CCCCCCCC(C)SCOC(=O)OCC 62a_200011218727_100000075025 [0,1,1,0,0,0|2,0,0]=4 3129 B16R0.5308 CCCCCCCCCCNS(=O)(=O)CCC 270084a_100000684558_100000211391 [0,1,1,0,0,0|2,0,0]=4 3130 B16R0.5308 CCCCCCCCCCNS(=O)(=O)CCC 274078a_100000684558_100000211391 [0,1,1,0,0,0|2,0,0]=4 3131 B16R0.5308 CCCCCCCCCCNS(=O)(=O)CCC 40a_100000684558_100000054278 [0,1,1,0,0,0|2,0,0]=4 3132 B16R0.5308 CCCCCCCCCCOC(C)(C)CCC 7a_100000748436_100000210320 [0,1,1,0,0,0|1,0,1]=4 3133 B16R0.657 CCCCCCCCCN[C@H](CC)CC(=O)O 269956a_100016995926_100000210670 [0,1,1,0,0,0|2,0,0]=4 3134 B16R0.1194 CCCCCCCCO[C@@H](CC)CC(=O)OC 7a_200015357724_100000210759 [0,1,1,0,0,0|2,0,0]=4 3135 B16R0.3202 CCCCCCCCC(=O)C(CC)NC(=O)C 1458a_100000195128_100000210759 [0,1,1,0,0,0|1,0,1]=4 3136 B16R0.660 C/C=C/C(CCC)OCCCCCCCCC 34a_200016264281_100011214924 [0,1,1,0,0,0|2,0,0]=4 3137 B16R0.660 C/C=C/C(CCC)OCCCCCCCCC 7a_200016264281_100000210328 [0,1,1,0,0,0|2,0,0]=4 3138 B16R0.660 C=CCC(CCC)OCCCCCCCCC 34a_100011215139_100011214924 [0,1,1,0,0,0|2,0,0]=4 3139 B16R0.660 C=CCC(CCC)OCCCCCCCCC 7a_100011215139_100000210328 [0,1,1,0,0,0|2,0,0]=4 3140 B16R0.1182 CCCCCCCCCCC(C)OC(C)CC 34a_100011215000_100011215416 [0,1,1,0,0,0|1,0,1]=4 3141 B16R0.1182 CCCCCCCCCCC(C)OC(C)CC 7a_100011215000_100000758301 [0,1,1,0,0,0|1,0,1]=4 3142 B16R0.1182 CCCCCCCCCCN(C)CC(=O)CC 269982a_100000207566_100000747405 [0,1,1,0,0,0|2,0,0]=4 3143 B16R0.1182 CCCCCCCCCNC(C)CC(=O)OC 2230a_100000212291_100009817358 [0,1,1,0,0,0|2,0,0]=4 3144 B16R0.1182 CCCCCCCCCNC(C)CC(=O)OC 34a_100000212291_100009817358 [0,1,1,0,0,0|2,0,0]=4 3145 B16R0.1182 CCCCCCCCCOC(C)CC(=O)OC 34a_100000210712_100009817358 [0,1,1,0,0,0|2,0,0]=4 3146 B16R0.1182 CCCCCCCCCOC(C)CC(=O)OC 7a_100000210712_100009817358 [0,1,1,0,0,0|2,0,0]=4 3147 B16R0.1182 CCCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100000210670 [0,1,1,0,0,0|2,0,0]=4 3148 B16R0.1191 CCCCCCCCCN(C)CC(=O)C(C)C 2230a_100000232482_100000753385 [0,1,1,0,0,0|2,0,0]=4 3149 B16R0.1191 CCCCCCCCCN(C)CC(=O)C(C)C 269982a_100000232482_100000753385 [0,1,1,0,0,0|2,0,0]=4 3150 B16R0.1204 CCCCCCCCCC(C)OC(CC)CC 7a_100011218016_100000210505 [0,1,1,0,0,0|1,0,1]=4 3151 B16R0.1675 CCCCCCCCCC(C)OC(C)(C)CC 7a_100011218016_100000210677 [0,1,1,0,0,0|1,0,1]=4 3152 B16R0.3180 CCCCCCCCC(=O)C(C)NC(=O)CC 1458a_100000194823_100000210759 [0,1,1,0,0,0|1,0,1]=4 3153 B16R0.4852 CCCCCCCCCN(C)C(C)C(=O)CC 2230a_100000232482_100000742827 [0,1,1,0,0,0|2,0,0]=4 3154 B16R0.4852 CCCCCCCCCN(C)C(C)C(=O)CC 269982a_100000232482_100000742827 [0,1,1,0,0,0|2,0,0]=4 3155 B16R1.64 CCCCCCCCC(=O)C1C=CCCC1 1458a_100000210188_100000751183 [1,1,0,0,0,0|1,0,1]=4 3156 B16R1.64 CCCCCCCCC(=O)C1CCCCO1 1458a_100000748299_100000210759 [1,1,0,0,0,0|0,0,2]=4 3157 B16R1.64 CCCCCCCCN(C)C1C=CCCC1 2230a_100000207567_100000751183 [1,1,0,0,0,0|2,0,0]=4 3158 B16R1.64 CCCCCCCCN(C)C1C=CCCC1 269982a_100000207567_100000751183 [1,1,0,0,0,0|2,0,0]=4 3159 B16R1.596 CC(C)CCCCCCNC1C=CCCC1 2230a_100000211014_100000751183 [1,1,0,0,0,0|2,0,0]=4 3160 B16R1.596 CC(C)CCCCCNCC1CCCCO1 2230a_100000174945_100000210682 [1,1,0,0,0,0|1,0,1]=4 3161 B16R1.596 CC(C)CCCCCNCC1CCCCO1 2230a_100011290863_100000211543 [1,1,0,0,0,0|1,0,1]=4 3162 B16R1.596 CC(C)CCCCCNCC1CCCCO1 34a_100000174945_100000210682 [1,1,0,0,0,0|1,0,1]=4 3163 B16R1.596 CC(C)CCCCCNCC1CCCCO1 34a_100011290863_100000211543 [1,1,0,0,0,0|1,0,1]=4 3164 B16R1.596 CC(C)CCCCCOCC1CCC=CO1 34a_100011217868_100000210682 [1,1,0,0,0,0|1,0,1]=4 3165 B16R1.596 CC(C)CCCCCOCC1CCCCO1 34a_100000211370_100000210682 [1,1,0,0,0,0|1,0,1]=4 3166 B16R1.596 CC(C)CCCCCOCC1CCCCO1 34a_100011995859_100000211543 [1,1,0,0,0,0|1,0,1]=4 3167 B16R1.596 CC(C)CCCCCOCC1CCCCO1 7a_100000211370_100000210682 [1,1,0,0,0,0|1,0,1]=4 3168 B16R1.596 CC(C)CCCCCOCC1CCCCO1 7a_100011995859_100000211543 [1,1,0,0,0,0|1,0,1]=4 3169 B16R1.596 CC(C)CCCCCSCC1CCCCO1 62a_100000210682_100000211543 [1,1,0,0,0,0|1,0,1]=4 3170 B16R1.596 CC(C)CCCCCSCC1CCCCO1 62a_100000211543_100000210682 [1,1,0,0,0,0|1,0,1]=4 3171 B16R1.596 CC(C)CCCCNCCC1CCCCO1 2230a_100015183643_100011216152 [1,1,0,0,0,0|1,0,1]=4 3172 B16R1.596 CC(C)CCCCNCCC1CCCCO1 34a_100015183643_100011216152 [1,1,0,0,0,0|1,0,1]=4 3173 B16R1.643 BrCCCCCCCCOC1C=CCCC1 7a_100009813846_100000751183 [1,1,0,0,0,0|2,0,0]=4 3174 B16R1.643 BrCCCCCCCOCC1CCCCO1 34a_100000760002_100000211543 [1,1,0,0,0,0|1,0,1]=4 3175 B16R1.643 BrCCCCCCCOCC1CCCCO1 7a_100000760002_100000211543 [1,1,0,0,0,0|1,0,1]=4 3176 B16R1.643 CCCCCCCCCNC1C=CCCC1 2230a_100000212291_100000751183 [1,1,0,0,0,0|1,0,0]=3 3177 B16R1.643 CCCCCCCCCNC1CCCCC1 2230a_100000182618_100011214924 [1,1,0,0,0,0|1,0,1]=4 3178 B16R1.643 CCCCCCCCCNC1CCCCC1 270004a_100000212291_100000210434 [1,1,0,0,0,0|1,0,1]=4 3179 B16R1.643 CCCCCCCCCNC1CCCCC1 34a_100000182618_100011214924 [1,1,0,0,0,0|1,0,1]=4 3180 B16R1.643 CCCCCCCCCNC1CCCCC1 34a_100000212291_100000210327 [1,1,0,0,0,0|1,0,1]=4 3181 B16R1.643 CCCCCCCCCNC1CCCOC1 2230a_100000719290_100011214924 [1,1,0,0,0,0|2,0,0]=4 3182 B16R1.643 CCCCCCCCCNC1CCCOC1 270004a_100000212291_100000753404 [1,1,0,0,0,0|2,0,0]=4 3183 B16R1.643 CCCCCCCCCNC1CCCOC1 34a_100000212291_100000693364 [1,1,0,0,0,0|2,0,0]=4 3184 B16R1.643 CCCCCCCCCNC1CCCOC1 34a_100000719290_100011214924 [1,1,0,0,0,0|2,0,0]=4 3185 B16R1.643 CCCCCCCCCNC1CCCSC1 270004a_100000212291_100000057913 [1,1,0,0,0,0|2,0,0]=4 3186 B16R1.643 CCCCCCCCCOC1C=CCCC1 34a_100011215024_100011214924 [1,1,0,0,0,0|1,0,0]=3 3187 B16R1.643 CCCCCCCCCOC1C=CCCC1 7a_100000210712_100000751183 [1,1,0,0,0,0|1,0,0]=3 3188 B16R1.643 CCCCCCCCCOC1CC=CCC1 34a_100000073881_100011214924 [1,1,0,0,0,0|1,0,1]=4 3189 B16R1.643 CCCCCCCCCOC1CCCCC1 34a_100000210231_100011214924 [1,1,0,0,0,0|1,0,1]=4 3190 B16R1.643 CCCCCCCCCOC1CCCCC1 34a_100000210712_100000210327 [1,1,0,0,0,0|1,0,1]=4 3191 B16R1.643 CCCCCCCCCOC1CCCCC1 7a_100000210231_100000210328 [1,1,0,0,0,0|1,0,1]=4 3192 B16R1.643 CCCCCCCCCOC1CCCCC1 7a_100000210712_100000210327 [1,1,0,0,0,0|1,0,1]=4 3193 B16R1.643 CCCCCCCCCOC1CCCCO1 34a_100000033831_100011214924 [1,1,0,0,0,0|0,0,1]=3 3194 B16R1.643 CCCCCCCCCOC1CCCOC1 34a_100000210712_100000693364 [1,1,0,0,0,0|2,0,0]=4 3195 B16R1.643 CCCCCCCCCOC1CCCOC1 34a_100000754041_100011214924 [1,1,0,0,0,0|2,0,0]=4 3196 B16R1.643 CCCCCCCCCOC1CCCOC1 7a_100000210712_100000693364 [1,1,0,0,0,0|2,0,0]=4 3197 B16R1.643 CCCCCCCCCOC1CCCSC1 7a_100015962668_100000210328 [1,1,0,0,0,0|2,0,0]=4 3198 B16R1.643 CCCCCCCCCSC1C=CCCC1 62a_100000751183_100000210670 [1,1,0,0,0,0|1,0,0]=3 3199 B16R1.643 CCCCCCCCCSC1CCCCC1 62a_100000210327_100000210670 [1,1,0,0,0,0|1,0,1]=4 3200 B16R1.643 CCCCCCCCNCC1CC=CCC1 270004a_100000229939_100000189434 [1,1,0,0,0,0|1,0,1]=4 3201 B16R1.643 CCCCCCCCNCC1CCCCC1 2230a_100000210473_100000210759 [1,1,0,0,0,0|1,0,1]=4 3202 B16R1.643 CCCCCCCCNCC1CCCCC1 2230a_100000229939_100000211423 [1,1,0,0,0,0|1,0,1]=4 3203 B16R1.643 CCCCCCCCNCC1CCCCC1 269862a_100000229939_100000211278 [1,1,0,0,0,0|1,0,1]=4 3204 B16R1.643 CCCCCCCCNCC1CCCCC1 34a_100000210473_100000210759 [1,1,0,0,0,0|1,0,1]=4 3205 B16R1.643 CCCCCCCCNCC1CCCCC1 34a_100000229939_100000211423 [1,1,0,0,0,0|1,0,1]=4 3206 B16R1.643 CCCCCCCCNCC1CCCCO1 2230a_100000174945_100000210759 [1,1,0,0,0,0|0,0,1]=3 3207 B16R1.643 CCCCCCCCNCC1CCCCO1 2230a_100000229939_100000211543 [1,1,0,0,0,0|0,0,1]=3 3208 B16R1.643 CCCCCCCCNCC1CCCCO1 34a_100000174945_100000210759 [1,1,0,0,0,0|0,0,1]=3 3209 B16R1.643 CCCCCCCCNCC1CCCCO1 34a_100000229939_100000211543 [1,1,0,0,0,0|0,0,1]=3 3210 B16R1.643 CCCCCCCCNCC1CCCOC1 2230a_100000229939_100000741521 [1,1,0,0,0,0|2,0,0]=4 3211 B16R1.643 CCCCCCCCNCC1CCCOC1 2230a_100000720124_100000210759 [1,1,0,0,0,0|2,0,0]=4 3212 B16R1.643 CCCCCCCCNCC1CCCOC1 34a_100000229939_100000741521 [1,1,0,0,0,0|2,0,0]=4 3213 B16R1.643 CCCCCCCCNCC1CCCOC1 34a_100000720124_100000210759 [1,1,0,0,0,0|2,0,0]=4 3214 B16R1.643 CCCCCCCCNC[C@H]1COCCO1 2230a_100010981119_100000210759 [1,1,0,0,0,0|1,0,1]=4 3215 B16R1.643 CCCCCCCCNC[C@H]1COCCO1 34a_100010981119_100000210759 [1,1,0,0,0,0|1,0,1]=4 3216 B16R1.643 CCCCCCCCOCC1CC=CCC1 34a_100000210713_100000210759 [1,1,0,0,0,0|1,0,1]=4 3217 B16R1.643 CCCCCCCCOCC1CCC=CO1 34a_100011217868_100000210759 [1,1,0,0,0,0|0,0,1]=3 3218 B16R1.643 CCCCCCCCOCC1CCCCC1 34a_100000210232_100000211423 [1,1,0,0,0,0|1,0,1]=4 3219 B16R1.643 CCCCCCCCOCC1CCCCC1 34a_100000212181_100000210759 [1,1,0,0,0,0|1,0,1]=4 3220 B16R1.643 CCCCCCCCOCC1CCCCC1 7a_100000210232_100000211423 [1,1,0,0,0,0|1,0,1]=4 3221 B16R1.643 CCCCCCCCOCC1CCCCC1 7a_100000212181_100000210759 [1,1,0,0,0,0|1,0,1]=4 3222 B16R1.643 CCCCCCCCOCC1CCCCN1 34a_100000210821_100000210759 [1,1,0,0,0,0|1,0,1]=4 3223 B16R1.643 CCCCCCCCOCC1CCCCO1 34a_100000210232_100000211543 [1,1,0,0,0,0|0,0,1]=3 3224 B16R1.643 CCCCCCCCOCC1CCCCO1 34a_100000211370_100000210759 [1,1,0,0,0,0|0,0,1]=3 3225 B16R1.643 CCCCCCCCOCC1CCCCO1 7a_100000210232_100000211543 [1,1,0,0,0,0|0,0,1]=3 3226 B16R1.643 CCCCCCCCOCC1CCCCO1 7a_100000211370_100000210759 [1,1,0,0,0,0|0,0,1]=3 3227 B16R1.643 CCCCCCCCOCC1CCCNC1 34a_100000211344_100000210759 [1,1,0,0,0,0|2,0,0]=4 3228 B16R1.643 CCCCCCCCOCC1CCCOC1 34a_100000210232_100000741521 [1,1,0,0,0,0|2,0,0]=4 3229 B16R1.643 CCCCCCCCOCC1CCCOC1 34a_100000741520_100000210759 [1,1,0,0,0,0|2,0,0]=4 3230 B16R1.643 CCCCCCCCOCC1CCCOC1 7a_100000210232_100000741521 [1,1,0,0,0,0|2,0,0]=4 3231 B16R1.643 CCCCCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000210759 [1,1,0,0,0,0|1,0,1]=4 3232 B16R1.643 CCCCCCCCOC[C@H]1COCCO1 34a_100009875890_100000210759 [1,1,0,0,0,0|1,0,1]=4 3233 B16R1.643 CCCCCCCCSCC1CCCCC1 62a_100000210759_100000211423 [1,1,0,0,0,0|1,0,1]=4 3234 B16R1.643 CCCCCCCCSCC1CCCCC1 62a_100000211423_100000210317 [1,1,0,0,0,0|1,0,1]=4 3235 B16R1.643 CCCCCCCCSCC1CCCCO1 62a_100000210759_100000211543 [1,1,0,0,0,0|0,0,1]=3 3236 B16R1.643 CCCCCCCCSCC1CCCCO1 62a_100000211543_100000210317 [1,1,0,0,0,0|0,0,1]=3 3237 B16R1.643 CCCCCCCCSCC1CCCOC1 62a_100000210759_100000741521 [1,1,0,0,0,0|2,0,0]=4 3238 B16R1.643 CCCCCCCCSCC1CCCOC1 62a_100000741521_100000210317 [1,1,0,0,0,0|2,0,0]=4 3239 B16R1.643 CCCCCCCNCCC1CCCCC1 2230a_100000229938_100012355289 [1,1,0,0,0,0|1,0,1]=4 3240 B16R1.643 CCCCCCCNCCC1CCCCC1 2230a_100000738074_100000210681 [1,1,0,0,0,0|1,0,1]=4 3241 B16R1.643 CCCCCCCNCCC1CCCCC1 270004a_100000229938_100011713444 [1,1,0,0,0,0|1,0,1]=4 3242 B16R1.643 CCCCCCCNCCC1CCCCC1 34a_100000738074_100000210614 [1,1,0,0,0,0|1,0,1]=4 3243 B16R1.643 CCCCCCCNCCC1CCCCO1 2230a_100015183643_100000210681 [1,1,0,0,0,0|0,0,1]=3 3244 B16R1.643 CCCCCCCNCCC1CCCCO1 34a_100015183643_100000210614 [1,1,0,0,0,0|0,0,1]=3 3245 B16R1.643 CCCCCCCNCCC1OCCCO1 2230a_100000229938_100000764188 [1,1,0,0,0,0|1,0,1]=4 3246 B16R1.643 CCCCCCCOCCC1CCCCC1 34a_100000210272_100011209188 [1,1,0,0,0,0|1,0,1]=4 3247 B16R1.643 CCCCCCCOCCC1CCCCC1 34a_100011217863_100000210614 [1,1,0,0,0,0|1,0,1]=4 3248 B16R1.643 CCCCCCCOCCC1CCCCC1 7a_100000210272_100011273959 [1,1,0,0,0,0|1,0,1]=4 3249 B16R1.643 CCCCCCCOCCC1CCCCC1 7a_100011217863_100000210614 [1,1,0,0,0,0|1,0,1]=4 3250 B16R1.643 CCCCCCCOCCC1CCCCN1 34a_100000211664_100000210614 [1,1,0,0,0,0|1,0,1]=4 3251 B16R1.643 CCCCCCCOCCC1CCCNC1 34a_100000752241_100000210614 [1,1,0,0,0,0|2,0,0]=4 3252 B16R1.643 CCCCCCCOCCC1OCCCO1 34a_100000210272_100000764188 [1,1,0,0,0,0|1,0,1]=4 3253 B16R1.643 CCCCCCCOCCC1OCCCO1 7a_100000210272_100000764188 [1,1,0,0,0,0|1,0,1]=4 3254 B16R1.643 CCCCCCCSCCC1CCCCC1 62a_100000210614_100012355289 [1,1,0,0,0,0|1,0,1]=4 3255 B16R1.643 CCCCCCCSCCC1CCCCC1 62a_100012355289_100000210316 [1,1,0,0,0,0|1,0,1]=4 3256 B16R1.643 CCCCCCCSCCC1OCCCO1 62a_100000210614_100000764188 [1,1,0,0,0,0|1,0,1]=4 3257 B16R1.643 CCCCCCCSCCC1OCCCO1 62a_100000764188_100000210316 [1,1,0,0,0,0|1,0,1]=4 3258 B16R1.643 CCCCCCNCCCC1CCCCC1 2230a_100000210581_100011713725 [1,1,0,0,0,0|1,0,1]=4 3259 B16R1.643 CCCCCCNCCCC1CCCCC1 2230a_100011211642_100000210314 [1,1,0,0,0,0|1,0,1]=4 3260 B16R1.643 CCCCCCNCCCC1CCCCC1 34a_100011211642_100000210314 [1,1,0,0,0,0|1,0,1]=4 3261 B16R1.643 CCCCCCNCCOC1CCCCO1 2230a_100000210581_100000744793 [1,1,0,0,0,0|1,0,1]=4 3262 B16R1.643 CCCCCCOCCCC1CCCCC1 34a_100000198086_100000210314 [1,1,0,0,0,0|1,0,1]=4 3263 B16R1.643 CCCCCCOCCCC1CCCCC1 34a_100000210259_100011713725 [1,1,0,0,0,0|1,0,1]=4 3264 B16R1.643 CCCCCCOCCCC1CCCCC1 7a_100000198086_100000210314 [1,1,0,0,0,0|1,0,1]=4 3265 B16R1.643 CCCCCCOCCCC1CCCCC1 7a_100000210259_100011713725 [1,1,0,0,0,0|1,0,1]=4 3266 B16R1.643 CCCCCCOCCCC1CCCCN1 34a_100011934581_100000210314 [1,1,0,0,0,0|1,0,1]=4 3267 B16R1.643 CCCCCCOCCCC1CCCNC1 34a_100150707839_100000210314 [1,1,0,0,0,0|2,0,0]=4 3268 B16R1.643 CCCCCCOCCOC1C=CCCC1 7a_100000691444_100000751183 [1,1,0,0,0,0|2,0,0]=4 3269 B16R1.643 CCCCCCOCCOC1CCCCO1 34a_100000034223_100000210314 [1,1,0,0,0,0|1,0,1]=4 3270 B16R1.643 CCCCCCOCCOC1CCCCO1 34a_100000210259_100000744793 [1,1,0,0,0,0|1,0,1]=4 3271 B16R1.643 CCCCCCOCCOC1CCCCO1 7a_100000034223_100000210314 [1,1,0,0,0,0|1,0,1]=4 3272 B16R1.643 CCCCCCOCCOC1CCCCO1 7a_100000210259_100000744793 [1,1,0,0,0,0|1,0,1]=4 3273 B16R1.643 CCCCCCSCCCC1CCCCC1 62a_100000210314_100011713725 [1,1,0,0,0,0|1,0,1]=4 3274 B16R1.643 CCCCCCSCCCC1CCCCC1 62a_100011713725_100000210757 [1,1,0,0,0,0|1,0,1]=4 3275 B16R1.643 CCCCCCSCCOC1CCCCO1 62a_100000210314_100000744793 [1,1,0,0,0,0|1,0,1]=4 3276 B16R1.643 CCCCCCSCCOC1CCCCO1 62a_100000744793_100000210757 [1,1,0,0,0,0|1,0,1]=4 3277 B16R1.643 CCCCCNCCCOC1CCCCO1 2230a_100000209983_100000700653 [1,1,0,0,0,0|1,0,1]=4 3278 B16R1.643 CCCCCNCCOCC1CCCCO1 34a_100000224656_100000211543 [1,1,0,0,0,0|1,0,1]=4 3279 B16R1.643 CCCCCOCCCCC1CCCCC1 34a_100011215267_100000718602 [1,1,0,0,0,0|1,0,1]=4 3280 B16R1.643 CCCCCOCCCCC1CCCCC1 7a_100011215267_100000210326 [1,1,0,0,0,0|1,0,1]=4 3281 B16R1.643 CCCCCOCCCOC1CCCCO1 34a_100000210253_100000700653 [1,1,0,0,0,0|1,0,1]=4 3282 B16R1.643 CCCCCOCCCOC1CCCCO1 7a_100000210253_100000700653 [1,1,0,0,0,0|1,0,1]=4 3283 B16R1.643 CCCCCOCCOCC1CCCCO1 34a_100011215259_100000211543 [1,1,0,0,0,0|1,0,1]=4 3284 B16R1.643 CCCCCOCCOCC1CCCCO1 7a_100011215259_100000211543 [1,1,0,0,0,0|1,0,1]=4 3285 B16R1.643 CCCCCSCCCOC1CCCCO1 62a_100000210326_100000700653 [1,1,0,0,0,0|1,0,1]=4 3286 B16R1.643 CCCCCSCCCOC1CCCCO1 62a_100000700653_100000210326 [1,1,0,0,0,0|1,0,1]=4 3287 B16R1.643 CCCCNCCCCOC1CCCCO1 2230a_100000102301_100000031530 [1,1,0,0,0,0|1,0,1]=4 3288 B16R1.643 CCCCNCCCCOC1CCCCO1 7a_106832991798_100000031530 [1,1,0,0,0,0|1,0,1]=4 3289 B16R1.643 CCCCOCCCCOC1C=CCCC1 7a_200000760531_100000751183 [1,1,0,0,0,0|2,0,0]=4 3290 B16R1.643 CCCCOCCCCOC1CCCCO1 34a_100000210227_100000031530 [1,1,0,0,0,0|1,0,1]=4 3291 B16R1.643 CCCCOCCCCOC1CCCCO1 7a_100000210227_100000031530 [1,1,0,0,0,0|1,0,1]=4 3292 B16R1.643 CCCCOCCCNCC1CCCCO1 2230a_200000211371_100000211543 [1,1,0,0,0,0|1,0,1]=4 3293 B16R1.643 CCCCOCCCNCC1CCCCO1 34a_200000211371_100000211543 [1,1,0,0,0,0|1,0,1]=4 3294 B16R1.643 CCCCOCCCOCC1CCCCO1 34a_200011215613_100000211543 [1,1,0,0,0,0|1,0,1]=4 3295 B16R1.643 CCCCOCCCOCC1CCCCO1 7a_200011215613_100000211543 [1,1,0,0,0,0|1,0,1]=4 3296 B16R1.643 CCCCOCCNCCC1CCCCO1 2230a_100015183643_100000743108 [1,1,0,0,0,0|1,0,1]=4 3297 B16R1.643 CCCCOCCNCCC1CCCCO1 34a_100015183643_100000743108 [1,1,0,0,0,0|1,0,1]=4 3298 B16R1.643 CCCCSCCCCOC1CCCCO1 62a_100000031530_100000210210 [1,1,0,0,0,0|1,0,1]=4 3299 B16R1.643 CCCCSCCCCOC1CCCCO1 62a_100000210211_100000031530 [1,1,0,0,0,0|1,0,1]=4 3300 B16R1.643 CCNCCCCCCOC1CCCCO1 2230a_100015525214_100000033462 [1,1,0,0,0,0|1,0,1]=4 3301 B16R1.643 CCOCCCCCCOC1CCCCO1 34a_100121572206_100000033462 [1,1,0,0,0,0|1,0,1]=4 3302 B16R1.643 CCSCCCCCCOC1CCCCO1 62a_100000033462_100000210202 [1,1,0,0,0,0|1,0,1]=4 3303 B16R1.643 CCSCCCCCCOC1CCCCO1 62a_100000210202_100000033462 [1,1,0,0,0,0|1,0,1]=4 3304 B16R1.643 COCCCCCCNCC1CCCCO1 2230a_100000174945_100011998445 [1,1,0,0,0,0|1,0,1]=4 3305 B16R1.643 COCCCCCCNCC1CCCCO1 34a_100000174945_100011998445 [1,1,0,0,0,0|1,0,1]=4 3306 B16R1.643 COCCCCCCOCC1CCC=CO1 34a_100011217868_100011998445 [1,1,0,0,0,0|1,0,1]=4 3307 B16R1.643 COCCCCCCOCC1CCCCO1 34a_100000211370_100011998445 [1,1,0,0,0,0|1,0,1]=4 3308 B16R1.643 COCCCCCCOCC1CCCCO1 34a_200012092642_100000211543 [1,1,0,0,0,0|1,0,1]=4 3309 B16R1.643 COCCCCCCOCC1CCCCO1 7a_100000211370_100011998445 [1,1,0,0,0,0|1,0,1]=4 3310 B16R1.643 COCCCCCCOCC1CCCCO1 7a_200012092642_100000211543 [1,1,0,0,0,0|1,0,1]=4 3311 B16R1.643 COCCCCCCSCC1CCCCO1 62a_100000211543_100011998445 [1,1,0,0,0,0|1,0,1]=4 3312 B16R1.643 COCCCCCCSCC1CCCCO1 62a_100011998445_100000211543 [1,1,0,0,0,0|1,0,1]=4 3313 B16R1.643 ClCCCCCCCCOC1C=CCCC1 7a_100000033203_100000751183 [1,1,0,0,0,0|2,0,0]=4 3314 B16R1.643 FCCCCCCNCCC1CCCCO1 2230a_100015183643_100015922095 [1,1,0,0,0,0|1,0,1]=4 3315 B16R1.643 FCCCCCCNCCC1CCCCO1 34a_100015183643_100015922095 [1,1,0,0,0,0|1,0,1]=4 3316 B16R1.643 NCCCCCCCOCC1CCCCO1 34a_100011996573_100000211543 [1,1,0,0,0,0|1,0,1]=4 3317 B16R1.643 OCCCCCCCCNC1C=CCCC1 2230a_102515433106_100000751183 [1,1,0,0,0,0|2,0,0]=4 3318 B16R1.643 OCCCCCCCCOC1C=CCCC1 34a_100011215024_100000033203 [1,1,0,0,0,0|2,0,0]=4 3319 B16R1.643 OCCCCCCCCOC1CCCCO1 34a_100000033831_100000033203 [1,1,0,0,0,0|1,0,1]=4 3320 B16R1.643 OCCCCCCCCSC1C=CCCC1 62a_100000033203_100000751183 [1,1,0,0,0,0|2,0,0]=4 3321 B16R1.643 OCCCCCCCCSC1C=CCCC1 62a_100000751183_100000033203 [1,1,0,0,0,0|2,0,0]=4 3322 B16R1.643 OCCCCCCCNCC1CCCCO1 2230a_100000174945_100000760002 [1,1,0,0,0,0|1,0,1]=4 3323 B16R1.643 OCCCCCCCNCC1CCCCO1 2230a_100011996573_100000211543 [1,1,0,0,0,0|1,0,1]=4 3324 B16R1.643 OCCCCCCCNCC1CCCCO1 34a_100000174945_100000760002 [1,1,0,0,0,0|1,0,1]=4 3325 B16R1.643 OCCCCCCCNCC1CCCCO1 34a_100011996573_100000211543 [1,1,0,0,0,0|1,0,1]=4 3326 B16R1.643 OCCCCCCCOCC1CCC=CO1 34a_100011217868_100000760002 [1,1,0,0,0,0|1,0,1]=4 3327 B16R1.643 OCCCCCCCOCC1CCCCO1 34a_100000211370_100000760002 [1,1,0,0,0,0|1,0,1]=4 3328 B16R1.643 OCCCCCCCOCC1CCCCO1 7a_100000211370_100000760002 [1,1,0,0,0,0|1,0,1]=4 3329 B16R1.643 OCCCCCCCSCC1CCCCO1 62a_100000211543_100000760002 [1,1,0,0,0,0|1,0,1]=4 3330 B16R1.643 OCCCCCCCSCC1CCCCO1 62a_100000760002_100000211543 [1,1,0,0,0,0|1,0,1]=4 3331 B16R1.643 OCCCCCCNCCC1CCCCO1 2230a_100015183643_100000766143 [1,1,0,0,0,0|1,0,1]=4 3332 B16R1.643 OCCCCCCNCCC1CCCCO1 34a_100015183643_100000766143 [1,1,0,0,0,0|1,0,1]=4 3333 B16R1.688 CCCCCCC(C)NCC1CCCCO1 2230a_100000174945_100011215978 [1,1,0,0,0,0|1,0,1]=4 3334 B16R1.688 CCCCCCC(C)NCC1CCCCO1 2230a_100000210919_100000211543 [1,1,0,0,0,0|1,0,1]=4 3335 B16R1.688 CCCCCCC(C)NCC1CCCCO1 270004a_100000174945_100000210826 [1,1,0,0,0,0|1,0,1]=4 3336 B16R1.688 CCCCCCC(C)NCC1CCCCO1 34a_100000174945_100011215978 [1,1,0,0,0,0|1,0,1]=4 3337 B16R1.688 CCCCCCC(C)NCC1CCCCO1 34a_100000210919_100000211543 [1,1,0,0,0,0|1,0,1]=4 3338 B16R1.688 CCCCCCC(C)OCC1CCC=CO1 34a_100011217868_100011215978 [1,1,0,0,0,0|1,0,1]=4 3339 B16R1.688 CCCCCCC(C)OCC1CCCCO1 34a_100000210265_100000211543 [1,1,0,0,0,0|1,0,1]=4 3340 B16R1.688 CCCCCCC(C)OCC1CCCCO1 34a_100000211370_100011215978 [1,1,0,0,0,0|1,0,1]=4 3341 B16R1.688 CCCCCCC(C)OCC1CCCCO1 7a_100000210265_100000211543 [1,1,0,0,0,0|1,0,1]=4 3342 B16R1.688 CCCCCCC(C)OCC1CCCCO1 7a_100000211370_100011215978 [1,1,0,0,0,0|1,0,1]=4 3343 B16R1.688 CCCCCCC(C)SCC1CCCCO1 62a_100000211543_100011215978 [1,1,0,0,0,0|1,0,1]=4 3344 B16R1.688 CCCCCCC(C)SCC1CCCCO1 62a_100011215978_100000211543 [1,1,0,0,0,0|1,0,1]=4 3345 B16R1.688 CCCCCCN(C)CCC1CCCCO1 2230a_100015183322_100000210314 [1,1,0,0,0,0|1,0,1]=4 3346 B16R1.688 CCCCCCN(C)CCC1CCCCO1 269982a_100015183322_100000210757 [1,1,0,0,0,0|1,0,1]=4 3347 B16R1.688 CCCCCCN(C)CCC1CCCCO1 34a_100015183322_100000210314 [1,1,0,0,0,0|1,0,1]=4 3348 B16R1.693 CCCCCCCC(=O)CC1CCCCO1 1458a_100000211969_100000211543 [1,1,0,0,0,0|0,0,2]=4 3349 B16R1.693 CCCCCCCC(=O)CC1CCCCO1 1458a_100000238585_100000210614 [1,1,0,0,0,0|0,0,2]=4 3350 B16R1.693 CCCCCCCC(C)OC1C=CCCC1 34a_100011215024_200011218727 [1,1,0,0,0,0|2,0,0]=4 3351 B16R1.693 CCCCCCCC(C)OC1C=CCCC1 7a_200011215852_100000751183 [1,1,0,0,0,0|2,0,0]=4 3352 B16R1.693 CCCCCCCC(C)OC1CCCCO1 34a_100000033831_200011218727 [1,1,0,0,0,0|1,0,1]=4 3353 B16R1.693 CCCCCCCC(C)SC1C=CCCC1 62a_100000751183_200011218727 [1,1,0,0,0,0|2,0,0]=4 3354 B16R1.693 CCCCCCCC(C)SC1C=CCCC1 62a_200011218727_100000751183 [1,1,0,0,0,0|2,0,0]=4 3355 B16R1.693 CCCCCCCN(C)CC1CCCCO1 2230a_100000225654_100000210681 [1,1,0,0,0,0|1,0,1]=4 3356 B16R1.693 CCCCCCCN(C)CC1CCCCO1 2230a_100000228206_100000211543 [1,1,0,0,0,0|1,0,1]=4 3357 B16R1.693 CCCCCCCN(C)CC1CCCCO1 269982a_100000225654_100000210681 [1,1,0,0,0,0|1,0,1]=4 3358 B16R1.693 CCCCCCCN(C)CC1CCCCO1 269982a_100000228206_100000211543 [1,1,0,0,0,0|1,0,1]=4 3359 B16R1.693 CCCCCCCN(C)CC1CCCCO1 34a_100000225654_100000210614 [1,1,0,0,0,0|1,0,1]=4 3360 B16R1.932 CCCC(C)CCCOCC1CCCCO1 34a_100011713154_100000211543 [1,1,0,0,0,0|1,0,1]=4 3361 B16R1.932 CCCC(C)CCCOCC1CCCCO1 7a_100011713154_100000211543 [1,1,0,0,0,0|1,0,1]=4 3362 B16R1.1166 CCC(C)CCCCCOC1C=CCCC1 7a_200000035636_100000751183 [1,1,0,0,0,0|2,0,0]=4 3363 B16R1.1694 CCCCCC(C)NCCC1CCCCO1 2230a_100015183643_200011218191 [1,1,0,0,0,0|1,0,1]=4 3364 B16R1.1694 CCCCCC(C)NCCC1CCCCO1 270004a_100015183643_100000211708 [1,1,0,0,0,0|1,0,1]=4 3365 B16R1.1694 CCCCCC(C)NCCC1CCCCO1 34a_100015183643_200011218191 [1,1,0,0,0,0|1,0,1]=4 3366 B16R1.52 CCCCCC(C)OCC1CCCC(=O)N1 34a_200000102386_200011218191 [1,1,0,0,0,0|2,0,0]=4 3367 B16R1.55 CCCCCCC(C)OC1CCCC(=O)C1 34a_100012613340_100011215978 [1,1,0,0,0,0|2,0,0]=4 3368 B16R1.75 CCCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210314 [1,1,0,0,0,0|2,0,0]=4 3369 B16R1.75 CCCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210314 [1,1,0,0,0,0|2,0,0]=4 3370 B16R1.83 CC(C)CCCCCOC1CCCC(=O)C1 34a_100012613340_100000210682 [1,1,0,0,0,0|2,0,0]=4 3371 B16R1.83 CC(C)CCCCOCC1CCCC(=O)N1 34a_200000102386_100011216152 [1,1,0,0,0,0|2,0,0]=4 3372 B16R1.92 CCCCCCCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000210614 [1,1,0,0,0,0|1,0,1]=4 3373 B16R1.63 CCCCCCCCC(=O)C1CCC(=O)N1 1458a_100000210400_100000210759 [0,1,0,0,1,0|1,0,1]=4 3374 B16R1.63 CCCCCCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000210759 [0,1,0,0,1,0|0,0,1]=3 3375 B16R1.63 CCCCCCCNC(=O)[C@@H]1CCC(=O)O1 11a_100000229938_100009814974 [0,1,0,0,1,0|1,0,1]=4 3376 B16R1.63 CCCCCCCNC(=O)[C@@H]1CCC(=O)O1 1626a_100000229938_100009814974 [0,1,0,0,1,0|1,0,1]=4 3377 B16R1.63 CCCCCCCNC(=O)[C@@H]1CCC(=O)O1 240690a_100000229938_100009814974 [0,1,0,0,1,0|1,0,1]=4 3378 B16R1.63 CCCCCCCNC(=O)[C@@H]1CCC(=O)O1 527a_100000229938_100009814974 [0,1,0,0,1,0|1,0,1]=4 3379 B16R1.63 COCCCCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100011998445 [0,1,0,0,1,0|1,0,1]=4 3380 B16R1.63 O=C1CC[C@H](O1)C(=O)CCCCCCCO 1458a_100009814974_100000760002 [0,1,0,0,1,0|1,0,1]=4 3381 B16R1.642 CCCCCCCCCNC1CNC(=O)C1 2230a_100000697751_100011214924 [0,1,0,0,1,0|2,0,0]=4 3382 B16R1.642 CCCCCCCCCNC1COC(=O)O1 34a_100000212291_100000032252 [0,1,0,0,1,0|1,0,0]=3 3383 B16R1.642 CCCCCCCCCOC1CCC(=O)C1 34a_100012614533_100011214924 [0,1,0,0,1,0|1,0,0]=3 3384 B16R1.642 CCCCCCCCCOC1CNC(=O)C1 34a_100000690082_100011214924 [0,1,0,0,1,0|2,0,0]=4 3385 B16R1.642 CCCCCCCCCOC1COC(=O)O1 34a_100000210712_100000032252 [0,1,0,0,1,0|1,0,0]=3 3386 B16R1.642 CCCCCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210759 [0,1,0,0,1,0|2,0,0]=4 3387 B16R1.642 CCCCCCCCNCC1CNC(=O)C1 34a_100016993742_100000210759 [0,1,0,0,1,0|2,0,0]=4 3388 B16R1.642 CCCCCCCCNCC1CNC(=O)O1 2230a_100000229939_100000181169 [0,1,0,0,1,0|1,0,0]=3 3389 B16R1.642 CCCCCCCCNCC1CNC(=O)O1 34a_100000229939_100000181169 [0,1,0,0,1,0|1,0,0]=3 3390 B16R1.642 CCCCCCCCNCC1COC(=O)O1 34a_100000229939_100000073702 [0,1,0,0,1,0|1,0,0]=3 3391 B16R1.642 CCCCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000229939_100015189358 [0,1,0,0,1,0|1,0,0]=3 3392 B16R1.642 CCCCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210759 [0,1,0,0,1,0|1,0,0]=3 3393 B16R1.642 CCCCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210759 [0,1,0,0,1,0|1,0,0]=3 3394 B16R1.642 CCCCCCCCNC[C@H]1COC(=O)N1 2230a_100000229939_100015307671 [0,1,0,0,1,0|2,0,0]=4 3395 B16R1.642 CCCCCCCCNC[C@H]1COC(=O)N1 34a_100000229939_100015307671 [0,1,0,0,1,0|2,0,0]=4 3396 B16R1.642 CCCCCCCCOCC1CCC(=O)N1 34a_100000737831_100000210759 [0,1,0,0,1,0|1,0,0]=3 3397 B16R1.642 CCCCCCCCOCC1CNC(=O)C1 34a_100016041077_100000210759 [0,1,0,0,1,0|2,0,0]=4 3398 B16R1.642 CCCCCCCCOCC1CNC(=O)O1 34a_100000210232_100000181169 [0,1,0,0,1,0|1,0,0]=3 3399 B16R1.642 CCCCCCCCOCC1CNC(=O)O1 34a_100011315639_100000210759 [0,1,0,0,1,0|1,0,0]=3 3400 B16R1.642 CCCCCCCCOCC1CNC(=O)O1 7a_100000210232_100000181169 [0,1,0,0,1,0|1,0,0]=3 3401 B16R1.642 CCCCCCCCOCC1COC(=O)O1 34a_100000210232_100000073702 [0,1,0,0,1,0|1,0,0]=3 3402 B16R1.642 CCCCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210232_100015189358 [0,1,0,0,1,0|1,0,0]=3 3403 B16R1.642 CCCCCCCCOC[C@H]1COC(=O)N1 34a_100000210232_100015307671 [0,1,0,0,1,0|2,0,0]=4 3404 B16R1.642 CCCCCCCCOC[C@H]1COC(=O)N1 7a_100000210232_100015307671 [0,1,0,0,1,0|2,0,0]=4 3405 B16R1.642 CCCCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210317 [0,1,0,0,1,0|1,0,0]=3 3406 B16R1.642 CCCCCCCCSCC1CNC(=O)O1 62a_100000210759_100000181169 [0,1,0,0,1,0|1,0,0]=3 3407 B16R1.642 CCCCCCCCSCC1COC(=O)O1 62a_100000073702_100000210317 [0,1,0,0,1,0|1,0,0]=3 3408 B16R1.642 CCCCCCCCSCC1COC(=O)O1 62a_100000210759_100000073702 [0,1,0,0,1,0|1,0,0]=3 3409 B16R1.642 CCCCCCCCSC[C@@H]1CCC(=O)N1 62a_100000210759_100015189358 [0,1,0,0,1,0|1,0,0]=3 3410 B16R1.642 CCCCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210317 [0,1,0,0,1,0|1,0,0]=3 3411 B16R1.642 CCCCCCCCSC[C@H]1COC(=O)N1 62a_100000210759_100015307671 [0,1,0,0,1,0|2,0,0]=4 3412 B16R1.642 CCCCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210317 [0,1,0,0,1,0|2,0,0]=4 3413 B16R1.642 CCCCCCCOCCC1COS(=O)O1 7a_100000210272_100009840081 [0,1,0,0,1,0|2,0,0]=4 3414 B16R1.642 CCCCCCCSCCC1COS(=O)O1 62a_100000210614_100009840081 [0,1,0,0,1,0|2,0,0]=4 3415 B16R1.642 CCCCCCOCCOC1COC(=O)O1 34a_100000691444_100000032252 [0,1,0,0,1,0|2,0,0]=4 3416 B16R1.642 CCCCCNCCOCC1CNC(=O)O1 34a_100000224656_100000181169 [0,1,0,0,1,0|2,0,0]=4 3417 B16R1.642 CCCCCNCCOCC1COC(=O)O1 34a_100000224656_100000073702 [0,1,0,0,1,0|2,0,0]=4 3418 B16R1.642 CCCCCOCCOCC1CNC(=O)O1 34a_100011215259_100000181169 [0,1,0,0,1,0|2,0,0]=4 3419 B16R1.642 CCCCCOCCOCC1CNC(=O)O1 7a_100011215259_100000181169 [0,1,0,0,1,0|2,0,0]=4 3420 B16R1.642 CCCCCOCCOCC1COC(=O)O1 34a_100011215259_100000073702 [0,1,0,0,1,0|2,0,0]=4 3421 B16R1.642 CCCCCOCCOC[C@@H]1CCC(=O)N1 7a_100011215259_100015189358 [0,1,0,0,1,0|2,0,0]=4 3422 B16R1.642 CCCCNCCCCOC1COC(=O)O1 34a_200011216965_100000032252 [0,1,0,0,1,0|2,0,0]=4 3423 B16R1.642 CCCCOCCCCOC1COC(=O)O1 34a_200000760531_100000032252 [0,1,0,0,1,0|2,0,0]=4 3424 B16R1.642 CCCCOCCCNCC1CNC(=O)O1 2230a_200000211371_100000181169 [0,1,0,0,1,0|2,0,0]=4 3425 B16R1.642 CCCCOCCCNCC1CNC(=O)O1 34a_200000211371_100000181169 [0,1,0,0,1,0|2,0,0]=4 3426 B16R1.642 CCCCOCCCNCC1COC(=O)O1 34a_200000211371_100000073702 [0,1,0,0,1,0|2,0,0]=4 3427 B16R1.642 CCCCOCCCNC[C@@H]1CCC(=O)N1 2230a_200000211371_100015189358 [0,1,0,0,1,0|2,0,0]=4 3428 B16R1.642 CCCCOCCCOCC1CNC(=O)O1 34a_200011215613_100000181169 [0,1,0,0,1,0|2,0,0]=4 3429 B16R1.642 CCCCOCCCOCC1CNC(=O)O1 7a_200011215613_100000181169 [0,1,0,0,1,0|2,0,0]=4 3430 B16R1.642 CCCCOCCCOCC1COC(=O)O1 34a_200011215613_100000073702 [0,1,0,0,1,0|2,0,0]=4 3431 B16R1.642 CCCCOCCCOC[C@@H]1CCC(=O)N1 7a_200011215613_100015189358 [0,1,0,0,1,0|2,0,0]=4 3432 B16R1.642 COCCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011998445 [0,1,0,0,1,0|2,0,0]=4 3433 B16R1.642 COCCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100011998445 [0,1,0,0,1,0|2,0,0]=4 3434 B16R1.642 COCCCCCCOCC1CCC(=O)N1 34a_100000737831_100011998445 [0,1,0,0,1,0|2,0,0]=4 3435 B16R1.642 COCCCCCCOCC1CNC(=O)O1 34a_100011315639_100011998445 [0,1,0,0,1,0|2,0,0]=4 3436 B16R1.642 COCCCCCCOCC1CNC(=O)O1 34a_200012092642_100000181169 [0,1,0,0,1,0|2,0,0]=4 3437 B16R1.642 COCCCCCCOCC1CNC(=O)O1 7a_200012092642_100000181169 [0,1,0,0,1,0|2,0,0]=4 3438 B16R1.642 COCCCCCCOCC1COC(=O)O1 34a_200012092642_100000073702 [0,1,0,0,1,0|2,0,0]=4 3439 B16R1.642 COCCCCCCOC[C@@H]1CCC(=O)N1 7a_200012092642_100015189358 [0,1,0,0,1,0|2,0,0]=4 3440 B16R1.642 COCCCCCCSCC1CNC(=O)O1 62a_100000181169_100011998445 [0,1,0,0,1,0|2,0,0]=4 3441 B16R1.642 COCCCCCCSCC1CNC(=O)O1 62a_100011998445_100000181169 [0,1,0,0,1,0|2,0,0]=4 3442 B16R1.642 COCCCCCCSCC1COC(=O)O1 62a_100000073702_100011998445 [0,1,0,0,1,0|2,0,0]=4 3443 B16R1.642 COCCCCCCSCC1COC(=O)O1 62a_100011998445_100000073702 [0,1,0,0,1,0|2,0,0]=4 3444 B16R1.642 COCCCCCCSC[C@@H]1CCC(=O)N1 62a_100011998445_100015189358 [0,1,0,0,1,0|2,0,0]=4 3445 B16R1.642 COCCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011998445 [0,1,0,0,1,0|2,0,0]=4 3446 B16R1.642 NCCCCCCCCOC1COC(=O)O1 34a_102515433106_100000032252 [0,1,0,0,1,0|2,0,0]=4 3447 B16R1.642 NCCCCCCCOCC1CNC(=O)O1 34a_100011996573_100000181169 [0,1,0,0,1,0|2,0,0]=4 3448 B16R1.642 NCCCCCCCOCC1COC(=O)O1 34a_100011996573_100000073702 [0,1,0,0,1,0|2,0,0]=4 3449 B16R1.642 O=C1CCC(C1)OCCCCCCCCO 34a_100012614533_100000033203 [0,1,0,0,1,0|2,0,0]=4 3450 B16R1.642 O=C1CCC(N1)COCCCCCCCO 34a_100000737831_100000760002 [0,1,0,0,1,0|2,0,0]=4 3451 B16R1.642 O=C1CC[C@@H](N1)CNCCCCCCCO 2230a_100015423886_100000760002 [0,1,0,0,1,0|2,0,0]=4 3452 B16R1.642 O=C1CC[C@@H](N1)CNCCCCCCCO 34a_100015423886_100000760002 [0,1,0,0,1,0|2,0,0]=4 3453 B16R1.642 O=C1CC[C@H](N1)CNCCCCCCCO 2230a_100011996573_100015189358 [0,1,0,0,1,0|2,0,0]=4 3454 B16R1.642 O=C1CC[C@H](N1)COCCCCCCCBr 7a_100000760002_100015189358 [0,1,0,0,1,0|2,0,0]=4 3455 B16R1.642 O=C1CC[C@H](N1)CSCCCCCCCO 62a_100000760002_100015189358 [0,1,0,0,1,0|2,0,0]=4 3456 B16R1.642 O=C1CC[C@H](N1)CSCCCCCCCO 62a_100015189358_100000760002 [0,1,0,0,1,0|2,0,0]=4 3457 B16R1.642 O=C1NCC(O1)CNCCCCCCCO 2230a_100011996573_100000181169 [0,1,0,0,1,0|2,0,0]=4 3458 B16R1.642 O=C1NCC(O1)CNCCCCCCCO 34a_100011996573_100000181169 [0,1,0,0,1,0|2,0,0]=4 3459 B16R1.642 O=C1NCC(O1)COCCCCCCCBr 34a_100000760002_100000181169 [0,1,0,0,1,0|2,0,0]=4 3460 B16R1.642 O=C1NCC(O1)COCCCCCCCBr 7a_100000760002_100000181169 [0,1,0,0,1,0|2,0,0]=4 3461 B16R1.642 O=C1NCC(O1)COCCCCCCCO 34a_100011315639_100000760002 [0,1,0,0,1,0|2,0,0]=4 3462 B16R1.642 O=C1NCC(O1)CSCCCCCCCO 62a_100000181169_100000760002 [0,1,0,0,1,0|2,0,0]=4 3463 B16R1.642 O=C1NCC(O1)CSCCCCCCCO 62a_100000760002_100000181169 [0,1,0,0,1,0|2,0,0]=4 3464 B16R1.642 O=C1OCC(O1)CNCCCCCCCO 34a_100011996573_100000073702 [0,1,0,0,1,0|2,0,0]=4 3465 B16R1.642 O=C1OCC(O1)COCCCCCCCBr 34a_100000760002_100000073702 [0,1,0,0,1,0|2,0,0]=4 3466 B16R1.642 O=C1OCC(O1)CSCCCCCCCO 62a_100000073702_100000760002 [0,1,0,0,1,0|2,0,0]=4 3467 B16R1.642 O=C1OCC(O1)CSCCCCCCCO 62a_100000760002_100000073702 [0,1,0,0,1,0|2,0,0]=4 3468 B16R1.642 O=C1OCC(O1)NCCCCCCCCO 34a_102515433106_100000032252 [0,1,0,0,1,0|2,0,0]=4 3469 B16R1.642 O=C1OCC(O1)OCCCCCCCCBr 34a_100009813846_100000032252 [0,1,0,0,1,0|2,0,0]=4 3470 B16R1.642 O=C1OCC(O1)OCCCCCCCCCl 34a_100000033203_100000032252 [0,1,0,0,1,0|2,0,0]=4 3471 B16R1.642 O=C1OCC(O1)SCCCCCCCCO 62a_100000033203_100000032252 [0,1,0,0,1,0|2,0,0]=4 3472 B16R1.687 CCCCCCC(C)NCC1CNC(=O)O1 2230a_100000210919_100000181169 [0,1,0,0,1,0|2,0,0]=4 3473 B16R1.687 CCCCCCC(C)NCC1CNC(=O)O1 34a_100000210919_100000181169 [0,1,0,0,1,0|2,0,0]=4 3474 B16R1.687 CCCCCCC(C)NCC1COC(=O)O1 34a_100000210919_100000073702 [0,1,0,0,1,0|2,0,0]=4 3475 B16R1.687 CCCCCCC(C)NC[C@@H]1CCC(=O)N1 2230a_100000210919_100015189358 [0,1,0,0,1,0|2,0,0]=4 3476 B16R1.687 CCCCCCC(C)NC[C@H]1CCC(=O)N1 2230a_100015423886_100011215978 [0,1,0,0,1,0|2,0,0]=4 3477 B16R1.687 CCCCCCC(C)NC[C@H]1CCC(=O)N1 270004a_100015423886_100000210826 [0,1,0,0,1,0|2,0,0]=4 3478 B16R1.687 CCCCCCC(C)NC[C@H]1CCC(=O)N1 34a_100015423886_100011215978 [0,1,0,0,1,0|2,0,0]=4 3479 B16R1.687 CCCCCCC(C)OCC1CCC(=O)N1 34a_100000737831_100011215978 [0,1,0,0,1,0|2,0,0]=4 3480 B16R1.687 CCCCCCC(C)OCC1CNC(=O)O1 34a_100000210265_100000181169 [0,1,0,0,1,0|2,0,0]=4 3481 B16R1.687 CCCCCCC(C)OCC1CNC(=O)O1 34a_100011315639_100011215978 [0,1,0,0,1,0|2,0,0]=4 3482 B16R1.687 CCCCCCC(C)OCC1CNC(=O)O1 7a_100000210265_100000181169 [0,1,0,0,1,0|2,0,0]=4 3483 B16R1.687 CCCCCCC(C)OCC1COC(=O)O1 34a_100000210265_100000073702 [0,1,0,0,1,0|2,0,0]=4 3484 B16R1.687 CCCCCCC(C)OC[C@@H]1CCC(=O)N1 7a_100000210265_100015189358 [0,1,0,0,1,0|2,0,0]=4 3485 B16R1.687 CCCCCCC(C)SCC1CNC(=O)O1 62a_100000181169_100011215978 [0,1,0,0,1,0|2,0,0]=4 3486 B16R1.687 CCCCCCC(C)SCC1CNC(=O)O1 62a_100011215978_100000181169 [0,1,0,0,1,0|2,0,0]=4 3487 B16R1.687 CCCCCCC(C)SCC1COC(=O)O1 62a_100000073702_100011215978 [0,1,0,0,1,0|2,0,0]=4 3488 B16R1.687 CCCCCCC(C)SCC1COC(=O)O1 62a_100011215978_100000073702 [0,1,0,0,1,0|2,0,0]=4 3489 B16R1.687 CCCCCCC(C)SC[C@@H]1CCC(=O)N1 62a_100011215978_100015189358 [0,1,0,0,1,0|2,0,0]=4 3490 B16R1.687 CCCCCCC(C)SC[C@@H]1CCC(=O)N1 62a_100015189358_100011215978 [0,1,0,0,1,0|2,0,0]=4 3491 B16R1.692 CCCCCCCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000210614 [0,1,0,0,1,0|1,0,1]=4 3492 B16R1.692 CCCCCCCC(=O)CC1CNC(=O)O1 1458a_100000211969_100000181169 [0,1,0,0,1,0|1,0,1]=4 3493 B16R1.692 CCCCCCCC(=O)CC1COC(=O)O1 1458a_100000211969_100000073702 [0,1,0,0,1,0|1,0,1]=4 3494 B16R1.692 CCCCCCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000211969_100015189358 [0,1,0,0,1,0|1,0,1]=4 3495 B16R1.692 CCCCCCCC(C)OC1CCC(=O)C1 34a_100012614533_200011218727 [0,1,0,0,1,0|2,0,0]=4 3496 B16R1.692 CCCCCCCC(C)OC1COC(=O)O1 34a_200011215852_100000032252 [0,1,0,0,1,0|2,0,0]=4 3497 B16R1.692 CCCCCCCC(C)SC1COC(=O)O1 62a_200011218727_100000032252 [0,1,0,0,1,0|2,0,0]=4 3498 B16R1.692 CCCCCCCN(C)CC1CNC(=O)O1 2230a_100000228206_100000181169 [0,1,0,0,1,0|2,0,0]=4 3499 B16R1.692 CCCCCCCN(C)CC1CNC(=O)O1 269982a_100000228206_100000181169 [0,1,0,0,1,0|2,0,0]=4 3500 B16R1.692 CCCCCCCN(C)CC1COC(=O)O1 269982a_100000228206_100000073702 [0,1,0,0,1,0|2,0,0]=4 3501 B16R1.692 CCCCCCCN(C)C[C@@H]1CCC(=O)N1 2230a_100000228206_100015189358 [0,1,0,0,1,0|2,0,0]=4 3502 B16R1.692 CCCCCCCN(C)C[C@@H]1CCC(=O)N1 269982a_100000228206_100015189358 [0,1,0,0,1,0|2,0,0]=4 3503 B16R1.931 CCCC(C)CCCOCC1CNC(=O)O1 34a_100011713154_100000181169 [0,1,0,0,1,0|2,0,0]=4 3504 B16R1.931 CCCC(C)CCCOCC1CNC(=O)O1 7a_100011713154_100000181169 [0,1,0,0,1,0|2,0,0]=4 3505 B16R1.931 CCCC(C)CCCOCC1COC(=O)O1 34a_100011713154_100000073702 [0,1,0,0,1,0|2,0,0]=4 3506 B16R1.931 CCCC(C)CCCOC[C@@H]1CCC(=O)N1 7a_100011713154_100015189358 [0,1,0,0,1,0|2,0,0]=4 3507 B16R1.6868 CC(C)CCCCCCNC1COC(=O)O1 34a_100000211014_100000032252 [0,1,0,0,1,0|2,0,0]=4 3508 B16R1.6868 CC(C)CCCCCNCC1CNC(=O)O1 2230a_100011290863_100000181169 [0,1,0,0,1,0|2,0,0]=4 3509 B16R1.6868 CC(C)CCCCCNCC1CNC(=O)O1 34a_100011290863_100000181169 [0,1,0,0,1,0|2,0,0]=4 3510 B16R1.6868 CC(C)CCCCCNCC1COC(=O)O1 34a_100011290863_100000073702 [0,1,0,0,1,0|2,0,0]=4 3511 B16R1.6868 CC(C)CCCCCNC[C@@H]1CCC(=O)N1 2230a_100011290863_100015189358 [0,1,0,0,1,0|2,0,0]=4 3512 B16R1.6868 CC(C)CCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210682 [0,1,0,0,1,0|2,0,0]=4 3513 B16R1.6868 CC(C)CCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210682 [0,1,0,0,1,0|2,0,0]=4 3514 B16R1.6868 CC(C)CCCCCOCC1CCC(=O)N1 34a_100000737831_100000210682 [0,1,0,0,1,0|2,0,0]=4 3515 B16R1.6868 CC(C)CCCCCOCC1CNC(=O)O1 34a_100011315639_100000210682 [0,1,0,0,1,0|2,0,0]=4 3516 B16R1.6868 CC(C)CCCCCOCC1CNC(=O)O1 34a_100011995859_100000181169 [0,1,0,0,1,0|2,0,0]=4 3517 B16R1.6868 CC(C)CCCCCOCC1CNC(=O)O1 7a_100011995859_100000181169 [0,1,0,0,1,0|2,0,0]=4 3518 B16R1.6868 CC(C)CCCCCOCC1COC(=O)O1 34a_100011995859_100000073702 [0,1,0,0,1,0|2,0,0]=4 3519 B16R1.6868 CC(C)CCCCCOC[C@@H]1CCC(=O)N1 7a_100011995859_100015189358 [0,1,0,0,1,0|2,0,0]=4 3520 B16R1.6868 CC(C)CCCCCSCC1CNC(=O)O1 62a_100000181169_100000210682 [0,1,0,0,1,0|2,0,0]=4 3521 B16R1.6868 CC(C)CCCCCSCC1CNC(=O)O1 62a_100000210682_100000181169 [0,1,0,0,1,0|2,0,0]=4 3522 B16R1.6868 CC(C)CCCCCSCC1COC(=O)O1 62a_100000073702_100000210682 [0,1,0,0,1,0|2,0,0]=4 3523 B16R1.6868 CC(C)CCCCCSCC1COC(=O)O1 62a_100000210682_100000073702 [0,1,0,0,1,0|2,0,0]=4 3524 B16R1.6868 CC(C)CCCCCSC[C@@H]1CCC(=O)N1 62a_100000210682_100015189358 [0,1,0,0,1,0|2,0,0]=4 3525 B16R1.6868 CC(C)CCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210682 [0,1,0,0,1,0|2,0,0]=4 3526 B16R1.394 CC(C)CCCCCCNC1CCCC1=O 2230a_100000211014_100000211823 [0,1,0,0,1,0|1,0,0]=3 3527 B16R1.394 CC(C)CCCCCCNC1CCCC1=O 34a_100000211014_100000709159 [0,1,0,0,1,0|1,0,0]=3 3528 B16R1.394 CC(C)CCCCCCNC1CCOC1=O 2230a_100000211014_100000211211 [0,1,0,0,1,0|2,0,0]=4 3529 B16R1.394 CC(C)CCCCCCNC1CCOC1=O 34a_100000211014_100000211211 [0,1,0,0,1,0|2,0,0]=4 3530 B16R1.394 CC(C)CCCCCOCC1CCNC1=O 34a_100000133458_100000210682 [0,1,0,0,1,0|2,0,0]=4 3531 B16R1.394 CC(C)CCCCCSCN1CCCC1=O 62a_100000026320_100000210682 [0,1,0,0,1,0|2,0,0]=4 3532 B16R1.394 CC(C)CCCCCSCN1CCCC1=O 62a_100000210682_100000026320 [0,1,0,0,1,0|2,0,0]=4 3533 B16R1.394 CC(C)CCCCNCCN1CCCC1=O 2230a_100011200922_100011216152 [0,1,0,0,1,0|2,0,0]=4 3534 B16R1.394 CC(C)CCCCOCCN1CCCC1=O 34a_100000211209_100011216152 [0,1,0,0,1,0|2,0,0]=4 3535 B16R1.394 CC(C)CCCCOCCN1CCCC1=O 34a_100011214890_100000739059 [0,1,0,0,1,0|2,0,0]=4 3536 B16R1.394 CC(C)CCCCOCCN1CCCC1=O 7a_100000211209_100011216152 [0,1,0,0,1,0|2,0,0]=4 3537 B16R1.394 CC(C)CCCCOCCN1CCCC1=O 7a_100011214890_100000739059 [0,1,0,0,1,0|2,0,0]=4 3538 B16R1.394 CC(C)CCCCSCCN1CCCC1=O 62a_100000739059_100011216152 [0,1,0,0,1,0|2,0,0]=4 3539 B16R1.394 CC(C)CCCCSCCN1CCCC1=O 62a_100011216152_100000739059 [0,1,0,0,1,0|2,0,0]=4 3540 B16R1.394 CC(C)CCCNCCCN1CCCC1=O 2230a_100000210347_100011214892 [0,1,0,0,1,0|2,0,0]=4 3541 B16R1.394 CC(C)CCCNCCCN1CCCC1=O 34a_100000210347_100011214892 [0,1,0,0,1,0|2,0,0]=4 3542 B16R1.394 CC(C)CCCOCCCN1CCCC1=O 34a_100011216539_100011214892 [0,1,0,0,1,0|2,0,0]=4 3543 B16R1.394 CC(C)CCCOCCCN1CCCC1=O 7a_100011216539_100011214892 [0,1,0,0,1,0|2,0,0]=4 3544 B16R1.394 CC(C)NCCCCCOC1CCCC1=O 34a_100011629493_100000709159 [0,1,0,0,1,0|2,0,0]=4 3545 B16R1.394 CC(O)CCCNCCCN1CCCC1=O 2230a_100000210347_200000718107 [0,1,0,0,1,0|2,0,0]=4 3546 B16R1.394 CC(O)CCCNCCCN1CCCC1=O 34a_100000210347_200000718107 [0,1,0,0,1,0|2,0,0]=4 3547 B16R1.394 CC(O)CCCOCCCN1CCCC1=O 34a_100011216539_200000718107 [0,1,0,0,1,0|2,0,0]=4 3548 B16R1.394 CC(O)CCCOCCCN1CCCC1=O 7a_100011216539_200000718107 [0,1,0,0,1,0|2,0,0]=4 3549 B16R1.4593 CCCCCCC(=O)CCC1CCOC1=O 1458a_100000117037_100000210757 [0,1,0,0,1,0|1,0,1]=4 3550 B16R1.4593 CCCCCCC(=O)CCN1CCCC1=O 1458a_100000751031_100000210757 [0,1,0,0,1,0|1,0,1]=4 3551 B16R1.4593 CCCCCCC(=O)CCN1CCCC1=O 1458a_100102632555_100000742232 [0,1,0,0,1,0|1,0,1]=4 3552 B16R1.4593 CCCCCCC(C)OCC1CCNC1=O 34a_100000133458_100011215978 [0,1,0,0,1,0|2,0,0]=4 3553 B16R1.4593 CCCCCCC(C)SCN1CCCC1=O 62a_100000026320_100011215978 [0,1,0,0,1,0|2,0,0]=4 3554 B16R1.4593 CCCCCCC(C)SCN1CCCC1=O 62a_100011215978_100000026320 [0,1,0,0,1,0|2,0,0]=4 3555 B16R1.4593 CCCCCCN(C)CCN1CCCC1=O 2230a_106256046315_100000739059 [0,1,0,0,1,0|2,0,0]=4 3556 B16R1.4593 CCCCCCN(C)CCN1CCCC1=O 269982a_106256046315_100000739059 [0,1,0,0,1,0|2,0,0]=4 3557 B16R1.5833 CCCCCCCCC(=O)C1CCCC1=O 1458a_100000210188_100000211823 [0,1,0,0,1,0|0,0,1]=3 3558 B16R1.5833 CCCCCCCCC(=O)C1CCOC1=O 1458a_100000210188_100000211211 [0,1,0,0,1,0|1,0,1]=4 3559 B16R1.5833 CCCCCCCCN(C)C1CCCC1=O 2230a_100000207567_100000211823 [0,1,0,0,1,0|1,0,0]=3 3560 B16R1.5833 CCCCCCCCN(C)C1CCCC1=O 269982a_100000207567_100000211823 [0,1,0,0,1,0|1,0,0]=3 3561 B16R1.5833 CCCCCCCCN(C)C1CCOC1=O 2230a_100000207567_100000211211 [0,1,0,0,1,0|2,0,0]=4 3562 B16R1.5833 CCCCCCCCN(C)C1CCOC1=O 269982a_100000207567_100000211211 [0,1,0,0,1,0|2,0,0]=4 3563 B16R1.5833 O=C(CCCCCCCO)C1CCCC1=O 1458a_100011219782_100000211823 [0,1,0,0,1,0|1,0,1]=4 3564 B16R1.6680 C#CCCCCCCCOC1CCCC1=O 34a_100000054614_100000709159 [0,1,0,0,1,0|0,0,2]=4 3565 B16R1.6680 C#CCCCCCCCOC1CCCC1=O 34a_200000719330_100153394163 [0,1,0,0,1,0|0,0,2]=4 3566 B16R1.6680 C#CCCCCCCCOC1CCCC1=O 7a_100000054614_100000211823 [0,1,0,0,1,0|0,0,2]=4 3567 B16R1.6680 C#CCCCCCCCSC1CCCC1=O 62a_100000211823_100153394163 [0,1,0,0,1,0|0,0,2]=4 3568 B16R1.6680 C#CCCCCCCCSC1CCCC1=O 62a_100153394163_100000211823 [0,1,0,0,1,0|0,0,2]=4 3569 B16R1.6680 C=CCCCCCCCOC1CCCC1=O 34a_100000730831_100000709159 [0,1,0,0,1,0|0,0,2]=4 3570 B16R1.6680 C=CCCCCCCCOC1CCCC1=O 34a_200000719330_100012355270 [0,1,0,0,1,0|0,0,2]=4 3571 B16R1.6680 C=CCCCCCCCOC1CCCC1=O 7a_100000730831_100000211823 [0,1,0,0,1,0|0,0,2]=4 3572 B16R1.6680 C=CCCCCCCCSC1CCCC1=O 62a_100000211823_100012355270 [0,1,0,0,1,0|0,0,2]=4 3573 B16R1.6680 C=CCCCCCCCSC1CCCC1=O 62a_100012355270_100000211823 [0,1,0,0,1,0|0,0,2]=4 3574 B16R1.6680 CC/C=C\CCCCCOC1CCCC1=O 34a_100016268722_100000709159 [0,1,0,0,1,0|0,0,2]=4 3575 B16R1.6680 CC/C=C\CCCCCOC1CCCC1=O 7a_100016268722_100000211823 [0,1,0,0,1,0|0,0,2]=4 3576 B16R1.6680 CCCCC#CCCCOC1CCCC1=O 34a_200000719330_200000047210 [0,1,0,0,1,0|0,0,2]=4 3577 B16R1.6680 CCCCC#CCCCSC1CCCC1=O 62a_100000211823_200000047210 [0,1,0,0,1,0|0,0,2]=4 3578 B16R1.6680 CCCCC#CCCCSC1CCCC1=O 62a_200000047210_100000211823 [0,1,0,0,1,0|0,0,2]=4 3579 B16R1.6680 CCCCC/C=C\CCOC1CCCC1=O 34a_100016277358_100000709159 [0,1,0,0,1,0|0,0,2]=4 3580 B16R1.6680 CCCCC/C=C\CCOC1CCCC1=O 7a_100016277358_100000211823 [0,1,0,0,1,0|0,0,2]=4 3581 B16R1.6680 CCCCCC#CCCOC1CCCC1=O 34a_200000042877_100000709159 [0,1,0,0,1,0|0,0,2]=4 3582 B16R1.6680 CCCCCC#CCCOC1CCCC1=O 7a_200000042877_100000211823 [0,1,0,0,1,0|0,0,2]=4 3583 B16R1.6680 CCCCCC/C=C/COC1CCCC1=O 34a_200016276170_100000709159 [0,1,0,0,1,0|0,0,2]=4 3584 B16R1.6680 CCCCCC/C=C/COC1CCCC1=O 7a_200016276170_100000211823 [0,1,0,0,1,0|0,0,2]=4 3585 B16R1.6680 CCCCCCC#CCOC1CCCC1=O 34a_200000037284_100000709159 [0,1,0,0,1,0|0,0,2]=4 3586 B16R1.6680 CCCCCCC#CCOC1CCCC1=O 7a_200000037284_100000211823 [0,1,0,0,1,0|0,0,2]=4 3587 B16R1.6680 CCCCCCCCCNC1CCCC1=O 2230a_100000212291_100000211823 [0,1,0,0,1,0|0,0,0]=2 3588 B16R1.6680 CCCCCCCCCNC1CCCC1=O 34a_100000212291_100000709159 [0,1,0,0,1,0|0,0,0]=2 3589 B16R1.6680 CCCCCCCCCNC1CCCC1C 269862a_100000212291_100000752053 [0,1,0,0,1,0|1,0,1]=4 3590 B16R1.6680 CCCCCCCCCNC1CCNC1=O 2230a_100016995588_100011214924 [0,1,0,0,1,0|1,0,0]=3 3591 B16R1.6680 CCCCCCCCCNC1CCNC1=O 34a_100016995588_100011214924 [0,1,0,0,1,0|1,0,0]=3 3592 B16R1.6680 CCCCCCCCCNC1CCOC1=O 2230a_100000212291_100000211211 [0,1,0,0,1,0|1,0,0]=3 3593 B16R1.6680 CCCCCCCCCNC1CCOC1=O 34a_100000212291_100000211211 [0,1,0,0,1,0|1,0,0]=3 3594 B16R1.6680 CCCCCCCCCN[C@@H]1CONC1=O 2230a_100000765999_100011214924 [0,1,0,0,1,0|2,0,0]=4 3595 B16R1.6680 CCCCCCCCCN[C@@H]1CONC1=O 34a_100000765999_100011214924 [0,1,0,0,1,0|2,0,0]=4 3596 B16R1.6680 CCCCCCCCCOC1CCCC1=O 34a_100000210712_100000709159 [0,1,0,0,1,0|0,0,0]=2 3597 B16R1.6680 CCCCCCCCCOC1CCCC1=O 34a_200000719330_100011214924 [0,1,0,0,1,0|0,0,0]=2 3598 B16R1.6680 CCCCCCCCCOC1CCCC1=O 7a_100000210712_100000211823 [0,1,0,0,1,0|0,0,0]=2 3599 B16R1.6680 CCCCCCCCCOC1CCCC1C 34a_100011216460_100011214924 [0,1,0,0,1,0|1,0,1]=4 3600 B16R1.6680 CCCCCCCCCOC1CCCC1C 7a_100011216460_100000210328 [0,1,0,0,1,0|1,0,1]=4 3601 B16R1.6680 CCCCCCCCCOC1CCOC1=O 34a_100000210712_100000211211 [0,1,0,0,1,0|1,0,0]=3 3602 B16R1.6680 CCCCCCCCCOC1CCOC1=O 7a_100000210712_100000211211 [0,1,0,0,1,0|1,0,0]=3 3603 B16R1.6680 CCCCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100011214924 [0,1,0,0,1,0|1,0,1]=4 3604 B16R1.6680 CCCCCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100011214924 [0,1,0,0,1,0|1,0,1]=4 3605 B16R1.6680 CCCCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100011214924 [0,1,0,0,1,0|1,0,0]=3 3606 B16R1.6680 CCCCCCCCCSC1CCCC1=O 62a_100000211823_100000210670 [0,1,0,0,1,0|0,0,0]=2 3607 B16R1.6680 CCCCCCCCCSC1CCOC1=O 62a_100000211211_100000210670 [0,1,0,0,1,0|1,0,0]=3 3608 B16R1.6680 CCCCCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210670 [0,1,0,0,1,0|0,0,2]=4 3609 B16R1.6680 CCCCCCCCOCC1=CCCC1=O 34a_100000087531_100000210759 [0,1,0,0,1,0|0,0,2]=4 3610 B16R1.6680 CCCCCCCCOCC1CCCN1C 34a_100000743107_100000210759 [0,1,0,0,1,0|2,0,0]=4 3611 B16R1.6680 CCCCCCCCOCC1CCNC1=O 34a_100000133458_100000210759 [0,1,0,0,1,0|1,0,0]=3 3612 B16R1.6680 CCCCCCCCSCN1CCCC1=O 62a_100000026320_100000210317 [0,1,0,0,1,0|1,0,0]=3 3613 B16R1.6680 CCCCCCCCSCN1CCCC1=O 62a_100000210759_100000026320 [0,1,0,0,1,0|1,0,0]=3 3614 B16R1.6680 CCCCCCCNCCC1CCCN1C 2230a_100000229938_100000005710 [0,1,0,0,1,0|2,0,0]=4 3615 B16R1.6680 CCCCCCCNCCN1CCCC1=O 2230a_100000229938_100000739059 [0,1,0,0,1,0|1,0,0]=3 3616 B16R1.6680 CCCCCCCNCCN1CCCC1=O 2230a_100011200922_100000210681 [0,1,0,0,1,0|1,0,0]=3 3617 B16R1.6680 CCCCCCCNCCN1CCNC1=O 2230a_100000229938_100000090651 [0,1,0,0,1,0|2,0,0]=4 3618 B16R1.6680 CCCCCCCNCCN1CCNC1=O 2230a_100011207550_100000210681 [0,1,0,0,1,0|2,0,0]=4 3619 B16R1.6680 CCCCCCCOCCC1CCCN1C 34a_100000210272_100000005710 [0,1,0,0,1,0|2,0,0]=4 3620 B16R1.6680 CCCCCCCOCCC1CCCN1C 34a_100011215177_100000210614 [0,1,0,0,1,0|2,0,0]=4 3621 B16R1.6680 CCCCCCCOCCC1CCCN1C 7a_100000210272_100000005710 [0,1,0,0,1,0|2,0,0]=4 3622 B16R1.6680 CCCCCCCOCCC1CCCN1C 7a_100011215177_100000210614 [0,1,0,0,1,0|2,0,0]=4 3623 B16R1.6680 CCCCCCCOCCN1CCCC1=O 34a_100000210272_100000739059 [0,1,0,0,1,0|1,0,0]=3 3624 B16R1.6680 CCCCCCCOCCN1CCCC1=O 34a_100000211209_100000210614 [0,1,0,0,1,0|1,0,0]=3 3625 B16R1.6680 CCCCCCCOCCN1CCCC1=O 7a_100000210272_100000739059 [0,1,0,0,1,0|1,0,0]=3 3626 B16R1.6680 CCCCCCCOCCN1CCCC1=O 7a_100000211209_100000210614 [0,1,0,0,1,0|1,0,0]=3 3627 B16R1.6680 CCCCCCCOCCN1CCNC1=O 34a_100000216532_100000210614 [0,1,0,0,1,0|2,0,0]=4 3628 B16R1.6680 CCCCCCCOCCN1CCNC1=O 7a_100000210272_100000090651 [0,1,0,0,1,0|2,0,0]=4 3629 B16R1.6680 CCCCCCCSCCC1CCCN1C 62a_100000005710_100000210316 [0,1,0,0,1,0|2,0,0]=4 3630 B16R1.6680 CCCCCCCSCCC1CCCN1C 62a_100000210614_100000005710 [0,1,0,0,1,0|2,0,0]=4 3631 B16R1.6680 CCCCCCCSCCN1CCCC1=O 62a_100000210614_100000739059 [0,1,0,0,1,0|1,0,0]=3 3632 B16R1.6680 CCCCCCCSCCN1CCCC1=O 62a_100000739059_100000210316 [0,1,0,0,1,0|1,0,0]=3 3633 B16R1.6680 CCCCCCCSCCN1CCNC1=O 62a_100000090651_100000210316 [0,1,0,0,1,0|2,0,0]=4 3634 B16R1.6680 CCCCCCCSCCN1CCNC1=O 62a_100000210614_100000090651 [0,1,0,0,1,0|2,0,0]=4 3635 B16R1.6680 CCCCCCNCCCN1CCCC1=O 2230a_100000210347_100000210314 [0,1,0,0,1,0|1,0,0]=3 3636 B16R1.6680 CCCCCCNCCCN1CCCC1=O 34a_100000210347_100000210314 [0,1,0,0,1,0|1,0,0]=3 3637 B16R1.6680 CCCCCCOCCCN1CCCC1=O 34a_100011216539_100000210314 [0,1,0,0,1,0|1,0,0]=3 3638 B16R1.6680 CCCCCCOCCCN1CCCC1=O 7a_100011216539_100000210314 [0,1,0,0,1,0|1,0,0]=3 3639 B16R1.6680 CCCCCCOCCOC1CCCC1=O 34a_100000691444_100000709159 [0,1,0,0,1,0|1,0,0]=3 3640 B16R1.6680 CCCCCCOCCOC1CCCC1=O 7a_100000691444_100000211823 [0,1,0,0,1,0|1,0,0]=3 3641 B16R1.6680 CCCCCCOCCOC1CCOC1=O 34a_100000691444_100000211211 [0,1,0,0,1,0|2,0,0]=4 3642 B16R1.6680 CCCCCCOCCOC1CCOC1=O 7a_100000691444_100000211211 [0,1,0,0,1,0|2,0,0]=4 3643 B16R1.6680 CCCCNCCCCOC1CCCC1=O 34a_200011216965_100000709159 [0,1,0,0,1,0|1,0,0]=3 3644 B16R1.6680 CCCCNCCCCOC1CCOC1=O 34a_200011216965_100000211211 [0,1,0,0,1,0|2,0,0]=4 3645 B16R1.6680 CCCCOCCCCOC1CCCC1=O 34a_200000760531_100000709159 [0,1,0,0,1,0|1,0,0]=3 3646 B16R1.6680 CCCCOCCCCOC1CCCC1=O 7a_200000760531_100000211823 [0,1,0,0,1,0|1,0,0]=3 3647 B16R1.6680 CCCCOCCCCOC1CCOC1=O 34a_200000760531_100000211211 [0,1,0,0,1,0|2,0,0]=4 3648 B16R1.6680 CCCCOCCCCOC1CCOC1=O 7a_200000760531_100000211211 [0,1,0,0,1,0|2,0,0]=4 3649 B16R1.6680 CCCCOCCNCCN1CCCC1=O 2230a_100011200922_100000743108 [0,1,0,0,1,0|2,0,0]=4 3650 B16R1.6680 CCCCOCCOCCN1CCCC1=O 34a_100000210238_100000739059 [0,1,0,0,1,0|2,0,0]=4 3651 B16R1.6680 CCCCOCCOCCN1CCCC1=O 34a_100000211209_100000743108 [0,1,0,0,1,0|2,0,0]=4 3652 B16R1.6680 CCCCOCCOCCN1CCCC1=O 7a_100000210238_100000739059 [0,1,0,0,1,0|2,0,0]=4 3653 B16R1.6680 CCCCOCCOCCN1CCCC1=O 7a_100000211209_100000743108 [0,1,0,0,1,0|2,0,0]=4 3654 B16R1.6680 CCCCOCCSCCN1CCCC1=O 62a_100000739059_100000743108 [0,1,0,0,1,0|2,0,0]=4 3655 B16R1.6680 CCCCOCCSCCN1CCCC1=O 62a_100000743108_100000739059 [0,1,0,0,1,0|2,0,0]=4 3656 B16R1.6680 CCCCOCNCCCN1CCCC1=O 2230a_100000210347_100011995733 [0,1,0,0,1,0|2,0,0]=4 3657 B16R1.6680 CCCCOCNCCCN1CCCC1=O 34a_100000210347_100011995733 [0,1,0,0,1,0|2,0,0]=4 3658 B16R1.6680 CCCCOCOCCCN1CCCC1=O 34a_100011216539_100011995733 [0,1,0,0,1,0|2,0,0]=4 3659 B16R1.6680 CCCCSCCNCCN1CCCC1=O 2230a_100025743550_100000739059 [0,1,0,0,1,0|2,0,0]=4 3660 B16R1.6680 CCCCSCCOCCN1CCCC1=O 34a_200000230436_100000739059 [0,1,0,0,1,0|2,0,0]=4 3661 B16R1.6680 CCCCSCCOCCN1CCCC1=O 7a_200000230436_100000739059 [0,1,0,0,1,0|2,0,0]=4 3662 B16R1.6680 CCCOCCCNCCN1CCCC1=O 2230a_100011217757_100000739059 [0,1,0,0,1,0|2,0,0]=4 3663 B16R1.6680 CCCOCCCNCCN1CCCC1=O 34a_100011217757_100000739059 [0,1,0,0,1,0|2,0,0]=4 3664 B16R1.6680 CCCOCCNCCCN1CCCC1=O 2230a_100000210347_100011215938 [0,1,0,0,1,0|2,0,0]=4 3665 B16R1.6680 CCCOCCNCCCN1CCCC1=O 34a_100000210347_100011215938 [0,1,0,0,1,0|2,0,0]=4 3666 B16R1.6680 CCCOCCOCCCN1CCCC1=O 34a_100011216539_100011215938 [0,1,0,0,1,0|2,0,0]=4 3667 B16R1.6680 CCCOCCOCCCN1CCCC1=O 7a_100011216539_100011215938 [0,1,0,0,1,0|2,0,0]=4 3668 B16R1.6680 CCCOCCOCCNC1CCCC1=O 2230a_200011904461_100000211823 [0,1,0,0,1,0|2,0,0]=4 3669 B16R1.6680 CCCOCCOCCNC1CCCC1=O 34a_200011904461_100000709159 [0,1,0,0,1,0|2,0,0]=4 3670 B16R1.6680 CCOCCCNCCCN1CCCC1=O 2230a_100000210347_100012232248 [0,1,0,0,1,0|2,0,0]=4 3671 B16R1.6680 CCOCCCNCCCN1CCCC1=O 34a_100000210347_100012232248 [0,1,0,0,1,0|2,0,0]=4 3672 B16R1.6680 CCOCCCOCCCN1CCCC1=O 34a_100011216539_100012232248 [0,1,0,0,1,0|2,0,0]=4 3673 B16R1.6680 CCOCCCOCCCN1CCCC1=O 7a_100011216539_100012232248 [0,1,0,0,1,0|2,0,0]=4 3674 B16R1.6680 CNCCCCCOCCN1CCCC1=O 34a_100000722520_100000739059 [0,1,0,0,1,0|2,0,0]=4 3675 B16R1.6680 COCCCCCCOCC1CCNC1=O 34a_100000133458_100011998445 [0,1,0,0,1,0|2,0,0]=4 3676 B16R1.6680 COCCCCCCSCN1CCCC1=O 62a_100000026320_100011998445 [0,1,0,0,1,0|2,0,0]=4 3677 B16R1.6680 COCCCCCCSCN1CCCC1=O 62a_100011998445_100000026320 [0,1,0,0,1,0|2,0,0]=4 3678 B16R1.6680 COCCCCCNCCN1CCCC1=O 2230a_100000747528_100000739059 [0,1,0,0,1,0|2,0,0]=4 3679 B16R1.6680 COCCCCCNCCN1CCCC1=O 34a_100000747528_100000739059 [0,1,0,0,1,0|2,0,0]=4 3680 B16R1.6680 COCCCCNCCCN1CCCC1=O 2230a_100000210347_100000730899 [0,1,0,0,1,0|2,0,0]=4 3681 B16R1.6680 COCCCCNCCCN1CCCC1=O 34a_100000210347_100000755781 [0,1,0,0,1,0|2,0,0]=4 3682 B16R1.6680 COCCCCOCCCN1CCCC1=O 34a_100011216539_100000755781 [0,1,0,0,1,0|2,0,0]=4 3683 B16R1.6680 COCCCCOCCCN1CCCC1=O 7a_100011216539_100000730899 [0,1,0,0,1,0|2,0,0]=4 3684 B16R1.6680 COCCCOCCCOC1CCCC1=O 34a_200011215475_100000709159 [0,1,0,0,1,0|2,0,0]=4 3685 B16R1.6680 COCCCOCCCOC1CCCC1=O 7a_200011215475_100000211823 [0,1,0,0,1,0|2,0,0]=4 3686 B16R1.6680 NCCCCCCCCOC1CCCC1=O 34a_102515433106_100000709159 [0,1,0,0,1,0|1,0,0]=3 3687 B16R1.6680 NCCCCCCCCOC1CCOC1=O 34a_102515433106_100000211211 [0,1,0,0,1,0|2,0,0]=4 3688 B16R1.6680 NCCCCCCOCCN1CCCC1=O 34a_100000686447_100000739059 [0,1,0,0,1,0|2,0,0]=4 3689 B16R1.6680 NCCNCCCCCOC1CCCC1=O 34a_103619048469_100000709159 [0,1,0,0,1,0|2,0,0]=4 3690 B16R1.6680 O=C1CCCC1NCCCCCCCCO 2230a_102515433106_100000211823 [0,1,0,0,1,0|1,0,0]=3 3691 B16R1.6680 O=C1CCCC1NCCCCCCCCO 34a_102515433106_100000709159 [0,1,0,0,1,0|1,0,0]=3 3692 B16R1.6680 O=C1CCCC1OCCCCCCCCBr 34a_100009813846_100000709159 [0,1,0,0,1,0|1,0,0]=3 3693 B16R1.6680 O=C1CCCC1OCCCCCCCCBr 7a_100009813846_100000211823 [0,1,0,0,1,0|1,0,0]=3 3694 B16R1.6680 O=C1CCCC1OCCCCCCCCCl 34a_100000033203_100000709159 [0,1,0,0,1,0|1,0,0]=3 3695 B16R1.6680 O=C1CCCC1OCCCCCCCCCl 7a_100000033203_100000211823 [0,1,0,0,1,0|1,0,0]=3 3696 B16R1.6680 O=C1CCCC1OCCCCCCCCO 34a_200000719330_100000033203 [0,1,0,0,1,0|1,0,0]=3 3697 B16R1.6680 O=C1CCCC1SCCCCCCCCO 62a_100000033203_100000211823 [0,1,0,0,1,0|1,0,0]=3 3698 B16R1.6680 O=C1CCCC1SCCCCCCCCO 62a_100000211823_100000033203 [0,1,0,0,1,0|1,0,0]=3 3699 B16R1.6680 O=C1CCCN1CCCNCCCCCF 2230a_100000210347_100000729378 [0,1,0,0,1,0|2,0,0]=4 3700 B16R1.6680 O=C1CCCN1CCCNCCCCCF 34a_100000210347_100000729378 [0,1,0,0,1,0|2,0,0]=4 3701 B16R1.6680 O=C1CCCN1CCCNCCCCCO 2230a_100000210347_100000746330 [0,1,0,0,1,0|2,0,0]=4 3702 B16R1.6680 O=C1CCCN1CCCNCCCCCO 34a_100000210347_100000746330 [0,1,0,0,1,0|2,0,0]=4 3703 B16R1.6680 O=C1CCCN1CCCOCCCCCF 34a_100011216539_100000729378 [0,1,0,0,1,0|2,0,0]=4 3704 B16R1.6680 O=C1CCCN1CCCOCCCCCF 7a_100011216539_100000729378 [0,1,0,0,1,0|2,0,0]=4 3705 B16R1.6680 O=C1CCCN1CCCOCCCCCO 34a_100011216539_100000746330 [0,1,0,0,1,0|2,0,0]=4 3706 B16R1.6680 O=C1CCCN1CCCOCCCCCO 7a_100011216539_100000746330 [0,1,0,0,1,0|2,0,0]=4 3707 B16R1.6680 O=C1CCCN1CCNCCCCCCF 2230a_100011200922_100015922095 [0,1,0,0,1,0|2,0,0]=4 3708 B16R1.6680 O=C1CCCN1CCNCCCCCCO 2230a_100000686447_100000739059 [0,1,0,0,1,0|2,0,0]=4 3709 B16R1.6680 O=C1CCCN1CCNCCCCCCO 2230a_100011200922_100000766143 [0,1,0,0,1,0|2,0,0]=4 3710 B16R1.6680 O=C1CCCN1CCNCCCCCCO 34a_100000686447_100000739059 [0,1,0,0,1,0|2,0,0]=4 3711 B16R1.6680 O=C1CCCN1CCOCCCCCCBr 34a_100011215345_100000739059 [0,1,0,0,1,0|2,0,0]=4 3712 B16R1.6680 O=C1CCCN1CCOCCCCCCBr 7a_100011215345_100000739059 [0,1,0,0,1,0|2,0,0]=4 3713 B16R1.6680 O=C1CCCN1CCOCCCCCCCl 34a_100000766143_100000739059 [0,1,0,0,1,0|2,0,0]=4 3714 B16R1.6680 O=C1CCCN1CCOCCCCCCCl 7a_100000766143_100000739059 [0,1,0,0,1,0|2,0,0]=4 3715 B16R1.6680 O=C1CCCN1CCOCCCCCCF 34a_100000211209_100015922095 [0,1,0,0,1,0|2,0,0]=4 3716 B16R1.6680 O=C1CCCN1CCOCCCCCCF 34a_100000732779_100000739059 [0,1,0,0,1,0|2,0,0]=4 3717 B16R1.6680 O=C1CCCN1CCOCCCCCCF 7a_100000211209_100015922095 [0,1,0,0,1,0|2,0,0]=4 3718 B16R1.6680 O=C1CCCN1CCOCCCCCCF 7a_100000732779_100000739059 [0,1,0,0,1,0|2,0,0]=4 3719 B16R1.6680 O=C1CCCN1CCOCCCCCCO 34a_100000211209_100000766143 [0,1,0,0,1,0|2,0,0]=4 3720 B16R1.6680 O=C1CCCN1CCOCCCCCCO 7a_100000211209_100000766143 [0,1,0,0,1,0|2,0,0]=4 3721 B16R1.6680 O=C1CCCN1CCSCCCCCCF 62a_100000739059_100015922095 [0,1,0,0,1,0|2,0,0]=4 3722 B16R1.6680 O=C1CCCN1CCSCCCCCCF 62a_100015922095_100000739059 [0,1,0,0,1,0|2,0,0]=4 3723 B16R1.6680 O=C1CCCN1CCSCCCCCCO 62a_100000739059_100000766143 [0,1,0,0,1,0|2,0,0]=4 3724 B16R1.6680 O=C1CCCN1CCSCCCCCCO 62a_100000766143_100000739059 [0,1,0,0,1,0|2,0,0]=4 3725 B16R1.6680 O=C1CCCN1CSCCCCCCCO 62a_100000026320_100000760002 [0,1,0,0,1,0|2,0,0]=4 3726 B16R1.6680 O=C1CCCN1CSCCCCCCCO 62a_100000760002_100000026320 [0,1,0,0,1,0|2,0,0]=4 3727 B16R1.6680 O=C1NCCC1COCCCCCCCO 34a_100000133458_100000760002 [0,1,0,0,1,0|2,0,0]=4 3728 B16R1.6680 O=C1NCCC1NCCCCCCCCO 2230a_100016995588_100000033203 [0,1,0,0,1,0|2,0,0]=4 3729 B16R1.6680 O=C1NCCC1NCCCCCCCCO 34a_100016995588_100000033203 [0,1,0,0,1,0|2,0,0]=4 3730 B16R1.6680 O=C1NCC[C@@H]1OCCCCCCCCO 34a_100000688343_100000033203 [0,1,0,0,1,0|2,0,0]=4 3731 B16R1.6680 O=C1OCCC1NCCCCCCCCO 2230a_102515433106_100000211211 [0,1,0,0,1,0|2,0,0]=4 3732 B16R1.6680 O=C1OCCC1NCCCCCCCCO 34a_102515433106_100000211211 [0,1,0,0,1,0|2,0,0]=4 3733 B16R1.6680 O=C1OCCC1OCCCCCCCCBr 34a_100009813846_100000211211 [0,1,0,0,1,0|2,0,0]=4 3734 B16R1.6680 O=C1OCCC1OCCCCCCCCBr 7a_100009813846_100000211211 [0,1,0,0,1,0|2,0,0]=4 3735 B16R1.6680 O=C1OCCC1OCCCCCCCCCl 34a_100000033203_100000211211 [0,1,0,0,1,0|2,0,0]=4 3736 B16R1.6680 O=C1OCCC1OCCCCCCCCCl 7a_100000033203_100000211211 [0,1,0,0,1,0|2,0,0]=4 3737 B16R1.6680 O=C1OCCC1SCCCCCCCCO 62a_100000033203_100000211211 [0,1,0,0,1,0|2,0,0]=4 3738 B16R1.6680 O=C1OCCC1SCCCCCCCCO 62a_100000211211_100000033203 [0,1,0,0,1,0|2,0,0]=4 3739 B16R1.7333 CCCCC(C)COCCN1CCCC1=O 34a_100011995851_100000739059 [0,1,0,0,1,0|2,0,0]=4 3740 B16R1.7333 CCCCC(C)COCCN1CCCC1=O 7a_100011995851_100000739059 [0,1,0,0,1,0|2,0,0]=4 3741 B16R1.7333 CCCCC(C)NCCCN1CCCC1=O 2230a_100000210347_200011215066 [0,1,0,0,1,0|2,0,0]=4 3742 B16R1.7333 CCCCC(C)NCCCN1CCCC1=O 270004a_100000210347_100000210087 [0,1,0,0,1,0|2,0,0]=4 3743 B16R1.7333 CCCCC(C)NCCCN1CCCC1=O 34a_100000210347_200011215066 [0,1,0,0,1,0|2,0,0]=4 3744 B16R1.7333 CCCCC(C)OCCCN1CCCC1=O 34a_100011216539_200011215066 [0,1,0,0,1,0|2,0,0]=4 3745 B16R1.7333 CCCCC(C)OCCCN1CCCC1=O 7a_100011216539_200011215066 [0,1,0,0,1,0|2,0,0]=4 3746 B16R1.7333 CCCC[C@H](N)COCCN1CCCC1=O 34a_100011934283_100000739059 [0,1,0,0,1,0|2,0,0]=4 3747 B16R1.7377 CCCCCC(C)NCCN1CCCC1=O 2230a_100000211957_100000739059 [0,1,0,0,1,0|2,0,0]=4 3748 B16R1.7377 CCCCCC(C)NCCN1CCCC1=O 2230a_100011200922_200011218191 [0,1,0,0,1,0|2,0,0]=4 3749 B16R1.7377 CCCCCC(C)NCCN1CCCC1=O 270004a_100011200922_100000211708 [0,1,0,0,1,0|2,0,0]=4 3750 B16R1.7377 CCCCCC(C)OCCN1CCCC1=O 34a_100000211209_200011218191 [0,1,0,0,1,0|2,0,0]=4 3751 B16R1.7377 CCCCCC(C)OCCN1CCCC1=O 34a_100011215632_100000739059 [0,1,0,0,1,0|2,0,0]=4 3752 B16R1.7377 CCCCCC(C)OCCN1CCCC1=O 7a_100000211209_200011218191 [0,1,0,0,1,0|2,0,0]=4 3753 B16R1.7377 CCCCCC(C)OCCN1CCCC1=O 7a_100011215632_100000739059 [0,1,0,0,1,0|2,0,0]=4 3754 B16R1.7377 CCCCCC(C)SCCN1CCCC1=O 62a_100000739059_200011218191 [0,1,0,0,1,0|2,0,0]=4 3755 B16R1.7377 CCCCCC(C)SCCN1CCCC1=O 62a_200011218191_100000739059 [0,1,0,0,1,0|2,0,0]=4 3756 B16R1.7605 CCCCCCCC(=O)CN1CCCC1=O 1458a_100000189602_100000210614 [0,1,0,0,1,0|1,0,1]=4 3757 B16R1.7605 CCCCCCCC(C)NC1CCNC1=O 2230a_100016995588_200011218727 [0,1,0,0,1,0|2,0,0]=4 3758 B16R1.7605 CCCCCCCC(C)NC1CCNC1=O 270004a_100016995588_100000210596 [0,1,0,0,1,0|2,0,0]=4 3759 B16R1.7605 CCCCCCCC(C)NC1CCNC1=O 34a_100016995588_200011218727 [0,1,0,0,1,0|2,0,0]=4 3760 B16R1.7605 CCCCCCCC(C)OC1CCCC1=O 34a_200000719330_200011218727 [0,1,0,0,1,0|1,0,0]=3 3761 B16R1.7605 CCCCCCCC(C)OC1CCCC1=O 34a_200011215852_100000709159 [0,1,0,0,1,0|1,0,0]=3 3762 B16R1.7605 CCCCCCCC(C)OC1CCCC1=O 7a_200011215852_100000211823 [0,1,0,0,1,0|1,0,0]=3 3763 B16R1.7605 CCCCCCCC(C)OC1CCOC1=O 34a_200011215852_100000211211 [0,1,0,0,1,0|2,0,0]=4 3764 B16R1.7605 CCCCCCCC(C)OC1CCOC1=O 7a_200011215852_100000211211 [0,1,0,0,1,0|2,0,0]=4 3765 B16R1.7605 CCCCCCCC(C)O[C@H]1CCNC1=O 34a_100000688343_200011218727 [0,1,0,0,1,0|2,0,0]=4 3766 B16R1.7605 CCCCCCCC(C)SC1CCCC1=O 62a_100000211823_200011218727 [0,1,0,0,1,0|1,0,0]=3 3767 B16R1.7605 CCCCCCCC(C)SC1CCCC1=O 62a_200011218727_100000211823 [0,1,0,0,1,0|1,0,0]=3 3768 B16R1.7605 CCCCCCCC(C)SC1CCOC1=O 62a_100000211211_200011218727 [0,1,0,0,1,0|2,0,0]=4 3769 B16R1.7605 CCCCCCCC(C)SC1CCOC1=O 62a_200011218727_100000211211 [0,1,0,0,1,0|2,0,0]=4 3770 B16R1.7605 CCCCCCCN(C)CN1CCCC1=O 269982a_100000228206_100000026320 [0,1,0,0,1,0|2,0,0]=4 3771 B16R1.8360 CCCCCCCCNC1C(=O)CCC1=O 2230a_100000229939_100009820769 [0,1,0,0,1,0|1,0,1]=4 3772 B16R1.8360 CCCCCCCCOC1C(=O)CCC1=O 7a_100000210232_100009820769 [0,1,0,0,1,0|1,0,1]=4 3773 B16R1.8360 CCCCCCCCSC1C(=O)CCC1=O 62a_100000210759_100009820769 [0,1,0,0,1,0|1,0,1]=4 3774 B16R1.8360 CCCCCCCCSC1C(=O)CCC1=O 62a_100009820769_100000210317 [0,1,0,0,1,0|1,0,1]=4 3775 B16R1.14009 CCCC(C)CCOCCN1CCCC1=O 34a_100011217855_100000739059 [0,1,0,0,1,0|2,0,0]=4 3776 B16R1.14009 CCCC(C)CCOCCN1CCCC1=O 7a_100011217855_100000739059 [0,1,0,0,1,0|2,0,0]=4 3777 B16R1.14009 CCCC(C)CNCCCN1CCCC1=O 2230a_100000210347_100011216630 [0,1,0,0,1,0|2,0,0]=4 3778 B16R1.14009 CCCC(C)CNCCCN1CCCC1=O 270004a_100000210347_100000243154 [0,1,0,0,1,0|2,0,0]=4 3779 B16R1.14009 CCCC(C)CNCCCN1CCCC1=O 34a_100000210347_100011216630 [0,1,0,0,1,0|2,0,0]=4 3780 B16R1.14009 CCCC(C)COCCCN1CCCC1=O 34a_100011216539_100011216630 [0,1,0,0,1,0|2,0,0]=4 3781 B16R1.14009 CCCC(C)COCCCN1CCCC1=O 7a_100011216539_100011216630 [0,1,0,0,1,0|2,0,0]=4 3782 B16R1.14009 CCC[C@H](N)CCOCCN1CCCC1=O 34a_100015193777_100000739059 [0,1,0,0,1,0|2,0,0]=4 3783 B16R1.16885 CCC(C)CCCCCOC1CCCC1=O 7a_200000035636_100000211823 [0,1,0,0,1,0|1,0,0]=3 3784 B16R1.16885 CCC(C)CCCCCOC1CCOC1=O 7a_200000035636_100000211211 [0,1,0,0,1,0|2,0,0]=4 3785 B16R1.16885 CCC(C)CCCOCCN1CCCC1=O 7a_100011216074_100000739059 [0,1,0,0,1,0|2,0,0]=4 3786 B18R1.40541 CCCCCCCCCCN1CCCNC(=O)C1 2230a_100015190381_100000210320 [0,1,0,0,0,1|2,0,0]=4 3787 B18R1.40541 O=C1CN(CCCN1)CCCCCCCCCO 2230a_100015190381_100009813782 [0,1,0,0,0,1|2,0,0]=4 3788 B18R1.61756 CCCCCCCCCN1CCCN(C(=O)C1)C 2230a_100000709885_100011214924 [0,1,0,0,0,1|2,0,0]=4 3789 B18R1.61756 CCCCCCCCCN1CCCN(C(=O)C1)C 269982a_100000709885_100000210670 [0,1,0,0,0,1|2,0,0]=4 3790 B18R1.61756 CCCCCCCCCN1CCCN(C(=O)C1)C 34a_100000709885_100011214924 [0,1,0,0,0,1|2,0,0]=4 3791 B18R1.78021 CCCCCCCCC(C)N1CCCNC(=O)C1 270004a_100015190381_100011216694 [0,1,0,0,0,1|2,0,0]=4 3792 B18R1.681 CCCCCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210759 [0,2,0,0,0,0|1,0,0]=3 3793 B18R1.681 CCCCCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210759 [0,2,0,0,0,0|1,0,0]=3 3794 B18R1.681 CN1C(=O)CCCC1CNCCCCCCCO 2230a_200010383782_100000760002 [0,2,0,0,0,0|2,0,0]=4 3795 B18R1.681 CN1C(=O)CCCC1CNCCCCCCCO 34a_200010383782_100000760002 [0,2,0,0,0,0|2,0,0]=4 3796 B18R1.681 COCCCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100011998445 [0,2,0,0,0,0|2,0,0]=4 3797 B18R1.681 COCCCCCCNCC1CCCC(=O)N1C 34a_200010383782_100011998445 [0,2,0,0,0,0|2,0,0]=4 3798 B18R1.693 CCCCCCC(C)NCC1CCCC(=O)N1C 2230a_200010383782_100011215978 [0,2,0,0,0,0|2,0,0]=4 3799 B18R1.693 CCCCCCC(C)NCC1CCCC(=O)N1C 270004a_200010383782_100000210826 [0,2,0,0,0,0|2,0,0]=4 3800 B18R1.693 CCCCCCC(C)NCC1CCCC(=O)N1C 34a_200010383782_100011215978 [0,2,0,0,0,0|2,0,0]=4 3801 B18R1.17691 CC(C)CCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210682 [0,2,0,0,0,0|2,0,0]=4 3802 B18R1.17691 CC(C)CCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210682 [0,2,0,0,0,0|2,0,0]=4 3803 B18R1.700 CCCCCCCCCC(=O)C1CCNC(=O)C1 1458a_100000132800_100000210670 [0,2,0,0,0,0|2,0,0]=4 3804 B18R1.700 CCCCCCCCCC(=O)C1CSCC(=O)N1 1458a_100000045068_100000210670 [0,2,0,0,0,0|2,0,0]=4 3805 B18R1.700 CCCCCCCCCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000210670 [0,2,0,0,0,0|1,0,0]=3 3806 B18R1.700 CCCCCCCCNC(=O)[C@H]1CCCC(=O)N1 240690a_100000229939_100000705292 [0,2,0,0,0,0|1,0,1]=4 3807 B18R1.700 CCCCCCCCNC(=O)[C@H]1CCCC(=O)N1 527a_100000229939_100000705292 [0,2,0,0,0,0|1,0,1]=4 3808 B18R1.700 O=C1CCC[C@@H](N1)C(=O)CCCCCCCCO 1458a_100000705292_100000033203 [0,2,0,0,0,0|1,0,1]=4 3809 B18R1.1144 CCCCCCCC(C)C(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_200011218727 [0,2,0,0,0,0|1,0,1]=4 3810 B18R1.1108 C#CCCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100153394163 [0,2,0,0,0,0|1,0,1]=4 3811 B18R1.1108 C=CCCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100011933949 [0,2,0,0,0,0|1,0,1]=4 3812 B18R1.1108 C=CCCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100012355270 [0,2,0,0,0,0|1,0,1]=4 3813 B18R1.1108 CC1=CC(CCC1)OCCCCCCCCCO 34a_100011218613_100009813782 [0,2,0,0,0,0|2,0,0]=4 3814 B18R1.1108 CCC#CCCCCCCOC1CCCC(=O)C1 34a_100012613340_200000036426 [0,2,0,0,0,0|1,0,1]=4 3815 B18R1.1108 CCCCC#CCCCOCC1CCCC(=O)N1 34a_200000102386_200000047210 [0,2,0,0,0,0|1,0,1]=4 3816 B18R1.1108 CCCCCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210320 [0,2,0,0,0,0|2,0,0]=4 3817 B18R1.1108 CCCCCCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210320 [0,2,0,0,0,0|2,0,0]=4 3818 B18R1.1108 CCCCCCCCCCOC1C=C(CCC1)C 34a_100011218613_100000210320 [0,2,0,0,0,0|2,0,0]=4 3819 B18R1.1108 CCCCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210320 [0,2,0,0,0,0|1,0,0]=3 3820 B18R1.1108 CCCCCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210320 [0,2,0,0,0,0|2,0,0]=4 3821 B18R1.1108 CCCCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100011214924 [0,2,0,0,0,0|1,0,0]=3 3822 B18R1.1108 CCCCCCCCCOCC1CCNC(=O)C1 34a_100009886756_100011214924 [0,2,0,0,0,0|2,0,0]=4 3823 B18R1.1108 CCCCCCCCCOCC1COCC(=O)N1 34a_200000101122_100011214924 [0,2,0,0,0,0|2,0,0]=4 3824 B18R1.1108 O=C1CC(CCN1)COCCCCCCCCO 34a_100009886756_100000033203 [0,2,0,0,0,0|2,0,0]=4 3825 B18R1.1108 O=C1CC(CCN1)NCCCCCCCCCO 2230a_100016994916_100009813782 [0,2,0,0,0,0|2,0,0]=4 3826 B18R1.1108 O=C1CC(CCN1)NCCCCCCCCCO 34a_100016994916_100009813782 [0,2,0,0,0,0|2,0,0]=4 3827 B18R1.1108 O=C1CCCC(C1)OCCCCCCCCCO 34a_100012613340_100009813782 [0,2,0,0,0,0|1,0,0]=3 3828 B18R1.1108 O=C1CCCC(N1)COCCCCCCCCO 34a_200000102386_100000033203 [0,2,0,0,0,0|1,0,0]=3 3829 B18R1.1108 O=C1COCC(N1)COCCCCCCCCO 34a_200000101122_100000033203 [0,2,0,0,0,0|2,0,0]=4 3830 B18R1.1108 O=C1C[C@@H](CCN1)OCCCCCCCCCO 34a_100015189427_100009813782 [0,2,0,0,0,0|2,0,0]=4 3831 B18R1.1134 CCCCCCCC(C)OCC1CCCC(=O)N1 34a_200000102386_200011218727 [0,2,0,0,0,0|1,0,0]=3 3832 B18R1.1134 CCCCCCCC(C)OCC1CCNC(=O)C1 34a_100009886756_200011218727 [0,2,0,0,0,0|2,0,0]=4 3833 B18R1.1134 CCCCCCCC(C)OCC1COCC(=O)N1 34a_200000101122_200011218727 [0,2,0,0,0,0|2,0,0]=4 3834 B18R1.21928 CCCCCCCCCNC1CCN(C(=O)C1)C 2230a_100000126938_100011214924 [0,2,0,0,0,0|2,0,0]=4 3835 B18R1.21928 CCCCCCCCCNC1CCN(C(=O)C1)C 34a_100000126938_100011214924 [0,2,0,0,0,0|2,0,0]=4 3836 B18R1.35155 CCCCCCCC(C)(C)OC1CCCC(=O)C1 34a_100012613340_200000046972 [0,2,0,0,0,0|2,0,0]=4 3837 B18R1.9965 CC(C)CCCC(C)CCOC1CCCC(=O)C1 34a_100012613340_100009816328 [0,2,0,0,0,0|2,0,0]=4 3838 B18R1.9950 CC(C)(O)CCCCCOCC1CCCC(=O)N1 34a_200000102386_100010402123 [0,2,0,0,0,0|2,0,0]=4 3839 B16R1.57 CCC1CCCCC1NCCCCC(=O)N 269862a_100000696515_100000757040 [0,0,1,1,0,0|2,0,0]=4 3840 B16R1.57 CCC1CCCCC1NCCCCC(=O)N 270004a_100000696515_100000757040 [0,0,1,1,0,0|2,0,0]=4 3841 B16R1.57 CCC1CCCCC1OCCCCC(=O)C 34a_100000210738_100009817362 [0,0,1,1,0,0|2,0,0]=4 3842 B16R1.57 CCC1CCCCC1OCCCCC(=O)C 7a_100000210738_100000735457 [0,0,1,1,0,0|2,0,0]=4 3843 B16R1.57 CCC1CCCCN1CCCCCC(=O)N 2230a_100000210034_100009817443 [0,0,1,1,0,0|2,0,0]=4 3844 B16R1.57 CCC1CCCCN1CCCCCC(=O)N 269982a_100000210034_100009817443 [0,0,1,1,0,0|2,0,0]=4 3845 B16R1.57 CCC1CCCCN1CCCCCC(=O)N 34a_100000210034_100009817443 [0,0,1,1,0,0|2,0,0]=4 3846 B16R1.250 CCCCCCCCCCSC1CC(=O)C1 62a_100009894365_100000210320 [0,0,1,1,0,0|2,0,0]=4 3847 B16R1.250 CCCCCCCCCNCC1CC(=O)C1 2230a_100000212291_100009874392 [0,0,1,1,0,0|2,0,0]=4 3848 B16R1.250 CCCCCCCCCOCC1CC(=O)C1 34a_100000101936_100011214924 [0,0,1,1,0,0|2,0,0]=4 3849 B16R1.250 CCCCCCCCCOCC1CC(=O)C1 7a_100000210712_100009874392 [0,0,1,1,0,0|2,0,0]=4 3850 B16R1.250 CCCCCCCCCSCC1CC(=O)C1 62a_100009874392_100000210670 [0,0,1,1,0,0|2,0,0]=4 3851 B16R1.270 CCCCCCN1CCCCC1CC(=O)N 2230a_100015184752_100000210314 [0,0,1,1,0,0|2,0,0]=4 3852 B16R1.270 CCCCCCN1CCCCC1CC(=O)N 269982a_100015184752_100000210757 [0,0,1,1,0,0|2,0,0]=4 3853 B16R1.270 CCCCCCN1CCCCC1CC(=O)N 34a_100015184752_100000210314 [0,0,1,1,0,0|2,0,0]=4 3854 B16R1.290 CC1CCCCC1NCCCCCC(=O)N 2230a_100000211402_100009817443 [0,0,1,1,0,0|2,0,0]=4 3855 B16R1.290 CC1CCCCC1NCCCCCC(=O)N 34a_100000211402_100009817443 [0,0,1,1,0,0|2,0,0]=4 3856 B16R1.290 CC1CCCCC1OCCCCCC(=O)N 34a_100000211207_100009817443 [0,0,1,1,0,0|2,0,0]=4 3857 B16R1.290 CC1CCCCC1OCCCCCC(=O)N 7a_100000211207_100009817443 [0,0,1,1,0,0|2,0,0]=4 3858 B16R1.695 CCCC1CCCCC1NCCCC(=O)N 269862a_100000739312_100011218038 [0,0,1,1,0,0|2,0,0]=4 3859 B16R1.695 CCCC1CCCCC1OCCCC(=O)C 34a_100011217265_100000685027 [0,0,1,1,0,0|2,0,0]=4 3860 B16R1.695 CCCC1CCCCC1OCCCC(=O)C 7a_100011217265_100011215641 [0,0,1,1,0,0|2,0,0]=4 3861 B16R1.695 CCCC1CCCCC1OCCCC(=O)N 34a_100011217265_100102525003 [0,0,1,1,0,0|2,0,0]=4 3862 B16R1.695 CCCC1CCCCC1OCCCC(=O)N 7a_100011217265_100102525003 [0,0,1,1,0,0|2,0,0]=4 3863 B16R1.695 CCCC1CCCCN1CCCCC(=O)C 269982a_100000701414_100000735457 [0,0,1,1,0,0|2,0,0]=4 3864 B16R1.695 CCCC1CCCCN1CCCCC(=O)C 34a_100000701414_100009817362 [0,0,1,1,0,0|2,0,0]=4 3865 B16R1.708 CCCC1CCCC1NCCCCC(=O)N 269862a_100000696515_100000723119 [0,0,1,1,0,0|2,0,0]=4 3866 B16R1.708 CCCC1CCCC1NCCCCC(=O)N 270004a_100000696515_100000723119 [0,0,1,1,0,0|2,0,0]=4 3867 B16R1.1270 CCCCC1CCCC1NCCCC(=O)N 269862a_100000739312_100000750825 [0,0,1,1,0,0|2,0,0]=4 3868 B16R1.1275 CC(=O)CCCCNCCCC1CCCC1 34a_100000736752_100009817362 [0,0,1,1,0,0|2,0,0]=4 3869 B16R1.1275 CC(=O)CCCCOCCCC1CCCC1 34a_100011215328_100009817362 [0,0,1,1,0,0|2,0,0]=4 3870 B16R1.1275 CC(=O)CCCCOCCCC1CCCC1 7a_100011215328_100000735457 [0,0,1,1,0,0|2,0,0]=4 3871 B16R1.1275 CC(=O)CCCCSCCCC1CCCC1 62a_100000735457_100011713738 [0,0,1,1,0,0|2,0,0]=4 3872 B16R1.1275 CC(=O)CCCCSCCCC1CCCC1 62a_100011713738_100000735457 [0,0,1,1,0,0|2,0,0]=4 3873 B16R1.1275 NC(=O)CCCCCNCCC1CCCC1 2230a_100000739158_100009817443 [0,0,1,1,0,0|2,0,0]=4 3874 B16R1.1275 NC(=O)CCCCCNCCC1CCCC1 34a_100000739158_100009817443 [0,0,1,1,0,0|2,0,0]=4 3875 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 34a_100000123541_100000760354 [0,0,1,1,0,0|2,0,0]=4 3876 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 34a_100000749090_100009817443 [0,0,1,1,0,0|2,0,0]=4 3877 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 7a_100000123541_100000760354 [0,0,1,1,0,0|2,0,0]=4 3878 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 7a_100000749090_100009817443 [0,0,1,1,0,0|2,0,0]=4 3879 B16R1.1275 NC(=O)CCCCCSCCC1CCCC1 62a_100000760354_100009817443 [0,0,1,1,0,0|2,0,0]=4 3880 B16R1.1275 NC(=O)CCCCCSCCC1CCCC1 62a_100009817443_100000760354 [0,0,1,1,0,0|2,0,0]=4 3881 B16R1.1275 NC(=O)CCCCNCCCC1CCCC1 34a_100000696515_100011713738 [0,0,1,1,0,0|2,0,0]=4 3882 B16R1.1275 NC(=O)CCCCOCCCC1CCCC1 34a_100012022536_100011713738 [0,0,1,1,0,0|2,0,0]=4 3883 B16R1.1275 NC(=O)CCCCOCCCC1CCCC1 7a_100012022536_100011713738 [0,0,1,1,0,0|2,0,0]=4 3884 B16R1.1275 O=C(O)COCCNCCCC1CCCC1 269956a_100000700818_100011713738 [0,0,1,1,0,0|2,0,0]=4 3885 B16R1.1275 O=C([O-])CCCCCOCCC1CCCC1 7a_100102619762_100000760354 [0,0,1,1,0,0|1,0,1]=4 3886 B16R1.1424 CCCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210326 [0,0,1,1,0,0|1,0,0]=3 3887 B16R1.1424 CCOCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210147 [0,0,1,1,0,0|2,0,0]=4 3888 B16R1.1424 CCSCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000757381 [0,0,1,1,0,0|2,0,0]=4 3889 B16R1.1424 COCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000740836 [0,0,1,1,0,0|2,0,0]=4 3890 B16R1.1424 O=C(O)CCC1CCCCN1CCCCF 269956a_100000694054_100000729493 [0,0,1,1,0,0|2,0,0]=4 3891 B16R1.1424 O=C(O)CCC1CCCCN1CCCCO 269956a_100000694054_100000210776 [0,0,1,1,0,0|2,0,0]=4 3892 B16R1.1442 CCCCCC1CCCC1NCCC(=O)N 269862a_100000740010_200000198059 [0,0,1,1,0,0|2,0,0]=4 3893 B16R1.3900 CCCCCCCN1CCCCC1C(=O)N 2230a_100000181395_100000210681 [0,0,1,1,0,0|2,0,0]=4 3894 B16R1.3900 CCCCCCCN1CCCCC1C(=O)N 269982a_100000181395_100000210681 [0,0,1,1,0,0|2,0,0]=4 3895 B16R1.3900 CCCCCCCN1CCCCC1C(=O)N 34a_100000181395_100000210614 [0,0,1,1,0,0|2,0,0]=4 3896 B16R1.3900 CCCCCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000210614 [0,0,1,1,0,0|1,0,0]=3 3897 B16R1.3900 CCCCCCCN1CCOC[C@@H]1C(=O)O 269956a_100016993156_100000210614 [0,0,1,1,0,0|2,0,0]=4 3898 B16R1.3900 CCCCCCCN1CCSCC1C(=O)O 269956a_100011346106_100000210614 [0,0,1,1,0,0|2,0,0]=4 3899 B16R1.3900 CCCCCCCN1CSCCC1C(=O)O 269956a_100015185162_100000210614 [0,0,1,1,0,0|2,0,0]=4 3900 B16R1.3900 CCCCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000210757 [0,0,1,1,0,0|1,0,0]=3 3901 B16R1.3900 CCCCOCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000743108 [0,0,1,1,0,0|2,0,0]=4 3902 B16R1.3900 CCCCOCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100011995733 [0,0,1,1,0,0|2,0,0]=4 3903 B16R1.3900 CCCOCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100011215938 [0,0,1,1,0,0|2,0,0]=4 3904 B16R1.3900 CCOCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100012232248 [0,0,1,1,0,0|2,0,0]=4 3905 B16R1.3900 COCCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000730899 [0,0,1,1,0,0|2,0,0]=4 3906 B16R1.3900 O=C(O)[C@@H]1CCCC[C@H]1NCCCCCF 269956a_100009816435_100000729378 [0,0,1,1,0,0|2,0,0]=4 3907 B16R1.3900 O=C(O)[C@@H]1CCCC[C@H]1NCCCCCO 269956a_100009816435_100000746330 [0,0,1,1,0,0|2,0,0]=4 3908 B16R1.3900 O=C(O)[C@H]1CCCCN1CCCCCCF 269956a_100000763471_100015922095 [0,0,1,1,0,0|2,0,0]=4 3909 B16R1.3900 O=C(O)[C@H]1CCCCN1CCCCCCO 269956a_100000763471_100000766143 [0,0,1,1,0,0|2,0,0]=4 3910 B16R1.5450 CCCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000210211 [0,0,1,1,0,0|1,0,0]=3 3911 B16R1.5450 CCOCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000739092 [0,0,1,1,0,0|2,0,0]=4 3912 B16R1.5450 COCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000233755 [0,0,1,1,0,0|2,0,0]=4 3913 B16R1.5450 CSCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000212216 [0,0,1,1,0,0|2,0,0]=4 3914 B16R1.5450 O=C(O)[C@H]1CCCCCC[C@H]1NCCCF 269956a_200049070474_100011934791 [0,0,1,1,0,0|2,0,0]=4 3915 B16R1.5450 O=C(O)[C@H]1CCCCCC[C@H]1NCCCO 269956a_200049070474_100011215043 [0,0,1,1,0,0|2,0,0]=4 3916 B16R1.6690 CCCCCCCCN1CCC[C@H]1C(=O)N 2230a_100000003125_100000210759 [0,0,1,1,0,0|2,0,0]=4 3917 B16R1.6690 CCCCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000210759 [0,0,1,1,0,0|1,0,0]=3 3918 B16R1.6690 CCCCCCCCN1CCSC1C(=O)O 269956a_100000035718_100000210759 [0,0,1,1,0,0|2,0,0]=4 3919 B16R1.6690 CCCCCCCCN1CSC[C@H]1C(=O)O 269956a_100000743924_100000210759 [0,0,1,1,0,0|2,0,0]=4 3920 B16R1.6690 COCCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100011998445 [0,0,1,1,0,0|2,0,0]=4 3921 B16R1.6690 O=C(O)[C@@H]1CCCN1CCCCCCCO 269956a_100000743916_100000760002 [0,0,1,1,0,0|2,0,0]=4 3922 B16R1.7037 CCCCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000210757 [0,0,1,1,0,0|1,0,0]=3 3923 B16R1.7037 CCCCOCN1CCCCCC1C(=O)O 269956a_100000758484_100011995733 [0,0,1,1,0,0|2,0,0]=4 3924 B16R1.7037 CCCOCCN1CCCCCC1C(=O)O 269956a_100000758484_100011215938 [0,0,1,1,0,0|2,0,0]=4 3925 B16R1.7037 CCOCCCN1CCCCCC1C(=O)O 269956a_100000758484_100012232248 [0,0,1,1,0,0|2,0,0]=4 3926 B16R1.7037 COCCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000730899 [0,0,1,1,0,0|2,0,0]=4 3927 B16R1.7037 O=C(O)C1CCCCCN1CCCCCF 269956a_100000758484_100000729378 [0,0,1,1,0,0|2,0,0]=4 3928 B16R1.7037 O=C(O)C1CCCCCN1CCCCCO 269956a_100000758484_100000746330 [0,0,1,1,0,0|2,0,0]=4 3929 B16R1.12272 CC(=O)CCCCN1CCCCCCCC1 269982a_100000039187_100000735457 [0,0,1,1,0,0|2,0,0]=4 3930 B16R1.12272 CC(=O)CCCCN1CCCCCCCC1 34a_100000039187_100009817362 [0,0,1,1,0,0|2,0,0]=4 3931 B16R1.12354 CC(=O)CCCCNC1CCCCCCC1 34a_100000211152_100009817362 [0,0,1,1,0,0|2,0,0]=4 3932 B16R1.12354 CC(=O)CCCCOC1CCCCCCC1 34a_100000210054_100009817362 [0,0,1,1,0,0|2,0,0]=4 3933 B16R1.12354 CC(=O)CCCCOC1CCCCCCC1 7a_100000210054_100000735457 [0,0,1,1,0,0|2,0,0]=4 3934 B16R1.12354 CC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100000685027 [0,0,1,1,0,0|2,0,0]=4 3935 B16R1.12354 CC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100011215641 [0,0,1,1,0,0|2,0,0]=4 3936 B16R1.12354 NC(=O)CCCCCN1CCCCCCC1 2230a_100000211400_100009817443 [0,0,1,1,0,0|2,0,0]=4 3937 B16R1.12354 NC(=O)CCCCCN1CCCCCCC1 269982a_100000211400_100009817443 [0,0,1,1,0,0|2,0,0]=4 3938 B16R1.12354 NC(=O)CCCCCN1CCCCCCC1 34a_100000211400_100009817443 [0,0,1,1,0,0|2,0,0]=4 3939 B16R1.12354 NC(=O)CCCCNC1CCCCCCC1 270004a_100000696515_100000210524 [0,0,1,1,0,0|2,0,0]=4 3940 B16R1.12354 NC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100102525003 [0,0,1,1,0,0|2,0,0]=4 3941 B16R1.12354 NC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100102525003 [0,0,1,1,0,0|2,0,0]=4 3942 B16R1.12354 NC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000744528 [0,0,1,1,0,0|2,0,0]=4 3943 B16R1.12354 NC(=O)CCNCCC1CCCCCCC1 34a_100011532352_100000731001 [0,0,1,1,0,0|2,0,0]=4 3944 B16R1.17540 CCCCCCCCCN1CCC1C(=O)O 269956a_100000021838_100000210670 [0,0,1,1,0,0|1,0,0]=3 3945 B16R1.17540 O=C(O)C1CCN1CCCCCCCCO 269956a_100000021838_100000033203 [0,0,1,1,0,0|2,0,0]=4 3946 B16R1.18095 CC(=O)CCCCNCC1CCCCCC1 34a_100015204231_100009817362 [0,0,1,1,0,0|2,0,0]=4 3947 B16R1.18095 CC(=O)CCCCOCC1CCCCCC1 34a_100000699130_100009817362 [0,0,1,1,0,0|2,0,0]=4 3948 B16R1.18095 CC(=O)CCCCOCC1CCCCCC1 7a_100000699130_100000735457 [0,0,1,1,0,0|2,0,0]=4 3949 B16R1.18095 CC(=O)CCCCSCC1CCCCCC1 62a_100000735457_200000696569 [0,0,1,1,0,0|2,0,0]=4 3950 B16R1.18095 CC(=O)CCCCSCC1CCCCCC1 62a_200000696569_100000735457 [0,0,1,1,0,0|2,0,0]=4 3951 B16R1.18095 CC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100000685027 [0,0,1,1,0,0|2,0,0]=4 3952 B16R1.18095 NC(=O)CCCCCNC1CCCCCC1 2230a_100000210984_100009817443 [0,0,1,1,0,0|2,0,0]=4 3953 B16R1.18095 NC(=O)CCCCCNC1CCCCCC1 34a_100000210984_100009817443 [0,0,1,1,0,0|2,0,0]=4 3954 B16R1.18095 NC(=O)CCCCCOC1CCCCCC1 34a_100000123541_100011217769 [0,0,1,1,0,0|2,0,0]=4 3955 B16R1.18095 NC(=O)CCCCCOC1CCCCCC1 34a_100000210887_100009817443 [0,0,1,1,0,0|2,0,0]=4 3956 B16R1.18095 NC(=O)CCCCCOC1CCCCCC1 7a_100000210887_100009817443 [0,0,1,1,0,0|2,0,0]=4 3957 B16R1.18095 NC(=O)CCCCCSC1CCCCCC1 62a_100009817443_100011217769 [0,0,1,1,0,0|2,0,0]=4 3958 B16R1.18095 NC(=O)CCCCCSC1CCCCCC1 62a_100011217769_100009817443 [0,0,1,1,0,0|2,0,0]=4 3959 B16R1.18095 NC(=O)CCCCNCC1CCCCCC1 269862a_100000696515_200000763224 [0,0,1,1,0,0|2,0,0]=4 3960 B16R1.18095 NC(=O)CCCCNCC1CCCCCC1 34a_100000696515_200000696569 [0,0,1,1,0,0|2,0,0]=4 3961 B16R1.18095 NC(=O)CCCCOCC1CCCCCC1 34a_100012022536_200000696569 [0,0,1,1,0,0|2,0,0]=4 3962 B16R1.18095 NC(=O)CCCCOCC1CCCCCC1 7a_100012022536_200000696569 [0,0,1,1,0,0|2,0,0]=4 3963 B16R1.18095 NC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100102525003 [0,0,1,1,0,0|2,0,0]=4 3964 B16R1.18095 O=C(O)COCCNCC1CCCCCC1 269956a_100000700818_200000696569 [0,0,1,1,0,0|2,0,0]=4 3965 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100015343762 [0,0,1,1,0,0|2,0,0]=4 3966 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100015343762 [0,0,1,1,0,0|2,0,0]=4 3967 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100015343762 [0,0,1,1,0,0|2,0,0]=4 3968 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100103153847 [0,0,1,1,0,0|2,0,0]=4 3969 B16R1.13660 CCCCCCCCCC(=O)C1CCC1=O 1458a_100000210558_100009892977 [0,0,1,1,0,0|0,0,2]=4 3970 B16R1.13660 CCCCCCCCCN(C)C1CCC1=O 269982a_100000232482_100009892977 [0,0,1,1,0,0|2,0,0]=4 3971 B16R1.694 CCCC(=O)COC1CCCCC1CCC 7a_100011217265_100000747444 [0,0,1,1,0,0|2,0,0]=4 3972 B16R1.694 CCCC(=O)OCN1CCCCC1CCC 2230a_100000701414_100000034017 [0,0,1,1,0,0|1,0,0]=3 3973 B16R1.694 CCCC(=O)OCN1CCCCC1CCC 269982a_100000701414_100000034017 [0,0,1,1,0,0|1,0,0]=3 3974 B16R1.694 CCCC(=O)OCN1CCCCC1CCC 34a_100000701414_100000034017 [0,0,1,1,0,0|1,0,0]=3 3975 B16R1.694 CCCC(=O)OCN1CCCCC1CCO 2230a_100000211664_100000034017 [0,0,1,1,0,0|2,0,0]=4 3976 B16R1.694 CCCC(=O)OCN1CCCCC1CCO 269982a_100000211664_100000034017 [0,0,1,1,0,0|2,0,0]=4 3977 B16R1.694 CCCC(=O)OCN1CCCCC1CCO 34a_100000211664_100000034017 [0,0,1,1,0,0|2,0,0]=4 3978 B16R1.694 CCCC(=O)OCN1CCCCC1COC 2230a_100015184032_100000034017 [0,0,1,1,0,0|2,0,0]=4 3979 B16R1.694 CCCC(=O)OCN1CCCCC1COC 269982a_100015184032_100000034017 [0,0,1,1,0,0|2,0,0]=4 3980 B16R1.694 CCCC(=O)OCN1CCCCC1COC 34a_100015184032_100000034017 [0,0,1,1,0,0|2,0,0]=4 3981 B16R1.694 CCCC(=O)OCN1CCOCC1CCC 2230a_102495339903_100000034017 [0,0,1,1,0,0|2,0,0]=4 3982 B16R1.694 CCCC(=O)OCN1CCOCC1CCC 269982a_102495339903_100000034017 [0,0,1,1,0,0|2,0,0]=4 3983 B16R1.694 CCCC(=O)OCN1CCOCC1CCC 34a_102495339903_100000034017 [0,0,1,1,0,0|2,0,0]=4 3984 B16R1.889 CCCC(=O)NCCCN1CCCCC1C 240690a_100000212276_100000211992 [0,0,1,1,0,0|2,0,0]=4 3985 B16R1.889 CCCC(=O)NCCCN1CCCCC1C 527a_100000212276_100000211992 [0,0,1,1,0,0|2,0,0]=4 3986 B16R1.889 CCCC(=O)OCNCC1CCCCC1O 34a_100011216029_100000034017 [0,0,1,1,0,0|2,0,0]=4 3987 B16R1.889 CCCC(=O)OCNCC1CCCCN1C 34a_100011228421_100000034017 [0,0,1,1,0,0|2,0,0]=4 3988 B16R1.889 CCCC(=O)OCOCC1CCCCN1C 34a_100000225079_100000034017 [0,0,1,1,0,0|2,0,0]=4 3989 B16R1.889 CCCC(=O)OCSCC1CCCCN1C 62a_100015185383_100000034017 [0,0,1,1,0,0|2,0,0]=4 3990 B16R1.890 CCCC(=O)OCNCC1CCCN1CC 2230a_100000211693_100000034017 [0,0,1,1,0,0|2,0,0]=4 3991 B16R1.890 CCCC(=O)OCOC[C@H]1CCCN1CC 34a_100011739246_100000034017 [0,0,1,1,0,0|2,0,0]=4 3992 B16R1.948 CCCC(=O)NCCN1CCCCC1CC 11a_100000755458_100000211992 [0,0,1,1,0,0|2,0,0]=4 3993 B16R1.948 CCCC(=O)NCCN1CCCCC1CC 1626a_100000755458_100000211992 [0,0,1,1,0,0|2,0,0]=4 3994 B16R1.948 CCCC(=O)NCCN1CCCCC1CC 240690a_100000755458_100000211992 [0,0,1,1,0,0|2,0,0]=4 3995 B16R1.948 CCCC(=O)NCCN1CCCCC1CC 527a_100000755458_100000211992 [0,0,1,1,0,0|2,0,0]=4 3996 B16R1.948 CCCC(=O)OCNC1CCCCC1OC 34a_100011208099_100000034017 [0,0,1,1,0,0|2,0,0]=4 3997 B16R1.948 CCCC(=O)OCOC1CCCCC1CC 34a_100000210738_100000034017 [0,0,1,1,0,0|1,0,0]=3 3998 B16R1.948 CCCC(=O)OCOC1CCCCC1CN 34a_100011216029_100000034017 [0,0,1,1,0,0|2,0,0]=4 3999 B16R1.948 CCCC(=O)OCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000034017 [0,0,1,1,0,0|2,0,0]=4 4000 B16R1.948 CCCC(=O)OCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000034017 [0,0,1,1,0,0|2,0,0]=4 4001 B16R1.949 CCCC(=O)NCCCCCN1CCCC1 1626a_100011491779_100000211992 [0,0,1,1,0,0|2,0,0]=4 4002 B16R1.949 CCCC(=O)NCCCCCN1CCCC1 240690a_100011491779_100000211992 [0,0,1,1,0,0|2,0,0]=4 4003 B16R1.949 CCCC(=O)OCNCCCC1CCCC1 2230a_100000736752_100000034017 [0,0,1,1,0,0|1,0,0]=3 4004 B16R1.949 CCCC(=O)OCNCCCC1CCCC1 34a_100000736752_100000034017 [0,0,1,1,0,0|1,0,0]=3 4005 B16R1.949 CCCC(=O)OCNCCOC1CCCC1 34a_100000741755_100000034017 [0,0,1,1,0,0|2,0,0]=4 4006 B16R1.949 CCCC(=O)OCOCCCC1CCCC1 34a_100011215328_100000034017 [0,0,1,1,0,0|1,0,0]=3 4007 B16R1.949 CCCC(=O)OCOCCNC1CCCC1 34a_200000200444_100000034017 [0,0,1,1,0,0|2,0,0]=4 4008 B16R1.949 CCCC(=O)OCOCCOC1CCCC1 34a_100000738311_100000034017 [0,0,1,1,0,0|2,0,0]=4 4009 B16R1.949 CCCC(=O)OCSCCCC1CCCC1 62a_100011713738_100000034017 [0,0,1,1,0,0|1,0,0]=3 4010 B16R1.949 CCCC(=O)OCSCCCN1CCCC1 62a_100016991639_100000034017 [0,0,1,1,0,0|2,0,0]=4 4011 B16R1.949 CCOC(=O)OCSCCCC1CCCC1 62a_100011713738_100000075025 [0,0,1,1,0,0|2,0,0]=4 4012 B16R1.1193 CCCCCCCCCCOC1CCCC1 34a_100000210269_100000210320 [0,0,1,1,0,0|1,0,1]=4 4013 B16R1.1193 CCCCCCCCCCOC1CCCC1 34a_100000210711_100000179811 [0,0,1,1,0,0|1,0,1]=4 4014 B16R1.1193 CCCCCCCCCCOC1CCCC1 7a_100000210269_100000210320 [0,0,1,1,0,0|1,0,1]=4 4015 B16R1.1193 CCCCCCCCCCOC1CCCC1 7a_100000210711_100000179811 [0,0,1,1,0,0|1,0,1]=4 4016 B16R1.1193 CCCCCCCCCCOC1CCCO1 34a_100000085407_100000210320 [0,0,1,1,0,0|0,0,2]=4 4017 B16R1.2034 CCCC(=O)COCC1CCCCCCC1 7a_100011216312_100000747444 [0,0,1,1,0,0|2,0,0]=4 4018 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000211992 [0,0,1,1,0,0|1,0,0]=3 4019 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000211992 [0,0,1,1,0,0|1,0,0]=3 4020 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000211992 [0,0,1,1,0,0|1,0,0]=3 4021 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000211992 [0,0,1,1,0,0|1,0,0]=3 4022 B16R1.2034 CCCC(=O)OCNC1CCCCCCC1 2230a_100000211152_100000034017 [0,0,1,1,0,0|1,0,0]=3 4023 B16R1.2034 CCCC(=O)OCNC1CCCCCCC1 34a_100000211152_100000034017 [0,0,1,1,0,0|1,0,0]=3 4024 B16R1.2034 CCCC(=O)OCOC1CCCCCCC1 34a_100000210054_100000034017 [0,0,1,1,0,0|1,0,0]=3 4025 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 2708a_100011532352_100015525214 [0,0,1,1,0,0|2,0,0]=4 4026 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 2708a_100015525214_100011532352 [0,0,1,1,0,0|2,0,0]=4 4027 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 273464a_100011532352_100015525214 [0,0,1,1,0,0|2,0,0]=4 4028 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 273464a_100015525214_100011532352 [0,0,1,1,0,0|2,0,0]=4 4029 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 512a_100015525214_100011532352 [0,0,1,1,0,0|2,0,0]=4 4030 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000210968 [0,0,1,1,0,0|2,0,0]=4 4031 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000210968 [0,0,1,1,0,0|2,0,0]=4 4032 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000210968 [0,0,1,1,0,0|2,0,0]=4 4033 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000210968 [0,0,1,1,0,0|2,0,0]=4 4034 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000184570 [0,0,1,1,0,0|2,0,0]=4 4035 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000184570 [0,0,1,1,0,0|2,0,0]=4 4036 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000184570 [0,0,1,1,0,0|2,0,0]=4 4037 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000184570 [0,0,1,1,0,0|2,0,0]=4 4038 B16R1.2034 O=C(CCO)NCCC1CCCCCCC1 240690a_100011532352_100011216618 [0,0,1,1,0,0|2,0,0]=4 4039 B16R1.12723 CCCC(=O)N1CCCCC1CCCOC 11a_100011804088_100000211992 [0,0,1,1,0,0|2,0,0]=4 4040 B16R1.12723 CCCC(=O)N1CCCCC1CCCOC 1626a_100011804088_100000211992 [0,0,1,1,0,0|2,0,0]=4 4041 B16R1.12723 CCCC(=O)N1CCCCC1CCCOC 240690a_100011804088_100000211992 [0,0,1,1,0,0|2,0,0]=4 4042 B16R1.12723 CCCC(=O)N1CCCCC1CCCOC 527a_100011804088_100000211992 [0,0,1,1,0,0|2,0,0]=4 4043 B16R1.15027 CCCC(=O)OCN1CCCCCCCC1 2230a_100000039187_100000034017 [0,0,1,1,0,0|1,0,0]=3 4044 B16R1.15027 CCCC(=O)OCN1CCCCCCCC1 269982a_100000039187_100000034017 [0,0,1,1,0,0|1,0,0]=3 4045 B16R1.15027 CCCC(=O)OCN1CCCCCCCC1 34a_100000039187_100000034017 [0,0,1,1,0,0|1,0,0]=3 4046 B16R1.15047 CCCC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000747444 [0,0,1,1,0,0|2,0,0]=4 4047 B16R1.15047 CCCC(=O)NCCCN1CCCCCC1 11a_100000181460_100000211992 [0,0,1,1,0,0|2,0,0]=4 4048 B16R1.15047 CCCC(=O)NCCCN1CCCCCC1 240690a_100000181460_100000211992 [0,0,1,1,0,0|2,0,0]=4 4049 B16R1.15047 CCCC(=O)NCCCN1CCCCCC1 527a_100000181460_100000211992 [0,0,1,1,0,0|2,0,0]=4 4050 B16R1.15047 CCCC(=O)OCNCC1CCCCCC1 2230a_100015204231_100000034017 [0,0,1,1,0,0|1,0,0]=3 4051 B16R1.15047 CCCC(=O)OCNCC1CCCCCC1 34a_100015204231_100000034017 [0,0,1,1,0,0|1,0,0]=3 4052 B16R1.15047 CCCC(=O)OCOCC1CCCCCC1 34a_100000699130_100000034017 [0,0,1,1,0,0|1,0,0]=3 4053 B16R1.15047 CCCC(=O)OCSCC1CCCCCC1 62a_200000696569_100000034017 [0,0,1,1,0,0|1,0,0]=3 4054 B16R1.15047 CCOC(=O)OCSCC1CCCCCC1 62a_200000696569_100000075025 [0,0,1,1,0,0|2,0,0]=4 4055 B16R1.17792 CCCCCCCN1CCNC(=O)C1CC 2230a_100000187962_100000210681 [0,0,1,1,0,0|2,0,0]=4 4056 B16R1.17792 CCCCCCCN1CCNC(=O)C1CC 269982a_100000187962_100000210681 [0,0,1,1,0,0|2,0,0]=4 4057 B16R1.17792 CCCCCCCN1CCNC(=O)C1CC 34a_100000187962_100000210614 [0,0,1,1,0,0|2,0,0]=4 4058 B16R1.20656 CCCCCCCCCCCC(=O)C1CC1 1458a_100000210395_100011215454 [0,0,1,1,0,0|1,0,0]=3 4059 B16R1.20656 CCCCCCCCCCCC(=O)C1CO1 1458a_100000701028_100011215454 [0,0,1,1,0,0|2,0,0]=4 4060 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 11a_100000684558_100000210395 [0,0,1,1,0,0|1,0,0]=3 4061 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 1626a_100000684558_100000210395 [0,0,1,1,0,0|1,0,0]=3 4062 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 240690a_100000684558_100000210395 [0,0,1,1,0,0|1,0,0]=3 4063 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 527a_100000684558_100000210395 [0,0,1,1,0,0|1,0,0]=3 4064 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 11a_100000684558_100000701028 [0,0,1,1,0,0|2,0,0]=4 4065 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 1626a_100000684558_100000701028 [0,0,1,1,0,0|2,0,0]=4 4066 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 240690a_100000684558_100000701028 [0,0,1,1,0,0|2,0,0]=4 4067 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 527a_100000684558_100000701028 [0,0,1,1,0,0|2,0,0]=4 4068 B16R1.20656 CCCCCCCCCCOC(C)C1CC1 34a_100000744524_100000210320 [0,0,1,1,0,0|1,0,1]=4 4069 B16R1.20656 CCCCCCCCCCOC(C)C1CC1 7a_100000744524_100000210320 [0,0,1,1,0,0|1,0,1]=4 4070 B16R1.20656 CCCCCCCCCNCC(=O)C1CC1 2230a_100000212291_100000746382 [0,0,1,1,0,0|2,0,0]=4 4071 B16R1.20656 CCCCCCCCCNCC(=O)C1CC1 34a_100000212291_100000746382 [0,0,1,1,0,0|2,0,0]=4 4072 B16R1.20656 CCCCCCCCCOCC(=O)C1CC1 34a_100000210712_100000746382 [0,0,1,1,0,0|2,0,0]=4 4073 B16R1.20656 CCCCCCCCCOCC(=O)C1CC1 34a_100000686663_100011214924 [0,0,1,1,0,0|2,0,0]=4 4074 B16R1.20656 CCCCCCCCCOCC(=O)C1CC1 7a_100000210712_100000746382 [0,0,1,1,0,0|2,0,0]=4 4075 B16R1.20656 CCCCCCCCCSCC(=O)C1CC1 62a_100000746382_100000210670 [0,0,1,1,0,0|2,0,0]=4 4076 B16R1.20656 CCCCCCCCNCOC(=O)C1CC1 2230a_100000229939_100000140896 [0,0,1,1,0,0|1,0,0]=3 4077 B16R1.20656 CCCCCCCCNCOC(=O)C1CC1 34a_100000229939_100000140896 [0,0,1,1,0,0|1,0,0]=3 4078 B16R1.20656 CCCCCCCCOCOC(=O)C1CC1 34a_100000210232_100000140896 [0,0,1,1,0,0|1,0,0]=3 4079 B16R1.20656 CCCCCCCCSCOC(=O)C1CC1 62a_100000140896_100000210317 [0,0,1,1,0,0|1,0,0]=3 4080 B16R1.20656 CCCCCCCCSCOC(=O)C1CC1 62a_100000210759_100000140896 [0,0,1,1,0,0|1,0,0]=3 4081 B16R1.20656 CCCCCNCCOCOC(=O)C1CC1 34a_100000224656_100000140896 [0,0,1,1,0,0|2,0,0]=4 4082 B16R1.20656 CCCCCOCCOCOC(=O)C1CC1 34a_100011215259_100000140896 [0,0,1,1,0,0|2,0,0]=4 4083 B16R1.20656 CCCCOCCCNCOC(=O)C1CC1 2230a_200000211371_100000140896 [0,0,1,1,0,0|2,0,0]=4 4084 B16R1.20656 CCCCOCCCNCOC(=O)C1CC1 34a_200000211371_100000140896 [0,0,1,1,0,0|2,0,0]=4 4085 B16R1.20656 CCCCOCCCOCOC(=O)C1CC1 34a_200011215613_100000140896 [0,0,1,1,0,0|2,0,0]=4 4086 B16R1.20656 COCCCCCCOCOC(=O)C1CC1 34a_200012092642_100000140896 [0,0,1,1,0,0|2,0,0]=4 4087 B16R1.20656 COCCCCCCSCOC(=O)C1CC1 62a_100000140896_100011998445 [0,0,1,1,0,0|2,0,0]=4 4088 B16R1.20656 COCCCCCCSCOC(=O)C1CC1 62a_100011998445_100000140896 [0,0,1,1,0,0|2,0,0]=4 4089 B16R1.20656 NCCCCCCCOCOC(=O)C1CC1 34a_100011996573_100000140896 [0,0,1,1,0,0|2,0,0]=4 4090 B16R1.20656 O=C(CCCCCCCCCCO)C1CC1 1458a_100000210395_100009813290 [0,0,1,1,0,0|2,0,0]=4 4091 B16R1.20656 O=C(NCCCCCCCCCO)C1CC1 240690a_100000078944_100000210395 [0,0,1,1,0,0|2,0,0]=4 4092 B16R1.20656 O=C(OCNCCCCCCCO)C1CC1 2230a_100011996573_100000140896 [0,0,1,1,0,0|2,0,0]=4 4093 B16R1.20656 O=C(OCNCCCCCCCO)C1CC1 34a_100011996573_100000140896 [0,0,1,1,0,0|2,0,0]=4 4094 B16R1.20656 O=C(OCOCCCCCCCBr)C1CC1 34a_100000760002_100000140896 [0,0,1,1,0,0|2,0,0]=4 4095 B16R1.20656 O=C(OCSCCCCCCCO)C1CC1 62a_100000140896_100000760002 [0,0,1,1,0,0|2,0,0]=4 4096 B16R1.20656 O=C(OCSCCCCCCCO)C1CC1 62a_100000760002_100000140896 [0,0,1,1,0,0|2,0,0]=4 4097 B16R1.27196 CCCCCCCCCCOC1(CCC1)C 34a_100000759064_100000210320 [0,0,1,1,0,0|1,0,1]=4 4098 B16R1.27196 CCCCCCCCCCOC1(CCC1)C 7a_100000759064_100000210320 [0,0,1,1,0,0|1,0,1]=4 4099 B16R1.1226 CC(=O)OC1CCC(CC1)NCCCCO 270004a_100000750430_200000086378 [0,0,1,1,0,0|2,0,0]=4 4100 B16R1.1226 CCCCCCN1CCC(CC1)NC(=O)C 2230a_100000747453_100000210314 [0,0,1,1,0,0|2,0,0]=4 4101 B16R1.1226 CCCCCCN1CCC(CC1)NC(=O)C 269982a_100000747453_100000210757 [0,0,1,1,0,0|2,0,0]=4 4102 B16R1.1226 CCCCCNC1CCC(CC1)NC(=O)C 270004a_100000209983_100000735651 [0,0,1,1,0,0|2,0,0]=4 4103 B16R1.1226 CCCCCNC1CCC(CC1)OC(=O)C 270004a_100000209983_200000086378 [0,0,1,1,0,0|1,0,0]=3 4104 B16R1.1226 CCCCCOC1CCC(CC1)NC(=O)C 34a_100000161027_100000718602 [0,0,1,1,0,0|2,0,0]=4 4105 B16R1.1226 CCCCCOC1CCC(CC1)NC(=O)C 7a_100000161027_100000210326 [0,0,1,1,0,0|2,0,0]=4 4106 B16R1.1226 CCOCCNC1CCC(CC1)OC(=O)C 270004a_102516460346_200000086378 [0,0,1,1,0,0|2,0,0]=4 4107 B16R1.1226 CCSCCNC1CCC(CC1)OC(=O)C 270004a_100000106463_200000086378 [0,0,1,1,0,0|2,0,0]=4 4108 B16R1.1226 COCCCNC1CCC(CC1)OC(=O)C 270004a_100150723488_200000086378 [0,0,1,1,0,0|2,0,0]=4 4109 B16R1.1226 CSCCCNC1CCC(CC1)OC(=O)C 270004a_100000749238_200000086378 [0,0,1,1,0,0|2,0,0]=4 4110 B16R1.5019 CCCCCCCN1CC[C@@H](C1)NC(=O)C 2230a_100016989438_100000210681 [0,0,1,1,0,0|2,0,0]=4 4111 B16R1.5019 CCCCCCCN1CC[C@@H](C1)NC(=O)C 269982a_100016989438_100000210681 [0,0,1,1,0,0|2,0,0]=4 4112 B16R2.71 CC1CCCCC1NCC2CCCCO2 2230a_100000211402_100000211543 [1,0,0,1,0,0|1,0,1]=4 4113 B16R2.71 CC1CCCCC1NCC2CCCCO2 269862a_100000174945_100000210921 [1,0,0,1,0,0|1,0,1]=4 4114 B16R2.71 CC1CCCCC1NCC2CCCCO2 270004a_100000174945_100000210921 [1,0,0,1,0,0|1,0,1]=4 4115 B16R2.71 CC1CCCCC1NCC2CCCCO2 34a_100000211402_100000211543 [1,0,0,1,0,0|1,0,1]=4 4116 B16R2.71 CC1CCCCC1OCC2CCCCO2 34a_100000211207_100000211543 [1,0,0,1,0,0|1,0,1]=4 4117 B16R2.71 CC1CCCCC1OCC2CCCCO2 7a_100000211207_100000211543 [1,0,0,1,0,0|1,0,1]=4 4118 B16R2.98 CCCC1CCCCN1C2C=CCCC2 2230a_100000701414_100000751183 [1,0,0,1,0,0|2,0,0]=4 4119 B16R2.98 CCCC1CCCCN1C2C=CCCC2 269982a_100000701414_100000751183 [1,0,0,1,0,0|2,0,0]=4 4120 B16R2.169 CCC1CCCC1NCC2CCCCO2 269862a_100000174945_100000749056 [1,0,0,1,0,0|1,0,1]=4 4121 B16R2.169 CCC1CCCC1NCC2CCCCO2 270004a_100000174945_100000749056 [1,0,0,1,0,0|1,0,1]=4 4122 B16R2.172 CCC1CCCCC1OC2C=CCCC2 7a_100000210738_100000751183 [1,0,0,1,0,0|2,0,0]=4 4123 B16R2.172 CCC1CCCCN1CC2CCCCO2 2230a_100000210034_100000211543 [1,0,0,1,0,0|1,0,1]=4 4124 B16R2.172 CCC1CCCCN1CC2CCCCO2 269982a_100000210034_100000211543 [1,0,0,1,0,0|1,0,1]=4 4125 B16R2.172 CCC1CCCCN1CC2CCCCO2 34a_100000210034_100000211543 [1,0,0,1,0,0|1,0,1]=4 4126 B16R2.2211 C1=CC(CCC1)NC2CCCCCCC2 2230a_100000211152_100000751183 [1,0,0,1,0,0|2,0,0]=4 4127 B16R2.2211 C1=CC(CCC1)OC2CCCCCCC2 7a_100000210054_100000751183 [1,0,0,1,0,0|2,0,0]=4 4128 B16R2.2211 C1CCCN(CCC1)CC2CCCCO2 2230a_100000211400_100000211543 [1,0,0,1,0,0|1,0,1]=4 4129 B16R2.2211 C1CCCN(CCC1)CC2CCCCO2 269982a_100000211400_100000211543 [1,0,0,1,0,0|1,0,1]=4 4130 B16R2.2211 C1CCCN(CCC1)CC2CCCCO2 34a_100000211400_100000211543 [1,0,0,1,0,0|1,0,1]=4 4131 B16R2.2256 C1=CC(CCC1)NCCC2CCCCC2 2230a_100000738074_100000751183 [1,0,0,1,0,0|2,0,0]=4 4132 B16R2.2256 C1=CC(CCC1)OCCC2CCCCC2 34a_100011215024_100011209188 [1,0,0,1,0,0|2,0,0]=4 4133 B16R2.2256 C1=CC(CCC1)OCCC2CCCCC2 7a_100011217863_100000751183 [1,0,0,1,0,0|2,0,0]=4 4134 B16R2.2256 C1=CC(CCC1)SCCC2CCCCC2 62a_100000751183_100012355289 [1,0,0,1,0,0|2,0,0]=4 4135 B16R2.2256 C1=CC(CCC1)SCCC2CCCCC2 62a_100012355289_100000751183 [1,0,0,1,0,0|2,0,0]=4 4136 B16R2.2256 C1=COC(CC1)COCC2CCCCC2 34a_100011217868_100000211423 [1,0,0,1,0,0|1,0,1]=4 4137 B16R2.2256 C1CCC(CC1)CCOC2CCCCO2 34a_100000033831_100011209188 [1,0,0,1,0,0|1,0,1]=4 4138 B16R2.2256 C1CCC(CC1)CNCC2CCCCO2 2230a_100000174945_100000211423 [1,0,0,1,0,0|1,0,1]=4 4139 B16R2.2256 C1CCC(CC1)CNCC2CCCCO2 2230a_100000210473_100000211543 [1,0,0,1,0,0|1,0,1]=4 4140 B16R2.2256 C1CCC(CC1)CNCC2CCCCO2 269862a_100000174945_100000211278 [1,0,0,1,0,0|1,0,1]=4 4141 B16R2.2256 C1CCC(CC1)CNCC2CCCCO2 34a_100000174945_100000211423 [1,0,0,1,0,0|1,0,1]=4 4142 B16R2.2256 C1CCC(CC1)CNCC2CCCCO2 34a_100000210473_100000211543 [1,0,0,1,0,0|1,0,1]=4 4143 B16R2.2256 C1CCC(CC1)COCC2CCCCO2 34a_100000211370_100000211423 [1,0,0,1,0,0|1,0,1]=4 4144 B16R2.2256 C1CCC(CC1)COCC2CCCCO2 34a_100000212181_100000211543 [1,0,0,1,0,0|1,0,1]=4 4145 B16R2.2256 C1CCC(CC1)COCC2CCCCO2 7a_100000211370_100000211423 [1,0,0,1,0,0|1,0,1]=4 4146 B16R2.2256 C1CCC(CC1)COCC2CCCCO2 7a_100000212181_100000211543 [1,0,0,1,0,0|1,0,1]=4 4147 B16R2.2256 C1CCC(CC1)CSCC2CCCCO2 62a_100000211423_100000211543 [1,0,0,1,0,0|1,0,1]=4 4148 B16R2.2256 C1CCC(CC1)CSCC2CCCCO2 62a_100000211543_100000211423 [1,0,0,1,0,0|1,0,1]=4 4149 B16R2.2256 C1CCC(CC1)NCCC2CCCCO2 270004a_100015183643_100000210434 [1,0,0,1,0,0|1,0,1]=4 4150 B16R2.2256 C1CCC(CC1)NCCC2CCCCO2 34a_100015183643_100000210327 [1,0,0,1,0,0|1,0,1]=4 4151 B16R2.2257 C1=CC(CCC1)NCCCC2CCCC2 2230a_100000736752_100000751183 [1,0,0,1,0,0|2,0,0]=4 4152 B16R2.2257 C1=CC(CCC1)OCCCC2CCCC2 34a_100011215024_100011713738 [1,0,0,1,0,0|2,0,0]=4 4153 B16R2.2257 C1=CC(CCC1)OCCCC2CCCC2 7a_100011215328_100000751183 [1,0,0,1,0,0|2,0,0]=4 4154 B16R2.2257 C1=CC(CCC1)SCCCC2CCCC2 62a_100000751183_100011713738 [1,0,0,1,0,0|2,0,0]=4 4155 B16R2.2257 C1=CC(CCC1)SCCCC2CCCC2 62a_100011713738_100000751183 [1,0,0,1,0,0|2,0,0]=4 4156 B16R2.2257 C1=COC(CC1)COCCC2CCCC2 34a_100011217868_100000760354 [1,0,0,1,0,0|1,0,1]=4 4157 B16R2.2257 C1CCC(OC1)CCNCC2CCCC2 2230a_100015183643_100000740388 [1,0,0,1,0,0|1,0,1]=4 4158 B16R2.2257 C1CCC(OC1)CCNCC2CCCC2 269862a_100015183643_100000746403 [1,0,0,1,0,0|1,0,1]=4 4159 B16R2.2257 C1CCC(OC1)CCNCC2CCCC2 34a_100015183643_100000740388 [1,0,0,1,0,0|1,0,1]=4 4160 B16R2.2257 C1CCC(OC1)CNCCC2CCCC2 2230a_100000174945_100000760354 [1,0,0,1,0,0|1,0,1]=4 4161 B16R2.2257 C1CCC(OC1)CNCCC2CCCC2 2230a_100000739158_100000211543 [1,0,0,1,0,0|1,0,1]=4 4162 B16R2.2257 C1CCC(OC1)CNCCC2CCCC2 34a_100000174945_100000760354 [1,0,0,1,0,0|1,0,1]=4 4163 B16R2.2257 C1CCC(OC1)CNCCC2CCCC2 34a_100000739158_100000211543 [1,0,0,1,0,0|1,0,1]=4 4164 B16R2.2257 C1CCC(OC1)COCCC2CCCC2 34a_100000211370_100000760354 [1,0,0,1,0,0|1,0,1]=4 4165 B16R2.2257 C1CCC(OC1)COCCC2CCCC2 34a_100000749090_100000211543 [1,0,0,1,0,0|1,0,1]=4 4166 B16R2.2257 C1CCC(OC1)COCCC2CCCC2 7a_100000211370_100000760354 [1,0,0,1,0,0|1,0,1]=4 4167 B16R2.2257 C1CCC(OC1)COCCC2CCCC2 7a_100000749090_100000211543 [1,0,0,1,0,0|1,0,1]=4 4168 B16R2.2257 C1CCC(OC1)CSCCC2CCCC2 62a_100000211543_100000760354 [1,0,0,1,0,0|1,0,1]=4 4169 B16R2.2257 C1CCC(OC1)CSCCC2CCCC2 62a_100000760354_100000211543 [1,0,0,1,0,0|1,0,1]=4 4170 B16R2.2257 C1CCC(OC1)OCCCC2CCCC2 34a_100000033831_100011713738 [1,0,0,1,0,0|1,0,1]=4 4171 B16R2.3043 C1=CC(CCC1)N2CCCCCCCC2 2230a_100000039187_100000751183 [1,0,0,1,0,0|2,0,0]=4 4172 B16R2.3043 C1=CC(CCC1)N2CCCCCCCC2 269982a_100000039187_100000751183 [1,0,0,1,0,0|2,0,0]=4 4173 B16R2.3250 CC1CCCC1NCCC2CCCCO2 269862a_100015183643_100000752053 [1,0,0,1,0,0|1,0,1]=4 4174 B16R2.5334 C1=CC(CCC1)NCC2CCCCCC2 2230a_100015204231_100000751183 [1,0,0,1,0,0|2,0,0]=4 4175 B16R2.5334 C1=CC(CCC1)OCC2CCCCCC2 34a_100011215024_200000696569 [1,0,0,1,0,0|2,0,0]=4 4176 B16R2.5334 C1=CC(CCC1)OCC2CCCCCC2 7a_100000699130_100000751183 [1,0,0,1,0,0|2,0,0]=4 4177 B16R2.5334 C1=CC(CCC1)SCC2CCCCCC2 62a_100000751183_200000696569 [1,0,0,1,0,0|2,0,0]=4 4178 B16R2.5334 C1=CC(CCC1)SCC2CCCCCC2 62a_200000696569_100000751183 [1,0,0,1,0,0|2,0,0]=4 4179 B16R2.5334 C1=COC(CC1)COC2CCCCCC2 34a_100011217868_100011217769 [1,0,0,1,0,0|1,0,1]=4 4180 B16R2.5334 C1CCCC(CC1)COC2CCCCO2 34a_100000033831_200000696569 [1,0,0,1,0,0|1,0,1]=4 4181 B16R2.5334 C1CCCC(CC1)NCC2CCCCO2 2230a_100000210984_100000211543 [1,0,0,1,0,0|1,0,1]=4 4182 B16R2.5334 C1CCCC(CC1)NCC2CCCCO2 270004a_100000174945_100000210131 [1,0,0,1,0,0|1,0,1]=4 4183 B16R2.5334 C1CCCC(CC1)NCC2CCCCO2 34a_100000174945_100011217769 [1,0,0,1,0,0|1,0,1]=4 4184 B16R2.5334 C1CCCC(CC1)NCC2CCCCO2 34a_100000210984_100000211543 [1,0,0,1,0,0|1,0,1]=4 4185 B16R2.5334 C1CCCC(CC1)OCC2CCCCO2 34a_100000210887_100000211543 [1,0,0,1,0,0|1,0,1]=4 4186 B16R2.5334 C1CCCC(CC1)OCC2CCCCO2 34a_100000211370_100011217769 [1,0,0,1,0,0|1,0,1]=4 4187 B16R2.5334 C1CCCC(CC1)OCC2CCCCO2 7a_100000210887_100000211543 [1,0,0,1,0,0|1,0,1]=4 4188 B16R2.5334 C1CCCC(CC1)SCC2CCCCO2 62a_100000211543_100011217769 [1,0,0,1,0,0|1,0,1]=4 4189 B16R2.5334 C1CCCC(CC1)SCC2CCCCO2 62a_100011217769_100000211543 [1,0,0,1,0,0|1,0,1]=4 4190 B16R2.34598 CCCCCNCC1CC2C=CC1CC2 269862a_100000209983_100010619355 [1,0,0,1,0,0|2,0,0]=4 4191 B16R2.252 O=C1CCCC(C1)OCC2CCCCC2 34a_100012613340_100000211423 [1,0,0,1,0,0|2,0,0]=4 4192 B16R2.252 O=C1CCCC(N1)COC2CCCCC2 34a_200000102386_100000210327 [1,0,0,1,0,0|2,0,0]=4 4193 B16R2.255 O=C1CCCC(C1)OCCC2CCCC2 34a_100012613340_100000760354 [1,0,0,1,0,0|2,0,0]=4 4194 B16R2.255 O=C1CCCC(N1)COCC2CCCC2 34a_200000102386_100000740388 [1,0,0,1,0,0|2,0,0]=4 4195 B16R2.11928 O=C1CCCC(C1)OC2CCCCCC2 34a_100012613340_100011217769 [1,0,0,1,0,0|2,0,0]=4 4196 B16R2.55 CCCC1CCCCN1C2COC(=O)O2 34a_100000701414_100000032252 [0,0,0,1,1,0|2,0,0]=4 4197 B16R2.173 CCC1CCCCC1OC2COC(=O)O2 34a_100000210738_100000032252 [0,0,0,1,1,0|2,0,0]=4 4198 B16R2.173 CCC1CCCCN1CC2CNC(=O)O2 2230a_100000210034_100000181169 [0,0,0,1,1,0|2,0,0]=4 4199 B16R2.173 CCC1CCCCN1CC2CNC(=O)O2 269982a_100000210034_100000181169 [0,0,0,1,1,0|2,0,0]=4 4200 B16R2.173 CCC1CCCCN1CC2CNC(=O)O2 34a_100000210034_100000181169 [0,0,0,1,1,0|2,0,0]=4 4201 B16R2.173 CCC1CCCCN1CC2COC(=O)O2 269982a_100000210034_100000073702 [0,0,0,1,1,0|2,0,0]=4 4202 B16R2.173 CCC1CCCCN1CC2COC(=O)O2 34a_100000210034_100000073702 [0,0,0,1,1,0|2,0,0]=4 4203 B16R2.173 CCC1CCCCN1C[C@@H]2CCC(=O)N2 2230a_100000210034_100015189358 [0,0,0,1,1,0|2,0,0]=4 4204 B16R2.173 CCC1CCCCN1C[C@@H]2CCC(=O)N2 269982a_100000210034_100015189358 [0,0,0,1,1,0|2,0,0]=4 4205 B16R2.1513 CCC1CCCC1NC[C@H]2CCC(=O)N2 269862a_100015423886_100000749056 [0,0,0,1,1,0|2,0,0]=4 4206 B16R2.1513 CCC1CCCC1NC[C@H]2CCC(=O)N2 270004a_100015423886_100000749056 [0,0,0,1,1,0|2,0,0]=4 4207 B16R2.2832 O=C1CCC(C1)OCCC2CCCCC2 34a_100012614533_100011209188 [0,0,0,1,1,0|2,0,0]=4 4208 B16R2.2832 O=C1CCC(N1)COCC2CCCCC2 34a_100000737831_100000211423 [0,0,0,1,1,0|2,0,0]=4 4209 B16R2.2832 O=C1CC[C@@H](N1)CNCC2CCCCC2 2230a_100015423886_100000211423 [0,0,0,1,1,0|2,0,0]=4 4210 B16R2.2832 O=C1CC[C@@H](N1)CNCC2CCCCC2 269862a_100015423886_100000211278 [0,0,0,1,1,0|2,0,0]=4 4211 B16R2.2832 O=C1CC[C@@H](N1)CNCC2CCCCC2 34a_100015423886_100000211423 [0,0,0,1,1,0|2,0,0]=4 4212 B16R2.2832 O=C1CC[C@H](N1)CNCC2CCCCC2 2230a_100000210473_100015189358 [0,0,0,1,1,0|2,0,0]=4 4213 B16R2.2832 O=C1CC[C@H](N1)COCC2CCCCC2 7a_100000212181_100015189358 [0,0,0,1,1,0|2,0,0]=4 4214 B16R2.2832 O=C1CC[C@H](N1)CSCC2CCCCC2 62a_100000211423_100015189358 [0,0,0,1,1,0|2,0,0]=4 4215 B16R2.2832 O=C1CC[C@H](N1)CSCC2CCCCC2 62a_100015189358_100000211423 [0,0,0,1,1,0|2,0,0]=4 4216 B16R2.2832 O=C1NCC(O1)CNCC2CCCCC2 2230a_100000210473_100000181169 [0,0,0,1,1,0|2,0,0]=4 4217 B16R2.2832 O=C1NCC(O1)CNCC2CCCCC2 34a_100000210473_100000181169 [0,0,0,1,1,0|2,0,0]=4 4218 B16R2.2832 O=C1NCC(O1)COCC2CCCCC2 34a_100000212181_100000181169 [0,0,0,1,1,0|2,0,0]=4 4219 B16R2.2832 O=C1NCC(O1)COCC2CCCCC2 34a_100011315639_100000211423 [0,0,0,1,1,0|2,0,0]=4 4220 B16R2.2832 O=C1NCC(O1)COCC2CCCCC2 7a_100000212181_100000181169 [0,0,0,1,1,0|2,0,0]=4 4221 B16R2.2832 O=C1NCC(O1)CSCC2CCCCC2 62a_100000181169_100000211423 [0,0,0,1,1,0|2,0,0]=4 4222 B16R2.2832 O=C1NCC(O1)CSCC2CCCCC2 62a_100000211423_100000181169 [0,0,0,1,1,0|2,0,0]=4 4223 B16R2.2832 O=C1OCC(O1)CNCC2CCCCC2 34a_100000210473_100000073702 [0,0,0,1,1,0|2,0,0]=4 4224 B16R2.2832 O=C1OCC(O1)COCC2CCCCC2 34a_100000212181_100000073702 [0,0,0,1,1,0|2,0,0]=4 4225 B16R2.2832 O=C1OCC(O1)CSCC2CCCCC2 62a_100000073702_100000211423 [0,0,0,1,1,0|2,0,0]=4 4226 B16R2.2832 O=C1OCC(O1)CSCC2CCCCC2 62a_100000211423_100000073702 [0,0,0,1,1,0|2,0,0]=4 4227 B16R2.2832 O=C1OCC(O1)NCCC2CCCCC2 34a_100000738074_100000032252 [0,0,0,1,1,0|2,0,0]=4 4228 B16R2.2832 O=C1OCC(O1)OCCC2CCCCC2 34a_100011217863_100000032252 [0,0,0,1,1,0|2,0,0]=4 4229 B16R2.2832 O=C1OCC(O1)SCCC2CCCCC2 62a_100012355289_100000032252 [0,0,0,1,1,0|2,0,0]=4 4230 B16R2.2842 O=C1CCC(C1)OCCCC2CCCC2 34a_100012614533_100011713738 [0,0,0,1,1,0|2,0,0]=4 4231 B16R2.2842 O=C1CCC(N1)COCCC2CCCC2 34a_100000737831_100000760354 [0,0,0,1,1,0|2,0,0]=4 4232 B16R2.2842 O=C1CC[C@@H](N1)CNCCC2CCCC2 2230a_100015423886_100000760354 [0,0,0,1,1,0|2,0,0]=4 4233 B16R2.2842 O=C1CC[C@@H](N1)CNCCC2CCCC2 34a_100015423886_100000760354 [0,0,0,1,1,0|2,0,0]=4 4234 B16R2.2842 O=C1CC[C@H](N1)CNCCC2CCCC2 2230a_100000739158_100015189358 [0,0,0,1,1,0|2,0,0]=4 4235 B16R2.2842 O=C1CC[C@H](N1)COCCC2CCCC2 7a_100000749090_100015189358 [0,0,0,1,1,0|2,0,0]=4 4236 B16R2.2842 O=C1CC[C@H](N1)CSCCC2CCCC2 62a_100000760354_100015189358 [0,0,0,1,1,0|2,0,0]=4 4237 B16R2.2842 O=C1CC[C@H](N1)CSCCC2CCCC2 62a_100015189358_100000760354 [0,0,0,1,1,0|2,0,0]=4 4238 B16R2.2842 O=C1NCC(O1)CNCCC2CCCC2 2230a_100000739158_100000181169 [0,0,0,1,1,0|2,0,0]=4 4239 B16R2.2842 O=C1NCC(O1)CNCCC2CCCC2 34a_100000739158_100000181169 [0,0,0,1,1,0|2,0,0]=4 4240 B16R2.2842 O=C1NCC(O1)COCCC2CCCC2 34a_100000749090_100000181169 [0,0,0,1,1,0|2,0,0]=4 4241 B16R2.2842 O=C1NCC(O1)COCCC2CCCC2 34a_100011315639_100000760354 [0,0,0,1,1,0|2,0,0]=4 4242 B16R2.2842 O=C1NCC(O1)COCCC2CCCC2 7a_100000749090_100000181169 [0,0,0,1,1,0|2,0,0]=4 4243 B16R2.2842 O=C1NCC(O1)CSCCC2CCCC2 62a_100000181169_100000760354 [0,0,0,1,1,0|2,0,0]=4 4244 B16R2.2842 O=C1NCC(O1)CSCCC2CCCC2 62a_100000760354_100000181169 [0,0,0,1,1,0|2,0,0]=4 4245 B16R2.2842 O=C1OCC(O1)CNCCC2CCCC2 34a_100000739158_100000073702 [0,0,0,1,1,0|2,0,0]=4 4246 B16R2.2842 O=C1OCC(O1)COCCC2CCCC2 34a_100000749090_100000073702 [0,0,0,1,1,0|2,0,0]=4 4247 B16R2.2842 O=C1OCC(O1)CSCCC2CCCC2 62a_100000073702_100000760354 [0,0,0,1,1,0|2,0,0]=4 4248 B16R2.2842 O=C1OCC(O1)CSCCC2CCCC2 62a_100000760354_100000073702 [0,0,0,1,1,0|2,0,0]=4 4249 B16R2.2842 O=C1OCC(O1)NCCCC2CCCC2 34a_100000736752_100000032252 [0,0,0,1,1,0|2,0,0]=4 4250 B16R2.2842 O=C1OCC(O1)OCCCC2CCCC2 34a_100011215328_100000032252 [0,0,0,1,1,0|2,0,0]=4 4251 B16R2.2842 O=C1OCC(O1)SCCCC2CCCC2 62a_100011713738_100000032252 [0,0,0,1,1,0|2,0,0]=4 4252 B16R2.11407 O=C1CCC(C1)OCC2CCCCCC2 34a_100012614533_200000696569 [0,0,0,1,1,0|2,0,0]=4 4253 B16R2.11407 O=C1CCC(N1)COC2CCCCCC2 34a_100000737831_100011217769 [0,0,0,1,1,0|2,0,0]=4 4254 B16R2.11407 O=C1CC[C@@H](N1)CNC2CCCCCC2 270004a_100015423886_100000210131 [0,0,0,1,1,0|2,0,0]=4 4255 B16R2.11407 O=C1CC[C@@H](N1)CNC2CCCCCC2 34a_100015423886_100011217769 [0,0,0,1,1,0|2,0,0]=4 4256 B16R2.11407 O=C1CC[C@H](N1)CNC2CCCCCC2 2230a_100000210984_100015189358 [0,0,0,1,1,0|2,0,0]=4 4257 B16R2.11407 O=C1CC[C@H](N1)COC2CCCCCC2 7a_100000210887_100015189358 [0,0,0,1,1,0|2,0,0]=4 4258 B16R2.11407 O=C1CC[C@H](N1)CSC2CCCCCC2 62a_100011217769_100015189358 [0,0,0,1,1,0|2,0,0]=4 4259 B16R2.11407 O=C1CC[C@H](N1)CSC2CCCCCC2 62a_100015189358_100011217769 [0,0,0,1,1,0|2,0,0]=4 4260 B16R2.11407 O=C1NCC(O1)CNC2CCCCCC2 2230a_100000210984_100000181169 [0,0,0,1,1,0|2,0,0]=4 4261 B16R2.11407 O=C1NCC(O1)CNC2CCCCCC2 34a_100000210984_100000181169 [0,0,0,1,1,0|2,0,0]=4 4262 B16R2.11407 O=C1NCC(O1)COC2CCCCCC2 34a_100000210887_100000181169 [0,0,0,1,1,0|2,0,0]=4 4263 B16R2.11407 O=C1NCC(O1)COC2CCCCCC2 34a_100011315639_100011217769 [0,0,0,1,1,0|2,0,0]=4 4264 B16R2.11407 O=C1NCC(O1)COC2CCCCCC2 7a_100000210887_100000181169 [0,0,0,1,1,0|2,0,0]=4 4265 B16R2.11407 O=C1NCC(O1)CSC2CCCCCC2 62a_100000181169_100011217769 [0,0,0,1,1,0|2,0,0]=4 4266 B16R2.11407 O=C1NCC(O1)CSC2CCCCCC2 62a_100011217769_100000181169 [0,0,0,1,1,0|2,0,0]=4 4267 B16R2.11407 O=C1OCC(O1)CNC2CCCCCC2 34a_100000210984_100000073702 [0,0,0,1,1,0|2,0,0]=4 4268 B16R2.11407 O=C1OCC(O1)COC2CCCCCC2 34a_100000210887_100000073702 [0,0,0,1,1,0|2,0,0]=4 4269 B16R2.11407 O=C1OCC(O1)CSC2CCCCCC2 62a_100000073702_100011217769 [0,0,0,1,1,0|2,0,0]=4 4270 B16R2.11407 O=C1OCC(O1)CSC2CCCCCC2 62a_100011217769_100000073702 [0,0,0,1,1,0|2,0,0]=4 4271 B16R2.11407 O=C1OCC(O1)NCC2CCCCCC2 34a_100015204231_100000032252 [0,0,0,1,1,0|2,0,0]=4 4272 B16R2.11407 O=C1OCC(O1)OCC2CCCCCC2 34a_100000699130_100000032252 [0,0,0,1,1,0|2,0,0]=4 4273 B16R2.11407 O=C1OCC(O1)SCC2CCCCCC2 62a_200000696569_100000032252 [0,0,0,1,1,0|2,0,0]=4 4274 B16R2.11414 CC1CCCCC1NCC2CNC(=O)O2 2230a_100000211402_100000181169 [0,0,0,1,1,0|2,0,0]=4 4275 B16R2.11414 CC1CCCCC1NCC2CNC(=O)O2 34a_100000211402_100000181169 [0,0,0,1,1,0|2,0,0]=4 4276 B16R2.11414 CC1CCCCC1NCC2COC(=O)O2 34a_100000211402_100000073702 [0,0,0,1,1,0|2,0,0]=4 4277 B16R2.11414 CC1CCCCC1NC[C@@H]2CCC(=O)N2 2230a_100000211402_100015189358 [0,0,0,1,1,0|2,0,0]=4 4278 B16R2.11414 CC1CCCCC1NC[C@H]2CCC(=O)N2 269862a_100015423886_100000210921 [0,0,0,1,1,0|2,0,0]=4 4279 B16R2.11414 CC1CCCCC1NC[C@H]2CCC(=O)N2 270004a_100015423886_100000210921 [0,0,0,1,1,0|2,0,0]=4 4280 B16R2.11414 CC1CCCCC1OCC2CNC(=O)O2 34a_100000211207_100000181169 [0,0,0,1,1,0|2,0,0]=4 4281 B16R2.11414 CC1CCCCC1OCC2CNC(=O)O2 7a_100000211207_100000181169 [0,0,0,1,1,0|2,0,0]=4 4282 B16R2.11414 CC1CCCCC1OCC2COC(=O)O2 34a_100000211207_100000073702 [0,0,0,1,1,0|2,0,0]=4 4283 B16R2.11414 CC1CCCCC1OC[C@@H]2CCC(=O)N2 7a_100000211207_100015189358 [0,0,0,1,1,0|2,0,0]=4 4284 B16R2.11458 O=C1OCC(O1)N2CCCCCCCC2 34a_100000039187_100000032252 [0,0,0,1,1,0|2,0,0]=4 4285 B16R2.11527 O=C1CC[C@H](N1)CN2CCCCCCC2 2230a_100000211400_100015189358 [0,0,0,1,1,0|2,0,0]=4 4286 B16R2.11527 O=C1CC[C@H](N1)CN2CCCCCCC2 269982a_100000211400_100015189358 [0,0,0,1,1,0|2,0,0]=4 4287 B16R2.11527 O=C1NCC(O1)CN2CCCCCCC2 2230a_100000211400_100000181169 [0,0,0,1,1,0|2,0,0]=4 4288 B16R2.11527 O=C1NCC(O1)CN2CCCCCCC2 269982a_100000211400_100000181169 [0,0,0,1,1,0|2,0,0]=4 4289 B16R2.11527 O=C1NCC(O1)CN2CCCCCCC2 34a_100000211400_100000181169 [0,0,0,1,1,0|2,0,0]=4 4290 B16R2.11527 O=C1OCC(O1)CN2CCCCCCC2 269982a_100000211400_100000073702 [0,0,0,1,1,0|2,0,0]=4 4291 B16R2.11527 O=C1OCC(O1)CN2CCCCCCC2 34a_100000211400_100000073702 [0,0,0,1,1,0|2,0,0]=4 4292 B16R2.11527 O=C1OCC(O1)NC2CCCCCCC2 34a_100000211152_100000032252 [0,0,0,1,1,0|2,0,0]=4 4293 B16R2.11527 O=C1OCC(O1)OC2CCCCCCC2 34a_100000210054_100000032252 [0,0,0,1,1,0|2,0,0]=4 4294 B16R2.611 CCCC1CCCCN1C2CCCC2=O 2230a_100000701414_100000211823 [0,0,0,1,1,0|1,0,0]=3 4295 B16R2.611 CCCC1CCCCN1C2CCCC2=O 269982a_100000701414_100000211823 [0,0,0,1,1,0|1,0,0]=3 4296 B16R2.611 CCCC1CCCCN1C2CCCC2=O 34a_100000701414_100000709159 [0,0,0,1,1,0|1,0,0]=3 4297 B16R2.611 CCCC1CCCCN1C2CCOC2=O 2230a_100000701414_100000211211 [0,0,0,1,1,0|2,0,0]=4 4298 B16R2.611 CCCC1CCCCN1C2CCOC2=O 269982a_100000701414_100000211211 [0,0,0,1,1,0|2,0,0]=4 4299 B16R2.611 CCCC1CCCCN1C2CCOC2=O 34a_100000701414_100000211211 [0,0,0,1,1,0|2,0,0]=4 4300 B16R2.611 CCCC1COCCN1C2CCCC2=O 2230a_102495339903_100000211823 [0,0,0,1,1,0|2,0,0]=4 4301 B16R2.611 CCCC1COCCN1C2CCCC2=O 269982a_102495339903_100000211823 [0,0,0,1,1,0|2,0,0]=4 4302 B16R2.611 CCCC1COCCN1C2CCCC2=O 34a_102495339903_100000709159 [0,0,0,1,1,0|2,0,0]=4 4303 B16R2.611 COCC1CCCCN1C2CCCC2=O 2230a_100015184032_100000211823 [0,0,0,1,1,0|2,0,0]=4 4304 B16R2.611 COCC1CCCCN1C2CCCC2=O 269982a_100015184032_100000211823 [0,0,0,1,1,0|2,0,0]=4 4305 B16R2.611 COCC1CCCCN1C2CCCC2=O 34a_100015184032_100000709159 [0,0,0,1,1,0|2,0,0]=4 4306 B16R2.611 O=C1CCCC1N2CCCCC2CCO 2230a_100000211664_100000211823 [0,0,0,1,1,0|2,0,0]=4 4307 B16R2.611 O=C1CCCC1N2CCCCC2CCO 269982a_100000211664_100000211823 [0,0,0,1,1,0|2,0,0]=4 4308 B16R2.611 O=C1CCCC1N2CCCCC2CCO 34a_100000211664_100000709159 [0,0,0,1,1,0|2,0,0]=4 4309 B16R2.639 CCCC1CCCC1NC2CCNC2=O 270004a_100016995588_100000723119 [0,0,0,1,1,0|2,0,0]=4 4310 B16R2.2451 CCC1CCCCC1NC2CCNC2=O 270004a_100016995588_100000757040 [0,0,0,1,1,0|2,0,0]=4 4311 B16R2.2451 CCC1CCCCC1OC2CCCC2=O 34a_100000210738_100000709159 [0,0,0,1,1,0|1,0,0]=3 4312 B16R2.2451 CCC1CCCCC1OC2CCCC2=O 7a_100000210738_100000211823 [0,0,0,1,1,0|1,0,0]=3 4313 B16R2.2451 CCC1CCCCC1OC2CCOC2=O 34a_100000210738_100000211211 [0,0,0,1,1,0|2,0,0]=4 4314 B16R2.2451 CCC1CCCCC1OC2CCOC2=O 7a_100000210738_100000211211 [0,0,0,1,1,0|2,0,0]=4 4315 B16R2.2451 CCC1CCCCN1CN2CCCC2=O 269982a_100000210034_100000026320 [0,0,0,1,1,0|2,0,0]=4 4316 B16R2.2451 CN[C@@H]1CCCC[C@H]1OC2CCCC2=O 34a_100000708425_100000709159 [0,0,0,1,1,0|2,0,0]=4 4317 B16R2.2451 COC1CCCCC1NC2CCCC2=O 34a_100011208099_100000709159 [0,0,0,1,1,0|2,0,0]=4 4318 B16R2.2451 CO[C@H]1CCCC[C@@H]1OC2CCCC2=O 34a_200009815850_100000709159 [0,0,0,1,1,0|2,0,0]=4 4319 B16R2.2451 CO[C@H]1CCCC[C@@H]1OC2CCCC2=O 7a_200009815850_100000211823 [0,0,0,1,1,0|2,0,0]=4 4320 B16R2.2451 NCC1CCCCC1OC2CCCC2=O 34a_100011216029_100000709159 [0,0,0,1,1,0|2,0,0]=4 4321 B16R2.2544 CCC1CCCN1CCN2CCCC2=O 2230a_100000754278_100000739059 [0,0,0,1,1,0|2,0,0]=4 4322 B16R2.2544 CCC1CCCN1CCN2CCCC2=O 269982a_100000754278_100000739059 [0,0,0,1,1,0|2,0,0]=4 4323 B16R2.2544 CCC1CCCN1CCN2CCCC2=O 34a_100000754278_100000739059 [0,0,0,1,1,0|2,0,0]=4 4324 B16R2.2544 CCN1CCCC1CNC2CCCC2=O 2230a_100000211693_100000211823 [0,0,0,1,1,0|2,0,0]=4 4325 B16R2.2544 CCN1CCC[C@@H]1COC2CCCC2=O 34a_100011739246_100000709159 [0,0,0,1,1,0|2,0,0]=4 4326 B16R2.2544 CCN1CCC[C@@H]1COC2CCCC2=O 7a_100011739246_100000211823 [0,0,0,1,1,0|2,0,0]=4 4327 B16R2.2966 CC1CCCCN1CCN2CCCC2=O 2230a_100000211376_100000739059 [0,0,0,1,1,0|2,0,0]=4 4328 B16R2.2966 CC1CCCCN1CCN2CCCC2=O 269982a_100000211376_100000739059 [0,0,0,1,1,0|2,0,0]=4 4329 B16R2.2966 CC1CCCCN1CCN2CCCC2=O 34a_100000211376_100000739059 [0,0,0,1,1,0|2,0,0]=4 4330 B16R2.2966 CN1CCCCC1CCN2CCCC2=O 2230a_200011221494_200000210301 [0,0,0,1,1,0|2,0,0]=4 4331 B16R2.2966 CN1CCCCC1CCN2CCCC2=O 269982a_200011221494_200000210301 [0,0,0,1,1,0|2,0,0]=4 4332 B16R2.2966 CN1CCCCC1CCN2CCCC2=O 34a_200011221494_200000210301 [0,0,0,1,1,0|2,0,0]=4 4333 B16R2.2966 CN1CCCCC1CNC2CCCC2=O 34a_100011228421_100000709159 [0,0,0,1,1,0|2,0,0]=4 4334 B16R2.2966 CN1CCCCC1COC2CCCC2=O 34a_100000225079_100000709159 [0,0,0,1,1,0|2,0,0]=4 4335 B16R2.2966 CN1CCCCC1COC2CCCC2=O 34a_200000719330_100015186950 [0,0,0,1,1,0|2,0,0]=4 4336 B16R2.2966 CN1CCCCC1CSC2CCCC2=O 62a_100000211823_100015185383 [0,0,0,1,1,0|2,0,0]=4 4337 B16R2.2966 CN1CCCCC1CSC2CCCC2=O 62a_100015185383_100000211823 [0,0,0,1,1,0|2,0,0]=4 4338 B16R2.2966 O=C1CCCC1NCC2CCCCC2O 34a_100011216029_100000709159 [0,0,0,1,1,0|2,0,0]=4 4339 B16R2.2966 [13CH3]N1CCCCC1CCN2CCCC2=O 2230a_200011221494_200025704644 [0,0,0,1,1,0|2,0,0]=4 4340 B16R2.2966 [13CH3]N1CCCCC1CCN2CCCC2=O 269982a_200011221494_200025704644 [0,0,0,1,1,0|2,0,0]=4 4341 B16R2.2966 [13CH3]N1CCCCC1CCN2CCCC2=O 34a_200011221494_200025704644 [0,0,0,1,1,0|2,0,0]=4 4342 B16R2.3018 O=C1CCCC1NCCCC2CCCC2 2230a_100000736752_100000211823 [0,0,0,1,1,0|1,0,0]=3 4343 B16R2.3018 O=C1CCCC1NCCCC2CCCC2 34a_100000736752_100000709159 [0,0,0,1,1,0|1,0,0]=3 4344 B16R2.3018 O=C1CCCC1NCCOC2CCCC2 34a_100000741755_100000709159 [0,0,0,1,1,0|2,0,0]=4 4345 B16R2.3018 O=C1CCCC1OCCCC2CCCC2 34a_100011215328_100000709159 [0,0,0,1,1,0|1,0,0]=3 4346 B16R2.3018 O=C1CCCC1OCCCC2CCCC2 34a_200000719330_100011713738 [0,0,0,1,1,0|1,0,0]=3 4347 B16R2.3018 O=C1CCCC1OCCCC2CCCC2 7a_100011215328_100000211823 [0,0,0,1,1,0|1,0,0]=3 4348 B16R2.3018 O=C1CCCC1OCCCN2CCCC2 34a_200000719330_100016991639 [0,0,0,1,1,0|2,0,0]=4 4349 B16R2.3018 O=C1CCCC1OCCNC2CCCC2 34a_200000200444_100000709159 [0,0,0,1,1,0|2,0,0]=4 4350 B16R2.3018 O=C1CCCC1OCCOC2CCCC2 34a_100000738311_100000709159 [0,0,0,1,1,0|2,0,0]=4 4351 B16R2.3018 O=C1CCCC1OCCOC2CCCC2 7a_100000738311_100000211823 [0,0,0,1,1,0|2,0,0]=4 4352 B16R2.3018 O=C1CCCC1SCCCC2CCCC2 62a_100000211823_100011713738 [0,0,0,1,1,0|1,0,0]=3 4353 B16R2.3018 O=C1CCCC1SCCCC2CCCC2 62a_100011713738_100000211823 [0,0,0,1,1,0|1,0,0]=3 4354 B16R2.3018 O=C1CCCC1SCCCN2CCCC2 62a_100000211823_100011445909 [0,0,0,1,1,0|2,0,0]=4 4355 B16R2.3018 O=C1CCCC1SCCCN2CCCC2 62a_100016991639_100000211823 [0,0,0,1,1,0|2,0,0]=4 4356 B16R2.3018 O=C1CCCN1CCCNC2CCCC2 2230a_100000210347_100000179811 [0,0,0,1,1,0|2,0,0]=4 4357 B16R2.3018 O=C1CCCN1CCCNC2CCCC2 270004a_100000210347_100000210133 [0,0,0,1,1,0|2,0,0]=4 4358 B16R2.3018 O=C1CCCN1CCCNC2CCCC2 34a_100000210347_100000179811 [0,0,0,1,1,0|2,0,0]=4 4359 B16R2.3018 O=C1CCCN1CCCOC2CCCC2 34a_100011216539_100000179811 [0,0,0,1,1,0|2,0,0]=4 4360 B16R2.3018 O=C1CCCN1CCCOC2CCCC2 7a_100011216539_100000179811 [0,0,0,1,1,0|2,0,0]=4 4361 B16R2.3018 O=C1CCCN1CCNCC2CCCC2 2230a_100000737975_100000739059 [0,0,0,1,1,0|2,0,0]=4 4362 B16R2.3018 O=C1CCCN1CCNCC2CCCC2 2230a_100011200922_100000740388 [0,0,0,1,1,0|2,0,0]=4 4363 B16R2.3018 O=C1CCCN1CCNCC2CCCC2 269862a_100011200922_100000746403 [0,0,0,1,1,0|2,0,0]=4 4364 B16R2.3018 O=C1CCCN1CCNCC2CCCC2 34a_100000737975_100000739059 [0,0,0,1,1,0|2,0,0]=4 4365 B16R2.3018 O=C1CCCN1CCOCC2CCCC2 34a_100000211209_100000740388 [0,0,0,1,1,0|2,0,0]=4 4366 B16R2.3018 O=C1CCCN1CCOCC2CCCC2 34a_100000742336_100000739059 [0,0,0,1,1,0|2,0,0]=4 4367 B16R2.3018 O=C1CCCN1CCOCC2CCCC2 7a_100000211209_100000740388 [0,0,0,1,1,0|2,0,0]=4 4368 B16R2.3018 O=C1CCCN1CCOCC2CCCC2 7a_100000742336_100000739059 [0,0,0,1,1,0|2,0,0]=4 4369 B16R2.3018 O=C1CCCN1CCSCC2CCCC2 62a_100000739059_100000740388 [0,0,0,1,1,0|2,0,0]=4 4370 B16R2.3018 O=C1CCCN1CCSCC2CCCC2 62a_100000740388_100000739059 [0,0,0,1,1,0|2,0,0]=4 4371 B16R2.3018 O=C1CCCN1CSCCC2CCCC2 62a_100000026320_100000760354 [0,0,0,1,1,0|2,0,0]=4 4372 B16R2.3018 O=C1CCCN1CSCCC2CCCC2 62a_100000760354_100000026320 [0,0,0,1,1,0|2,0,0]=4 4373 B16R2.3018 O=C1NCCC1COCCC2CCCC2 34a_100000133458_100000760354 [0,0,0,1,1,0|2,0,0]=4 4374 B16R2.3018 O=C1NCCC1NCCCC2CCCC2 2230a_100016995588_100011713738 [0,0,0,1,1,0|2,0,0]=4 4375 B16R2.3018 O=C1NCCC1NCCCC2CCCC2 34a_100016995588_100011713738 [0,0,0,1,1,0|2,0,0]=4 4376 B16R2.3018 O=C1NCC[C@@H]1OCCCC2CCCC2 34a_100000688343_100011713738 [0,0,0,1,1,0|2,0,0]=4 4377 B16R2.3018 O=C1OCCC1NCCCC2CCCC2 2230a_100000736752_100000211211 [0,0,0,1,1,0|2,0,0]=4 4378 B16R2.3018 O=C1OCCC1NCCCC2CCCC2 34a_100000736752_100000211211 [0,0,0,1,1,0|2,0,0]=4 4379 B16R2.3018 O=C1OCCC1OCCCC2CCCC2 34a_100011215328_100000211211 [0,0,0,1,1,0|2,0,0]=4 4380 B16R2.3018 O=C1OCCC1OCCCC2CCCC2 7a_100011215328_100000211211 [0,0,0,1,1,0|2,0,0]=4 4381 B16R2.3018 O=C1OCCC1SCCCC2CCCC2 62a_100000211211_100011713738 [0,0,0,1,1,0|2,0,0]=4 4382 B16R2.3018 O=C1OCCC1SCCCC2CCCC2 62a_100011713738_100000211211 [0,0,0,1,1,0|2,0,0]=4 4383 B16R2.3222 CC1CCCC1NCCN2CCCC2=O 269862a_100011200922_100000752053 [0,0,0,1,1,0|2,0,0]=4 4384 B16R2.3222 CC1CCCC1OCCN2CCCC2=O 34a_100011216460_100000739059 [0,0,0,1,1,0|2,0,0]=4 4385 B16R2.3222 CC1CCCC1OCCN2CCCC2=O 7a_100011216460_100000739059 [0,0,0,1,1,0|2,0,0]=4 4386 B16R2.3222 CN1CCCC1CCOC2CCCC2=O 34a_100011215177_100000709159 [0,0,0,1,1,0|2,0,0]=4 4387 B16R2.3222 CN1CCCC1CCOC2CCCC2=O 34a_200000719330_100000005710 [0,0,0,1,1,0|2,0,0]=4 4388 B16R2.3222 CN1CCCC1CCOC2CCCC2=O 7a_100011215177_100000211823 [0,0,0,1,1,0|2,0,0]=4 4389 B16R2.3222 CN1CCCC1CCSC2CCCC2=O 62a_100000005710_100000211823 [0,0,0,1,1,0|2,0,0]=4 4390 B16R2.3222 CN1CCCC1CCSC2CCCC2=O 62a_100000211823_100000005710 [0,0,0,1,1,0|2,0,0]=4 4391 B16R2.12704 O=C1CCCN1CCCNCCC2CC2 2230a_100000210347_100000694398 [0,0,0,1,1,0|2,0,0]=4 4392 B16R2.12704 O=C1CCCN1CCCNCCC2CC2 34a_100000210347_100000694398 [0,0,0,1,1,0|2,0,0]=4 4393 B16R2.12704 O=C1CCCN1CCCOCCC2CC2 34a_100011216539_100000694398 [0,0,0,1,1,0|2,0,0]=4 4394 B16R2.12704 O=C1CCCN1CCCOCCC2CC2 7a_100011216539_100000764125 [0,0,0,1,1,0|2,0,0]=4 4395 B16R2.12829 O=C1CCCC1NCC2CCCCCC2 2230a_100015204231_100000211823 [0,0,0,1,1,0|1,0,0]=3 4396 B16R2.12829 O=C1CCCC1NCC2CCCCCC2 34a_100015204231_100000709159 [0,0,0,1,1,0|1,0,0]=3 4397 B16R2.12829 O=C1CCCC1OCC2CCCCCC2 34a_100000699130_100000709159 [0,0,0,1,1,0|1,0,0]=3 4398 B16R2.12829 O=C1CCCC1OCC2CCCCCC2 34a_200000719330_200000696569 [0,0,0,1,1,0|1,0,0]=3 4399 B16R2.12829 O=C1CCCC1OCC2CCCCCC2 7a_100000699130_100000211823 [0,0,0,1,1,0|1,0,0]=3 4400 B16R2.12829 O=C1CCCC1SCC2CCCCCC2 62a_100000211823_200000696569 [0,0,0,1,1,0|1,0,0]=3 4401 B16R2.12829 O=C1CCCC1SCC2CCCCCC2 62a_200000696569_100000211823 [0,0,0,1,1,0|1,0,0]=3 4402 B16R2.12829 O=C1CCCN1CCN2CCCCCC2 2230a_100000185865_100000739059 [0,0,0,1,1,0|2,0,0]=4 4403 B16R2.12829 O=C1CCCN1CCN2CCCCCC2 269982a_100000185865_100000739059 [0,0,0,1,1,0|2,0,0]=4 4404 B16R2.12829 O=C1CCCN1CCN2CCCCCC2 34a_100000185865_100000739059 [0,0,0,1,1,0|2,0,0]=4 4405 B16R2.12829 O=C1CCCN1CSC2CCCCCC2 62a_100000026320_100011217769 [0,0,0,1,1,0|2,0,0]=4 4406 B16R2.12829 O=C1CCCN1CSC2CCCCCC2 62a_100011217769_100000026320 [0,0,0,1,1,0|2,0,0]=4 4407 B16R2.12829 O=C1NCCC1COC2CCCCCC2 34a_100000133458_100011217769 [0,0,0,1,1,0|2,0,0]=4 4408 B16R2.12829 O=C1NCCC1NCC2CCCCCC2 2230a_100016995588_200000696569 [0,0,0,1,1,0|2,0,0]=4 4409 B16R2.12829 O=C1NCCC1NCC2CCCCCC2 34a_100016995588_200000696569 [0,0,0,1,1,0|2,0,0]=4 4410 B16R2.12829 O=C1NCC[C@@H]1OCC2CCCCCC2 34a_100000688343_200000696569 [0,0,0,1,1,0|2,0,0]=4 4411 B16R2.12829 O=C1OCCC1NCC2CCCCCC2 2230a_100015204231_100000211211 [0,0,0,1,1,0|2,0,0]=4 4412 B16R2.12829 O=C1OCCC1NCC2CCCCCC2 34a_100015204231_100000211211 [0,0,0,1,1,0|2,0,0]=4 4413 B16R2.12829 O=C1OCCC1OCC2CCCCCC2 34a_100000699130_100000211211 [0,0,0,1,1,0|2,0,0]=4 4414 B16R2.12829 O=C1OCCC1OCC2CCCCCC2 7a_100000699130_100000211211 [0,0,0,1,1,0|2,0,0]=4 4415 B16R2.12829 O=C1OCCC1SCC2CCCCCC2 62a_100000211211_200000696569 [0,0,0,1,1,0|2,0,0]=4 4416 B16R2.12829 O=C1OCCC1SCC2CCCCCC2 62a_200000696569_100000211211 [0,0,0,1,1,0|2,0,0]=4 4417 B16R2.12850 O=C1CCCC1N2CCCCCCCC2 2230a_100000039187_100000211823 [0,0,0,1,1,0|1,0,0]=3 4418 B16R2.12850 O=C1CCCC1N2CCCCCCCC2 269982a_100000039187_100000211823 [0,0,0,1,1,0|1,0,0]=3 4419 B16R2.12850 O=C1CCCC1N2CCCCCCCC2 34a_100000039187_100000709159 [0,0,0,1,1,0|1,0,0]=3 4420 B16R2.12850 O=C1OCCC1N2CCCCCCCC2 2230a_100000039187_100000211211 [0,0,0,1,1,0|2,0,0]=4 4421 B16R2.12850 O=C1OCCC1N2CCCCCCCC2 269982a_100000039187_100000211211 [0,0,0,1,1,0|2,0,0]=4 4422 B16R2.12850 O=C1OCCC1N2CCCCCCCC2 34a_100000039187_100000211211 [0,0,0,1,1,0|2,0,0]=4 4423 B16R2.23378 O=C1CCCC1NC2CCCCCCC2 2230a_100000211152_100000211823 [0,0,0,1,1,0|1,0,0]=3 4424 B16R2.23378 O=C1CCCC1NC2CCCCCCC2 34a_100000211152_100000709159 [0,0,0,1,1,0|1,0,0]=3 4425 B16R2.23378 O=C1CCCC1OC2CCCCCCC2 34a_100000210054_100000709159 [0,0,0,1,1,0|1,0,0]=3 4426 B16R2.23378 O=C1CCCC1OC2CCCCCCC2 7a_100000210054_100000211823 [0,0,0,1,1,0|1,0,0]=3 4427 B16R2.23378 O=C1CCCN1CN2CCCCCCC2 269982a_100000211400_100000026320 [0,0,0,1,1,0|2,0,0]=4 4428 B16R2.23378 O=C1NCCC1NC2CCCCCCC2 270004a_100016995588_100000210524 [0,0,0,1,1,0|2,0,0]=4 4429 B16R2.23378 O=C1OCCC1NC2CCCCCCC2 2230a_100000211152_100000211211 [0,0,0,1,1,0|2,0,0]=4 4430 B16R2.23378 O=C1OCCC1NC2CCCCCCC2 34a_100000211152_100000211211 [0,0,0,1,1,0|2,0,0]=4 4431 B16R2.23378 O=C1OCCC1OC2CCCCCCC2 34a_100000210054_100000211211 [0,0,0,1,1,0|2,0,0]=4 4432 B16R2.23378 O=C1OCCC1OC2CCCCCCC2 7a_100000210054_100000211211 [0,0,0,1,1,0|2,0,0]=4 4433 B16R2.85184 O=C1CCCN1CCCNCC2CCC2 2230a_100000210347_100000763275 [0,0,0,1,1,0|2,0,0]=4 4434 B16R2.85184 O=C1CCCN1CCCNCC2CCC2 269862a_100000210347_100000753134 [0,0,0,1,1,0|2,0,0]=4 4435 B16R2.85184 O=C1CCCN1CCCNCC2CCC2 34a_100000210347_100000763275 [0,0,0,1,1,0|2,0,0]=4 4436 B16R2.85184 O=C1CCCN1CCCOCC2CCC2 34a_100011216539_100000763275 [0,0,0,1,1,0|2,0,0]=4 4437 B16R2.85184 O=C1CCCN1CCCOCC2CCC2 7a_100011216539_100000763275 [0,0,0,1,1,0|2,0,0]=4 4438 B18R2.31711 O=C1CN(CCCN1)CCCC2CCCCC2 2230a_100015190381_100011713725 [0,0,0,1,0,1|2,0,0]=4 4439 B18R2.46037 CCCC1CCCCC1N2CCCNC(=O)C2 270004a_100015190381_100011218038 [0,0,0,1,0,1|2,0,0]=4 4440 B18R2.100529 CCCCC1CCCC1N2CCCNC(=O)C2 270004a_100015190381_100000750825 [0,0,0,1,0,1|2,0,0]=4 4441 B18R2.326935 O=C1CN(CCCN1)C2CCCCCCCC2 270004a_100015190381_100000038600 [0,0,0,1,0,1|2,0,0]=4 4442 B18R2.3922 CN1C(=O)CCCC1CNCC2CCCCC2 2230a_200010383782_100000211423 [0,1,0,1,0,0|2,0,0]=4 4443 B18R2.3922 CN1C(=O)CCCC1CNCC2CCCCC2 269862a_200010383782_100000211278 [0,1,0,1,0,0|2,0,0]=4 4444 B18R2.3922 CN1C(=O)CCCC1CNCC2CCCCC2 34a_200010383782_100000211423 [0,1,0,1,0,0|2,0,0]=4 4445 B18R2.3930 CN1C(=O)CCCC1CNCCC2CCCC2 2230a_200010383782_100000760354 [0,1,0,1,0,0|2,0,0]=4 4446 B18R2.3930 CN1C(=O)CCCC1CNCCC2CCCC2 34a_200010383782_100000760354 [0,1,0,1,0,0|2,0,0]=4 4447 B18R2.31260 CN1C(=O)CCCC1CNC2CCCCCC2 270004a_200010383782_100000210131 [0,1,0,1,0,0|2,0,0]=4 4448 B18R2.31260 CN1C(=O)CCCC1CNC2CCCCCC2 34a_200010383782_100011217769 [0,1,0,1,0,0|2,0,0]=4 4449 B18R2.39767 CC1CCCCC1NCC2CCCC(=O)N2C 269862a_200010383782_100000210921 [0,1,0,1,0,0|2,0,0]=4 4450 B18R2.39767 CC1CCCCC1NCC2CCCC(=O)N2C 270004a_200010383782_100000210921 [0,1,0,1,0,0|2,0,0]=4 4451 B18R2.106092 CCC1CCCC1NCC2CCCC(=O)N2C 269862a_200010383782_100000749056 [0,1,0,1,0,0|2,0,0]=4 4452 B18R2.106092 CCC1CCCC1NCC2CCCC(=O)N2C 270004a_200010383782_100000749056 [0,1,0,1,0,0|2,0,0]=4 4453 B18R2.6463 O=C1CCC[C@@H](N1)C(=O)CCC2CCCCC2 1458a_100000705292_100011273959 [0,1,0,1,0,0|1,0,1]=4 4454 B18R2.65915 O=C1CCC[C@@H](N1)C(=O)CCCC2CCCC2 1458a_100000705292_100011713738 [0,1,0,1,0,0|1,0,1]=4 4455 B18R2.523480 O=C1CCC[C@@H](N1)C(=O)CC2CCCCCC2 1458a_100000705292_200000696569 [0,1,0,1,0,0|1,0,1]=4 4456 B18R2.244 CCCCC1CCCC1NC2CCNC(=O)C2 269862a_100016994916_100000750825 [0,1,0,1,0,0|2,0,0]=4 4457 B18R2.2626 CCCC1CCCCC1NC2CCNC(=O)C2 269862a_100016994916_100011218038 [0,1,0,1,0,0|2,0,0]=4 4458 B18R2.3899 O=C1CC(CCN1)COCCCC2CCCC2 34a_100009886756_100011713738 [0,1,0,1,0,0|2,0,0]=4 4459 B18R2.3899 O=C1CCCC(N1)COCCCC2CCCC2 34a_200000102386_100011713738 [0,1,0,1,0,0|1,0,0]=3 4460 B18R2.3899 O=C1CCCC(N1)COCCCN2CCCC2 34a_200000102386_100016991639 [0,1,0,1,0,0|2,0,0]=4 4461 B18R2.3899 O=C1COCC(N1)COCCCC2CCCC2 34a_200000101122_100011713738 [0,1,0,1,0,0|2,0,0]=4 4462 B18R2.6483 CC1=CC(CCC1)OCCCC2CCCCC2 34a_100011218613_100011713725 [0,1,0,1,0,0|2,0,0]=4 4463 B18R2.6483 O=C1CC(CCN1)COCCC2CCCCC2 34a_100009886756_100011209188 [0,1,0,1,0,0|2,0,0]=4 4464 B18R2.6483 O=C1CC(CCN1)NCCCC2CCCCC2 2230a_100016994916_100011713725 [0,1,0,1,0,0|2,0,0]=4 4465 B18R2.6483 O=C1CC(CCN1)NCCCC2CCCCC2 34a_100016994916_100011713725 [0,1,0,1,0,0|2,0,0]=4 4466 B18R2.6483 O=C1CCCC(C1)OCCCC2CCCCC2 34a_100012613340_100011713725 [0,1,0,1,0,0|1,0,0]=3 4467 B18R2.6483 O=C1CCCC(C1)OCCCN2CCCCC2 34a_100012613340_100000690320 [0,1,0,1,0,0|2,0,0]=4 4468 B18R2.6483 O=C1CCCC(C1)OCCOC2CCCCC2 34a_100012613340_100011211530 [0,1,0,1,0,0|2,0,0]=4 4469 B18R2.6483 O=C1CCCC(N1)COCCC2CCCCC2 34a_200000102386_100011209188 [0,1,0,1,0,0|1,0,0]=3 4470 B18R2.6483 O=C1CCCC(N1)COCCC2CCOCC2 34a_200000102386_100011934994 [0,1,0,1,0,0|2,0,0]=4 4471 B18R2.6483 O=C1CCCC(N1)COCCN2CCCCC2 34a_200000102386_100000739454 [0,1,0,1,0,0|2,0,0]=4 4472 B18R2.6483 O=C1CCCC(N1)COCOC2CCCCC2 34a_200000102386_100011935260 [0,1,0,1,0,0|2,0,0]=4 4473 B18R2.6483 O=C1COCC(N1)COCCC2CCCCC2 34a_200000101122_100011209188 [0,1,0,1,0,0|2,0,0]=4 4474 B18R2.6483 O=C1C[C@@H](CCN1)OCCCC2CCCCC2 34a_100015189427_100011713725 [0,1,0,1,0,0|2,0,0]=4 4475 B18R2.31194 O=C1CC(CCN1)COCC2CCCCCC2 34a_100009886756_200000696569 [0,1,0,1,0,0|2,0,0]=4 4476 B18R2.31194 O=C1CCCC(N1)COCC2CCCCCC2 34a_200000102386_200000696569 [0,1,0,1,0,0|1,0,0]=3 4477 B18R2.31194 O=C1COCC(N1)COCC2CCCCCC2 34a_200000101122_200000696569 [0,1,0,1,0,0|2,0,0]=4 4478 B18R2.65831 CN1CCCC1CCOCC2CCCC(=O)N2 34a_200000102386_100000005710 [0,1,0,1,0,0|2,0,0]=4 4479 B18R2.65882 CN1CCCCC1CCOC2CCCC(=O)C2 34a_100012613340_100000211948 [0,1,0,1,0,0|2,0,0]=4 4480 B18R2.65882 CN1CCCCC1COCC2CCCC(=O)N2 34a_200000102386_100015186950 [0,1,0,1,0,0|2,0,0]=4 4481 B18R3.31698 O=C1CCCC(N1)COC2C3CCC2CC3 34a_200000102386_100009813300 [0,0,0,2,0,0|2,0,0]=4 4482 B18R3.31713 O=C1CCCC(N1)COC2CC3CCC2C3 34a_200000102386_100000727232 [0,0,0,2,0,0|2,0,0]=4 4483 B14R0.488 CCCCCCCCNC(CC)C(=O)N 2230a_100000229939_100000750255 [0,0,1,0,1,0|2,0,0]=4 4484 B14R0.488 CCCCCCCCNC(CC)C(=O)N 2230a_100000733705_100000210759 [0,0,1,0,1,0|2,0,0]=4 4485 B14R0.488 CCCCCCCCNC(CC)C(=O)N 34a_100000229939_100000750255 [0,0,1,0,1,0|2,0,0]=4 4486 B14R0.488 CCCCCCCCNC(CC)C(=O)N 34a_100000733705_100000210759 [0,0,1,0,1,0|2,0,0]=4 4487 B14R0.488 CCCCCCCCN[C@H](CC)C(=O)O 269956a_100000747097_100000210759 [0,0,1,0,1,0|2,0,0]=4 4488 B14R0.488 CCCCCCCCOC(CC)C(=O)N 34a_100000210232_100000750255 [0,0,1,0,1,0|2,0,0]=4 4489 B14R0.488 CCCCCCCCOC(CC)C(=O)N 7a_100000210232_100000750255 [0,0,1,0,1,0|2,0,0]=4 4490 B14R0.488 CCCCCCCCSC(CC)C(=O)N 62a_100000210759_100000750255 [0,0,1,0,1,0|2,0,0]=4 4491 B14R0.488 CCCCCCCCSC(CC)C(=O)N 62a_100000750255_100000210317 [0,0,1,0,1,0|2,0,0]=4 4492 B14R0.181 CCC(=O)C(C)NCCCCCCCO 2230a_100011996573_100000742827 [0,0,1,0,1,0|2,0,0]=4 4493 B14R0.181 CCC(=O)C(C)OCCCCCCCBr 7a_100000760002_100000742827 [0,0,1,0,1,0|2,0,0]=4 4494 B14R0.181 CCC(=O)C(C)OCCCCCCOC 7a_200012092642_100000742827 [0,0,1,0,1,0|2,0,0]=4 4495 B14R0.181 CCC(=O)C(C)SCCCCCCCO 62a_100000742827_100000760002 [0,0,1,0,1,0|2,0,0]=4 4496 B14R0.181 CCC(=O)C(C)SCCCCCCCO 62a_100000760002_100000742827 [0,0,1,0,1,0|2,0,0]=4 4497 B14R0.181 CCC(=O)C(C)SCCCCCCOC 62a_100000742827_100011998445 [0,0,1,0,1,0|2,0,0]=4 4498 B14R0.181 CCC(=O)C(C)SCCCCCCOC 62a_100011998445_100000742827 [0,0,1,0,1,0|2,0,0]=4 4499 B14R0.181 CCCCCCCCCN(C)C(=O)CC 11a_100000232482_100000210414 [0,0,1,0,1,0|1,0,0]=3 4500 B14R0.181 CCCCCCCCCN(C)C(=O)CC 1626a_100000232482_100000210414 [0,0,1,0,1,0|1,0,0]=3 4501 B14R0.181 CCCCCCCCCN(C)C(=O)CC 240690a_100000232482_100000210414 [0,0,1,0,1,0|1,0,0]=3 4502 B14R0.181 CCCCCCCCCN(C)C(=O)CC 527a_100000232482_100000210414 [0,0,1,0,1,0|1,0,0]=3 4503 B14R0.181 CCCCCCCCCN(C)C(=O)CO 240690a_100000232482_100000210174 [0,0,1,0,1,0|2,0,0]=4 4504 B14R0.181 CCCCCCCCCN(C)C(=O)CO 527a_100000232482_100000210174 [0,0,1,0,1,0|2,0,0]=4 4505 B14R0.181 CCCCCCCCCN(C)C(=O)NC 2708a_100102657272_100000232482 [0,0,1,0,1,0|2,0,0]=4 4506 B14R0.181 CCCCCCCCCN(C)C(=O)NC 273464a_100102657272_100000232482 [0,0,1,0,1,0|2,0,0]=4 4507 B14R0.181 CCCCCCCCNC(C)C(=O)CC 2230a_100000229939_100000742827 [0,0,1,0,1,0|1,0,0]=3 4508 B14R0.181 CCCCCCCCNC(C)C(=O)NC 2230a_100000229939_100000731044 [0,0,1,0,1,0|2,0,0]=4 4509 B14R0.181 CCCCCCCCNC(C)C(=O)NC 34a_100000229939_100000731044 [0,0,1,0,1,0|2,0,0]=4 4510 B14R0.181 CCCCCCCCNC(C)C(=O)OC 2230a_100000229939_100000211248 [0,0,1,0,1,0|2,0,0]=4 4511 B14R0.181 CCCCCCCCNC(C)C(=O)OC 34a_100000229939_100000211248 [0,0,1,0,1,0|2,0,0]=4 4512 B14R0.181 CCCCCCCCN[C@H](C)C(=O)NC 2230a_100000684985_100000210759 [0,0,1,0,1,0|2,0,0]=4 4513 B14R0.181 CCCCCCCCN[C@H](C)C(=O)NC 34a_100000684985_100000210759 [0,0,1,0,1,0|2,0,0]=4 4514 B14R0.181 CCCCCCCCOC(C)C(=O)CC 7a_100000210232_100000742827 [0,0,1,0,1,0|1,0,0]=3 4515 B14R0.181 CCCCCCCCOC(C)C(=O)NC 34a_100000210232_100000731044 [0,0,1,0,1,0|2,0,0]=4 4516 B14R0.181 CCCCCCCCOC(C)C(=O)NC 7a_100000210232_100000209862 [0,0,1,0,1,0|2,0,0]=4 4517 B14R0.181 CCCCCCCCOC(C)C(=O)OC 34a_100000210232_100000211248 [0,0,1,0,1,0|2,0,0]=4 4518 B14R0.181 CCCCCCCCOC(C)C(=O)OC 34a_100011215400_100000210759 [0,0,1,0,1,0|2,0,0]=4 4519 B14R0.181 CCCCCCCCOC(C)C(=O)OC 7a_100000210232_100000211248 [0,0,1,0,1,0|2,0,0]=4 4520 B14R0.181 CCCCCCCCSC(C)C(=O)CC 62a_100000210759_100000742827 [0,0,1,0,1,0|1,0,0]=3 4521 B14R0.181 CCCCCCCCSC(C)C(=O)CC 62a_100000742827_100000210317 [0,0,1,0,1,0|1,0,0]=3 4522 B14R0.181 CCCCCCCCSC(C)C(=O)NC 62a_100000209862_100000210317 [0,0,1,0,1,0|2,0,0]=4 4523 B14R0.181 CCCCCCCCSC(C)C(=O)NC 62a_100000210759_100000731044 [0,0,1,0,1,0|2,0,0]=4 4524 B14R0.181 CCCCCCCCSC(C)C(=O)OC 62a_100000210759_100000211248 [0,0,1,0,1,0|2,0,0]=4 4525 B14R0.181 CCCCCCCCSC(C)C(=O)OC 62a_100000211248_100000210317 [0,0,1,0,1,0|2,0,0]=4 4526 B14R0.181 CCCCCCCNCC(C)C(=O)NC 2230a_100015187722_100000210681 [0,0,1,0,1,0|2,0,0]=4 4527 B14R0.181 CCCCCCCNCC(C)C(=O)NC 34a_100015187722_100000210614 [0,0,1,0,1,0|2,0,0]=4 4528 B14R0.181 CCCCCCCOCC(C)C(=O)OC 34a_100000210272_100000698445 [0,0,1,0,1,0|2,0,0]=4 4529 B14R0.181 CCCCCCCOCC(C)C(=O)OC 34a_100000749362_100000210614 [0,0,1,0,1,0|2,0,0]=4 4530 B14R0.181 CCCCCCCOCC(C)C(=O)OC 7a_100000749362_100000210614 [0,0,1,0,1,0|2,0,0]=4 4531 B14R0.181 CCCCCCCSCC(C)C(=O)OC 62a_100000210614_100000698445 [0,0,1,0,1,0|2,0,0]=4 4532 B14R0.181 CCCCCCCSCC(C)C(=O)OC 62a_100000698445_100000210316 [0,0,1,0,1,0|2,0,0]=4 4533 B14R0.181 CCCCCCNCCC(C)C(=O)OC 2230a_100000210581_100000034942 [0,0,1,0,1,0|2,0,0]=4 4534 B14R0.181 CCCCCCOCCC(C)C(=O)OC 34a_100000210259_100000034942 [0,0,1,0,1,0|2,0,0]=4 4535 B14R0.181 CCCCCCOCCC(C)C(=O)OC 7a_100000210259_100000034942 [0,0,1,0,1,0|2,0,0]=4 4536 B14R0.181 CCCCCCSCCC(C)C(=O)OC 62a_100000034942_100000210757 [0,0,1,0,1,0|2,0,0]=4 4537 B14R0.181 CCCCCCSCCC(C)C(=O)OC 62a_100000210314_100000034942 [0,0,1,0,1,0|2,0,0]=4 4538 B14R0.181 CCCCCOCCOC(C)C(=O)CC 7a_100011215259_100000742827 [0,0,1,0,1,0|2,0,0]=4 4539 B14R0.181 CCCCOCCCNC(C)C(=O)CC 2230a_200000211371_100000742827 [0,0,1,0,1,0|2,0,0]=4 4540 B14R0.181 CCCCOCCCOC(C)C(=O)CC 7a_200011215613_100000742827 [0,0,1,0,1,0|2,0,0]=4 4541 B14R1.40 BrCCCCCCOCC1CCCO1 7a_100011215345_100000203698 [1,0,0,0,1,0|2,0,0]=4 4542 B14R1.40 CCCCCCCCCN1CCCC1 2230a_100000188435_100011214924 [1,0,0,0,1,0|1,0,1]=4 4543 B14R1.40 CCCCCCCCCN1CCCC1 269982a_100000188435_100000210670 [1,0,0,0,1,0|1,0,1]=4 4544 B14R1.40 CCCCCCCCNC1CCCC1 2230a_100000211070_100000210759 [1,0,0,0,1,0|1,0,1]=4 4545 B14R1.40 CCCCCCCCNC1CCCC1 2230a_100000229939_100000179811 [1,0,0,0,1,0|1,0,1]=4 4546 B14R1.40 CCCCCCCCNC1CCCC1 270004a_100000229939_100000210133 [1,0,0,0,1,0|1,0,1]=4 4547 B14R1.40 CCCCCCCCNC1CCCC1 34a_100000211070_100000210759 [1,0,0,0,1,0|1,0,1]=4 4548 B14R1.40 CCCCCCCCNC1CCCC1 34a_100000229939_100000179811 [1,0,0,0,1,0|1,0,1]=4 4549 B14R1.40 CCCCCCCCOC1CCCC1 34a_100000210232_100000179811 [1,0,0,0,1,0|1,0,1]=4 4550 B14R1.40 CCCCCCCCOC1CCCC1 34a_100000210269_100000210759 [1,0,0,0,1,0|1,0,1]=4 4551 B14R1.40 CCCCCCCCOC1CCCC1 7a_100000210232_100000179811 [1,0,0,0,1,0|1,0,1]=4 4552 B14R1.40 CCCCCCCCOC1CCCC1 7a_100000210269_100000210759 [1,0,0,0,1,0|1,0,1]=4 4553 B14R1.40 CCCCCCCCOC1CCCO1 34a_100000085407_100000210759 [1,0,0,0,1,0|1,0,0]=3 4554 B14R1.40 CCCCCCCCSC1CCCC1 62a_100000210759_100000179811 [1,0,0,0,1,0|1,0,1]=4 4555 B14R1.40 CCCCCCCCSC1CCCC1 62a_100011217020_100000210317 [1,0,0,0,1,0|1,0,1]=4 4556 B14R1.40 CCCCCCCNCC1CCCC1 2230a_100000229938_100000740388 [1,0,0,0,1,0|1,0,1]=4 4557 B14R1.40 CCCCCCCNCC1CCCC1 2230a_100000737975_100000210681 [1,0,0,0,1,0|1,0,1]=4 4558 B14R1.40 CCCCCCCNCC1CCCC1 269862a_100000229938_100000746403 [1,0,0,0,1,0|1,0,1]=4 4559 B14R1.40 CCCCCCCNCC1CCCC1 34a_100000737975_100000210614 [1,0,0,0,1,0|1,0,1]=4 4560 B14R1.40 CCCCCCCNCC1CCCO1 2230a_100000229938_100000203698 [1,0,0,0,1,0|1,0,0]=3 4561 B14R1.40 CCCCCCCNCC1OCCO1 2230a_100000036311_100000210681 [1,0,0,0,1,0|2,0,0]=4 4562 B14R1.40 CCCCCCCNCC1OCCO1 2230a_100000229938_100000755774 [1,0,0,0,1,0|2,0,0]=4 4563 B14R1.40 CCCCCCCNCC1OCCO1 34a_100000036311_100000210614 [1,0,0,0,1,0|2,0,0]=4 4564 B14R1.40 CCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210681 [1,0,0,0,1,0|1,0,0]=3 4565 B14R1.40 CCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000210614 [1,0,0,0,1,0|1,0,0]=3 4566 B14R1.40 CCCCCCCOCC1CCCC1 34a_100000210272_100000740388 [1,0,0,0,1,0|1,0,1]=4 4567 B14R1.40 CCCCCCCOCC1CCCC1 34a_100000742336_100000210614 [1,0,0,0,1,0|1,0,1]=4 4568 B14R1.40 CCCCCCCOCC1CCCC1 7a_100000210272_100000740388 [1,0,0,0,1,0|1,0,1]=4 4569 B14R1.40 CCCCCCCOCC1CCCC1 7a_100000742336_100000210614 [1,0,0,0,1,0|1,0,1]=4 4570 B14R1.40 CCCCCCCOCC1CCCO1 34a_100000210270_100000210614 [1,0,0,0,1,0|1,0,0]=3 4571 B14R1.40 CCCCCCCOCC1CCCO1 7a_100000210270_100000210614 [1,0,0,0,1,0|1,0,0]=3 4572 B14R1.40 CCCCCCCOCC1CCCO1 7a_100000210272_100000203698 [1,0,0,0,1,0|1,0,0]=3 4573 B14R1.40 CCCCCCCOCC1COCO1 34a_100011216627_100000210614 [1,0,0,0,1,0|2,0,0]=4 4574 B14R1.40 CCCCCCCOCC1OCCO1 34a_100000087154_100000210614 [1,0,0,0,1,0|2,0,0]=4 4575 B14R1.40 CCCCCCCOCC1OCCO1 34a_100000210272_100000755774 [1,0,0,0,1,0|2,0,0]=4 4576 B14R1.40 CCCCCCCOCC1OCCO1 7a_100000210272_100000755774 [1,0,0,0,1,0|2,0,0]=4 4577 B14R1.40 CCCCCCCOC[C@H]1CCCN1 34a_100000745186_100000210614 [1,0,0,0,1,0|2,0,0]=4 4578 B14R1.40 CCCCCCCSCC1CCCC1 62a_100000210614_100000740388 [1,0,0,0,1,0|1,0,1]=4 4579 B14R1.40 CCCCCCCSCC1CCCC1 62a_100000740388_100000210316 [1,0,0,0,1,0|1,0,1]=4 4580 B14R1.40 CCCCCCCSCC1CCCO1 62a_100000203698_100000210316 [1,0,0,0,1,0|1,0,0]=3 4581 B14R1.40 CCCCCCCSCC1CCCO1 62a_100000210614_100000203698 [1,0,0,0,1,0|1,0,0]=3 4582 B14R1.40 CCCCCCCSCC1OCCO1 62a_100000210614_100000755774 [1,0,0,0,1,0|2,0,0]=4 4583 B14R1.40 CCCCCCCSCC1OCCO1 62a_100000755774_100000210316 [1,0,0,0,1,0|2,0,0]=4 4584 B14R1.40 CCCCCCNCCC1CCCC1 2230a_100000210581_100000760354 [1,0,0,0,1,0|1,0,1]=4 4585 B14R1.40 CCCCCCNCCC1CCCC1 2230a_100000739158_100000210314 [1,0,0,0,1,0|1,0,1]=4 4586 B14R1.40 CCCCCCNCCC1CCCC1 34a_100000739158_100000210314 [1,0,0,0,1,0|1,0,1]=4 4587 B14R1.40 CCCCCCNCCC1OCCO1 2230a_100000034215_100000210314 [1,0,0,0,1,0|2,0,0]=4 4588 B14R1.40 CCCCCCNCCC1OCCO1 2230a_100000210581_100000740749 [1,0,0,0,1,0|2,0,0]=4 4589 B14R1.40 CCCCCCNCCC1OCCO1 34a_100000034215_100000210314 [1,0,0,0,1,0|2,0,0]=4 4590 B14R1.40 CCCCCCOCCC1CCCC1 34a_100000210259_100000760354 [1,0,0,0,1,0|1,0,1]=4 4591 B14R1.40 CCCCCCOCCC1CCCC1 34a_100000749090_100000210314 [1,0,0,0,1,0|1,0,1]=4 4592 B14R1.40 CCCCCCOCCC1CCCC1 7a_100000210259_100000760354 [1,0,0,0,1,0|1,0,1]=4 4593 B14R1.40 CCCCCCOCCC1CCCC1 7a_100000749090_100000210314 [1,0,0,0,1,0|1,0,1]=4 4594 B14R1.40 CCCCCCOCCC1OCCO1 34a_100000210259_100000740749 [1,0,0,0,1,0|2,0,0]=4 4595 B14R1.40 CCCCCCOCCC1OCCO1 7a_100000210259_100000740749 [1,0,0,0,1,0|2,0,0]=4 4596 B14R1.40 CCCCCCSCCC1CCCC1 62a_100000210314_100000760354 [1,0,0,0,1,0|1,0,1]=4 4597 B14R1.40 CCCCCCSCCC1CCCC1 62a_100000760354_100000210757 [1,0,0,0,1,0|1,0,1]=4 4598 B14R1.40 CCCCCCSCCC1OCCO1 62a_100000210314_100000740749 [1,0,0,0,1,0|2,0,0]=4 4599 B14R1.40 CCCCCNCCCC1CCCC1 2230a_100000209983_100011713738 [1,0,0,0,1,0|1,0,1]=4 4600 B14R1.40 CCCCCNCCCC1CCCC1 2230a_100000736752_100000210326 [1,0,0,0,1,0|1,0,1]=4 4601 B14R1.40 CCCCCNCCCC1CCCC1 34a_100000736752_100000718602 [1,0,0,0,1,0|1,0,1]=4 4602 B14R1.40 CCCCCNCCCC1OCCO1 2230a_100000209983_100000042513 [1,0,0,0,1,0|2,0,0]=4 4603 B14R1.40 CCCCCOCCCC1CCCC1 34a_100000210253_100011713738 [1,0,0,0,1,0|1,0,1]=4 4604 B14R1.40 CCCCCOCCCC1CCCC1 34a_100011215328_100000718602 [1,0,0,0,1,0|1,0,1]=4 4605 B14R1.40 CCCCCOCCCC1CCCC1 7a_100000210253_100011713738 [1,0,0,0,1,0|1,0,1]=4 4606 B14R1.40 CCCCCOCCCC1CCCC1 7a_100011215328_100000210326 [1,0,0,0,1,0|1,0,1]=4 4607 B14R1.40 CCCCCOCCCC1OCCO1 34a_100000210253_100009861162 [1,0,0,0,1,0|2,0,0]=4 4608 B14R1.40 CCCCCOCCCC1OCCO1 34a_100009871617_100000718602 [1,0,0,0,1,0|2,0,0]=4 4609 B14R1.40 CCCCCOCCCC1OCCO1 7a_100000210253_100000042513 [1,0,0,0,1,0|2,0,0]=4 4610 B14R1.40 CCCCCOCCCC1OCCO1 7a_100009871617_100000210326 [1,0,0,0,1,0|2,0,0]=4 4611 B14R1.40 CCCCCSCCCC1CCCC1 62a_100000210326_100011713738 [1,0,0,0,1,0|1,0,1]=4 4612 B14R1.40 CCCCCSCCCC1CCCC1 62a_100011713738_100000210326 [1,0,0,0,1,0|1,0,1]=4 4613 B14R1.40 CCCCCSCCCC1OCCO1 62a_100000210326_100000042513 [1,0,0,0,1,0|2,0,0]=4 4614 B14R1.40 CCCCNCCCCC1OCCO1 2230a_100000102301_100000034956 [1,0,0,0,1,0|2,0,0]=4 4615 B14R1.40 CCCCNCCCCC1OCCO1 7a_106832991798_100000034956 [1,0,0,0,1,0|2,0,0]=4 4616 B14R1.40 CCCCOCCCCC1OCCO1 34a_100000210227_200009813554 [1,0,0,0,1,0|2,0,0]=4 4617 B14R1.40 CCCCOCCCCC1OCCO1 7a_100000210227_100000034956 [1,0,0,0,1,0|2,0,0]=4 4618 B14R1.40 CCCCOCCNC[C@@H]1CCCO1 2230a_100020590478_100000743108 [1,0,0,0,1,0|2,0,0]=4 4619 B14R1.40 CCCCOCCNC[C@@H]1CCCO1 34a_100020590478_100000743108 [1,0,0,0,1,0|2,0,0]=4 4620 B14R1.40 CCCCOCCOCC1CCCO1 34a_100000210270_100000743108 [1,0,0,0,1,0|2,0,0]=4 4621 B14R1.40 CCCCOCCOCC1CCCO1 7a_100000210238_100000203698 [1,0,0,0,1,0|2,0,0]=4 4622 B14R1.40 CCCCOCCOCC1CCCO1 7a_100000210270_100000743108 [1,0,0,0,1,0|2,0,0]=4 4623 B14R1.40 CCCCOCCSCC1CCCO1 62a_100000203698_100000743108 [1,0,0,0,1,0|2,0,0]=4 4624 B14R1.40 CCCCOCCSCC1CCCO1 62a_100000743108_100000203698 [1,0,0,0,1,0|2,0,0]=4 4625 B14R1.40 CCCCSCCCCC1OCCO1 62a_100000210211_100000034956 [1,0,0,0,1,0|2,0,0]=4 4626 B14R1.40 CCCCSCCNCC1CCCO1 2230a_100025743550_100000203698 [1,0,0,0,1,0|2,0,0]=4 4627 B14R1.40 CCCCSCCOCC1CCCO1 7a_200000230436_100000203698 [1,0,0,0,1,0|2,0,0]=4 4628 B14R1.40 CCCOCCCCOC1CCCO1 34a_100011018183_100000210303 [1,0,0,0,1,0|2,0,0]=4 4629 B14R1.40 CCCOCCCCOC1CCCO1 7a_100011018183_100000210303 [1,0,0,0,1,0|2,0,0]=4 4630 B14R1.40 CCCOCCCNCC1CCCO1 2230a_100011217757_100000203698 [1,0,0,0,1,0|2,0,0]=4 4631 B14R1.40 COCCCCCCOC1CCCO1 34a_100000085407_100011998445 [1,0,0,0,1,0|2,0,0]=4 4632 B14R1.40 COCCCCCNCC1CCCO1 2230a_100000747528_100000203698 [1,0,0,0,1,0|2,0,0]=4 4633 B14R1.40 ClCCCCCCOCC1CCCO1 7a_100000766143_100000203698 [1,0,0,0,1,0|2,0,0]=4 4634 B14R1.40 FCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100015922095 [1,0,0,0,1,0|2,0,0]=4 4635 B14R1.40 FCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100015922095 [1,0,0,0,1,0|2,0,0]=4 4636 B14R1.40 FCCCCCCOCC1CCCO1 34a_100000210270_100015922095 [1,0,0,0,1,0|2,0,0]=4 4637 B14R1.40 FCCCCCCOCC1CCCO1 7a_100000210270_100015922095 [1,0,0,0,1,0|2,0,0]=4 4638 B14R1.40 FCCCCCCOCC1CCCO1 7a_100000732779_100000203698 [1,0,0,0,1,0|2,0,0]=4 4639 B14R1.40 FCCCCCCSCC1CCCO1 62a_100000203698_100015922095 [1,0,0,0,1,0|2,0,0]=4 4640 B14R1.40 FCCCCCCSCC1CCCO1 62a_100015922095_100000203698 [1,0,0,0,1,0|2,0,0]=4 4641 B14R1.40 OCCCCCCCOC1CCCO1 34a_100000085407_100000760002 [1,0,0,0,1,0|2,0,0]=4 4642 B14R1.40 OCCCCCCNCC1CCCO1 2230a_100000686447_100000203698 [1,0,0,0,1,0|2,0,0]=4 4643 B14R1.40 OCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000766143 [1,0,0,0,1,0|2,0,0]=4 4644 B14R1.40 OCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000766143 [1,0,0,0,1,0|2,0,0]=4 4645 B14R1.40 OCCCCCCOCC1CCCO1 34a_100000210270_100000766143 [1,0,0,0,1,0|2,0,0]=4 4646 B14R1.40 OCCCCCCOCC1CCCO1 7a_100000210270_100000766143 [1,0,0,0,1,0|2,0,0]=4 4647 B14R1.40 OCCCCCCSCC1CCCO1 62a_100000203698_100000766143 [1,0,0,0,1,0|2,0,0]=4 4648 B14R1.40 OCCCCCCSCC1CCCO1 62a_100000766143_100000203698 [1,0,0,0,1,0|2,0,0]=4 4649 B14R1.122 CCCCCCCOC1CCC(=O)C1 34a_100012614533_100000210614 [1,0,0,0,1,0|2,0,0]=4 4650 B14R1.122 CCCCCCCOC1COC(=O)O1 34a_100000210272_100000032252 [1,0,0,0,1,0|2,0,0]=4 4651 B14R1.122 CCCCCCCSC1COC(=O)O1 62a_100000210614_100000032252 [1,0,0,0,1,0|2,0,0]=4 4652 B14R1.122 CCCCCCNCC1CNC(=O)O1 2230a_100000210581_100000181169 [1,0,0,0,1,0|2,0,0]=4 4653 B14R1.122 CCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000210581_100015189358 [1,0,0,0,1,0|2,0,0]=4 4654 B14R1.122 CCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210314 [1,0,0,0,1,0|2,0,0]=4 4655 B14R1.122 CCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210314 [1,0,0,0,1,0|2,0,0]=4 4656 B14R1.122 CCCCCCOCC1CCC(=O)N1 34a_100000737831_100000210314 [1,0,0,0,1,0|2,0,0]=4 4657 B14R1.122 CCCCCCOCC1CNC(=O)O1 34a_100000210259_100000181169 [1,0,0,0,1,0|2,0,0]=4 4658 B14R1.122 CCCCCCOCC1CNC(=O)O1 34a_100011315639_100000210314 [1,0,0,0,1,0|2,0,0]=4 4659 B14R1.122 CCCCCCOCC1CNC(=O)O1 7a_100000210259_100000181169 [1,0,0,0,1,0|2,0,0]=4 4660 B14R1.122 CCCCCCOCC1COC(=O)O1 34a_100000210259_100000073702 [1,0,0,0,1,0|2,0,0]=4 4661 B14R1.122 CCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210259_100015189358 [1,0,0,0,1,0|2,0,0]=4 4662 B14R1.122 CCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210757 [1,0,0,0,1,0|2,0,0]=4 4663 B14R1.122 CCCCCCSCC1CNC(=O)O1 62a_100000210314_100000181169 [1,0,0,0,1,0|2,0,0]=4 4664 B14R1.122 CCCCCCSCC1COC(=O)O1 62a_100000073702_100000210757 [1,0,0,0,1,0|2,0,0]=4 4665 B14R1.122 CCCCCCSCC1COC(=O)O1 62a_100000210314_100000073702 [1,0,0,0,1,0|2,0,0]=4 4666 B14R1.122 CCCCCCSC[C@@H]1CCC(=O)N1 62a_100000210314_100015189358 [1,0,0,0,1,0|2,0,0]=4 4667 B14R1.122 CCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210757 [1,0,0,0,1,0|2,0,0]=4 4668 B14R1.216 CCCCCCCNC1CCCC1=O 2230a_100000229938_100000211823 [1,0,0,0,1,0|1,0,0]=3 4669 B14R1.216 CCCCCCCNC1CCNC1=O 2230a_100016995588_100000210681 [1,0,0,0,1,0|2,0,0]=4 4670 B14R1.216 CCCCCCCNC1CCNC1=O 34a_100016995588_100000210614 [1,0,0,0,1,0|2,0,0]=4 4671 B14R1.216 CCCCCCCNC1CCOC1=O 2230a_100000229938_100000211211 [1,0,0,0,1,0|2,0,0]=4 4672 B14R1.216 CCCCCCCOC1CCCC1=O 34a_100000210272_100000709159 [1,0,0,0,1,0|1,0,0]=3 4673 B14R1.216 CCCCCCCOC1CCCC1=O 34a_200000719330_100000210614 [1,0,0,0,1,0|1,0,0]=3 4674 B14R1.216 CCCCCCCOC1CCCC1=O 7a_100000210272_100000211823 [1,0,0,0,1,0|1,0,0]=3 4675 B14R1.216 CCCCCCCOC1CCOC1=O 34a_100000210272_100000211211 [1,0,0,0,1,0|2,0,0]=4 4676 B14R1.216 CCCCCCCOC1CCOC1=O 7a_100000210272_100000211211 [1,0,0,0,1,0|2,0,0]=4 4677 B14R1.216 CCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100000210614 [1,0,0,0,1,0|2,0,0]=4 4678 B14R1.216 CCCCCCCSC1CCCC1=O 62a_100000210614_100000211823 [1,0,0,0,1,0|1,0,0]=3 4679 B14R1.216 CCCCCCCSC1CCCC1=O 62a_100000211823_100000210316 [1,0,0,0,1,0|1,0,0]=3 4680 B14R1.216 CCCCCCCSC1CCOC1=O 62a_100000210614_100000211211 [1,0,0,0,1,0|2,0,0]=4 4681 B14R1.216 CCCCCCCSC1CCOC1=O 62a_100000211211_100000210316 [1,0,0,0,1,0|2,0,0]=4 4682 B14R1.216 CCCCCCOCC1CCNC1=O 34a_100000133458_100000210314 [1,0,0,0,1,0|2,0,0]=4 4683 B14R1.216 CCCCCCSCN1CCCC1=O 62a_100000026320_100000210757 [1,0,0,0,1,0|2,0,0]=4 4684 B14R1.216 CCCCCCSCN1CCCC1=O 62a_100000210314_100000026320 [1,0,0,0,1,0|2,0,0]=4 4685 B14R1.216 CCCCCNCCN1CCCC1=O 2230a_100000209983_100000739059 [1,0,0,0,1,0|2,0,0]=4 4686 B14R1.216 CCCCCNCCN1CCCC1=O 2230a_100011200922_100000210326 [1,0,0,0,1,0|2,0,0]=4 4687 B14R1.216 CCCCCOCCN1CCCC1=O 34a_100000210253_100000739059 [1,0,0,0,1,0|2,0,0]=4 4688 B14R1.216 CCCCCOCCN1CCCC1=O 34a_100000211209_100000718602 [1,0,0,0,1,0|2,0,0]=4 4689 B14R1.216 CCCCCOCCN1CCCC1=O 7a_100000210253_100000739059 [1,0,0,0,1,0|2,0,0]=4 4690 B14R1.216 CCCCCOCCN1CCCC1=O 7a_100000211209_100000210326 [1,0,0,0,1,0|2,0,0]=4 4691 B14R1.216 CCCCCSCCN1CCCC1=O 62a_100000210326_100000739059 [1,0,0,0,1,0|2,0,0]=4 4692 B14R1.216 CCCCCSCCN1CCCC1=O 62a_100000739059_100000210326 [1,0,0,0,1,0|2,0,0]=4 4693 B14R1.216 CCCCNCCCN1CCCC1=O 2230a_100000210347_100000210211 [1,0,0,0,1,0|2,0,0]=4 4694 B14R1.216 CCCCNCCCN1CCCC1=O 34a_100000210347_100000210210 [1,0,0,0,1,0|2,0,0]=4 4695 B14R1.216 CCCCOCCCN1CCCC1=O 34a_100011216539_100000210210 [1,0,0,0,1,0|2,0,0]=4 4696 B14R1.216 CCCCOCCCN1CCCC1=O 7a_100011216539_100000210211 [1,0,0,0,1,0|2,0,0]=4 4697 B14R1.216 CCCCOCCOC1CCCC1=O 34a_100000210238_100000709159 [1,0,0,0,1,0|2,0,0]=4 4698 B14R1.216 CCCCOCCOC1CCCC1=O 34a_200000719330_100000743108 [1,0,0,0,1,0|2,0,0]=4 4699 B14R1.216 CCCCOCCOC1CCCC1=O 7a_100000210238_100000211823 [1,0,0,0,1,0|2,0,0]=4 4700 B14R1.216 CCCCOCCSC1CCCC1=O 62a_100000211823_100000743108 [1,0,0,0,1,0|2,0,0]=4 4701 B14R1.216 CCCCOCCSC1CCCC1=O 62a_100000743108_100000211823 [1,0,0,0,1,0|2,0,0]=4 4702 B14R1.216 CCCCSCCNC1CCCC1=O 2230a_100025743550_100000211823 [1,0,0,0,1,0|2,0,0]=4 4703 B14R1.216 CCCCSCCOC1CCCC1=O 34a_200000230436_100000709159 [1,0,0,0,1,0|2,0,0]=4 4704 B14R1.216 CCCCSCCOC1CCCC1=O 7a_200000230436_100000211823 [1,0,0,0,1,0|2,0,0]=4 4705 B14R1.216 CCCOCCCNC1CCCC1=O 2230a_100011217757_100000211823 [1,0,0,0,1,0|2,0,0]=4 4706 B14R1.216 CCCOCCCNC1CCCC1=O 34a_100011217757_100000709159 [1,0,0,0,1,0|2,0,0]=4 4707 B14R1.216 CNCCCCCOC1CCCC1=O 34a_100000722520_100000709159 [1,0,0,0,1,0|2,0,0]=4 4708 B14R1.216 COCCCCCNC1CCCC1=O 2230a_100000747528_100000211823 [1,0,0,0,1,0|2,0,0]=4 4709 B14R1.216 COCCCCCNC1CCCC1=O 34a_100000747528_100000709159 [1,0,0,0,1,0|2,0,0]=4 4710 B14R1.216 NCCCCCCOC1CCCC1=O 34a_100000686447_100000709159 [1,0,0,0,1,0|2,0,0]=4 4711 B14R1.216 O=C1CCCC1NCCCCCCO 2230a_100000686447_100000211823 [1,0,0,0,1,0|2,0,0]=4 4712 B14R1.216 O=C1CCCC1NCCCCCCO 34a_100000686447_100000709159 [1,0,0,0,1,0|2,0,0]=4 4713 B14R1.216 O=C1CCCC1OCCCCCCBr 34a_100011215345_100000709159 [1,0,0,0,1,0|2,0,0]=4 4714 B14R1.216 O=C1CCCC1OCCCCCCBr 7a_100011215345_100000211823 [1,0,0,0,1,0|2,0,0]=4 4715 B14R1.216 O=C1CCCC1OCCCCCCCl 34a_100000766143_100000709159 [1,0,0,0,1,0|2,0,0]=4 4716 B14R1.216 O=C1CCCC1OCCCCCCCl 7a_100000766143_100000211823 [1,0,0,0,1,0|2,0,0]=4 4717 B14R1.216 O=C1CCCC1OCCCCCCF 34a_100000732779_100000709159 [1,0,0,0,1,0|2,0,0]=4 4718 B14R1.216 O=C1CCCC1OCCCCCCF 34a_200000719330_100015922095 [1,0,0,0,1,0|2,0,0]=4 4719 B14R1.216 O=C1CCCC1OCCCCCCF 7a_100000732779_100000211823 [1,0,0,0,1,0|2,0,0]=4 4720 B14R1.216 O=C1CCCC1OCCCCCCO 34a_200000719330_100000766143 [1,0,0,0,1,0|2,0,0]=4 4721 B14R1.216 O=C1CCCC1SCCCCCCF 62a_100000211823_100015922095 [1,0,0,0,1,0|2,0,0]=4 4722 B14R1.216 O=C1CCCC1SCCCCCCF 62a_100015922095_100000211823 [1,0,0,0,1,0|2,0,0]=4 4723 B14R1.216 O=C1CCCC1SCCCCCCO 62a_100000211823_100000766143 [1,0,0,0,1,0|2,0,0]=4 4724 B14R1.216 O=C1CCCC1SCCCCCCO 62a_100000766143_100000211823 [1,0,0,0,1,0|2,0,0]=4 4725 B14R1.229 CCCCCCCCNC1CCC1=O 34a_100000229939_100009892977 [0,0,0,0,2,0|1,0,0]=3 4726 B14R1.229 CCCCCCCCOC1CCC1=O 34a_100000210232_100009892977 [0,0,0,0,2,0|1,0,0]=3 4727 B14R1.229 CCCCCCCCOC1CCC1=O 7a_100000210232_100009892977 [0,0,0,0,2,0|1,0,0]=3 4728 B14R1.229 CCCCCCCCSC1CCC1=O 62a_100000210759_100009892977 [0,0,0,0,2,0|1,0,0]=3 4729 B14R1.229 CCCCCCCCSC1CCC1=O 62a_100009892977_100000210317 [0,0,0,0,2,0|1,0,0]=3 4730 B14R1.229 CCCCCCNCCC1CCC1=O 2230a_100000210581_200016118888 [0,0,0,0,2,0|1,0,0]=3 4731 B14R1.229 CCCCCCOCCC1CCC1=O 7a_100000210259_200016118888 [0,0,0,0,2,0|1,0,0]=3 4732 B14R1.229 CCCCCCSCCC1CCC1=O 62a_100000210314_200016118888 [0,0,0,0,2,0|1,0,0]=3 4733 B14R1.229 CCCCCCSCCC1CCC1=O 62a_200016118888_100000210757 [0,0,0,0,2,0|1,0,0]=3 4734 B14R1.229 CCCCCNCCOC1CCC1=O 34a_100000224656_100009892977 [0,0,0,0,2,0|2,0,0]=4 4735 B14R1.229 CCCCCOCCOC1CCC1=O 34a_100011215259_100009892977 [0,0,0,0,2,0|2,0,0]=4 4736 B14R1.229 CCCCCOCCOC1CCC1=O 7a_100011215259_100009892977 [0,0,0,0,2,0|2,0,0]=4 4737 B14R1.229 CCCCOCCCNC1CCC1=O 34a_200000211371_100009892977 [0,0,0,0,2,0|2,0,0]=4 4738 B14R1.229 CCCCOCCCOC1CCC1=O 34a_200011215613_100009892977 [0,0,0,0,2,0|2,0,0]=4 4739 B14R1.229 CCCCOCCCOC1CCC1=O 7a_200011215613_100009892977 [0,0,0,0,2,0|2,0,0]=4 4740 B14R1.229 CCCCOCSCCC1CCC1=O 62a_100011995733_200016118888 [0,0,0,0,2,0|2,0,0]=4 4741 B14R1.229 CCCCOCSCCC1CCC1=O 62a_200016118888_100011995733 [0,0,0,0,2,0|2,0,0]=4 4742 B14R1.229 CCCOCCNCCC1CCC1=O 2230a_100161115042_200016118888 [0,0,0,0,2,0|2,0,0]=4 4743 B14R1.229 CCCOCCOCCC1CCC1=O 7a_100000752267_200016118888 [0,0,0,0,2,0|2,0,0]=4 4744 B14R1.229 CCCOCCSCCC1CCC1=O 62a_100011215938_200016118888 [0,0,0,0,2,0|2,0,0]=4 4745 B14R1.229 CCCOCCSCCC1CCC1=O 62a_200016118888_100011215938 [0,0,0,0,2,0|2,0,0]=4 4746 B14R1.229 CCCSCCNCCC1CCC1=O 2230a_100020603323_200016118888 [0,0,0,0,2,0|2,0,0]=4 4747 B14R1.229 CCCSCCOCCC1CCC1=O 7a_200000230433_200016118888 [0,0,0,0,2,0|2,0,0]=4 4748 B14R1.229 CCOCCCNCCC1CCC1=O 2230a_100000210961_200016118888 [0,0,0,0,2,0|2,0,0]=4 4749 B14R1.229 CCOCCCOCCC1CCC1=O 7a_100000757476_200016118888 [0,0,0,0,2,0|2,0,0]=4 4750 B14R1.229 CCOCCCSCCC1CCC1=O 62a_100012232248_200016118888 [0,0,0,0,2,0|2,0,0]=4 4751 B14R1.229 CCOCCCSCCC1CCC1=O 62a_200016118888_100012232248 [0,0,0,0,2,0|2,0,0]=4 4752 B14R1.229 CCSCCCOCCC1CCC1=O 7a_100011216438_200016118888 [0,0,0,0,2,0|2,0,0]=4 4753 B14R1.229 COCCCCCCOC1CCC1=O 34a_200012092642_100009892977 [0,0,0,0,2,0|2,0,0]=4 4754 B14R1.229 COCCCCCCOC1CCC1=O 7a_200012092642_100009892977 [0,0,0,0,2,0|2,0,0]=4 4755 B14R1.229 COCCCCCCSC1CCC1=O 62a_100009892977_100011998445 [0,0,0,0,2,0|2,0,0]=4 4756 B14R1.229 COCCCCCCSC1CCC1=O 62a_100011998445_100009892977 [0,0,0,0,2,0|2,0,0]=4 4757 B14R1.229 COCCCCSCCC1CCC1=O 62a_100000730899_200016118888 [0,0,0,0,2,0|2,0,0]=4 4758 B14R1.229 COCCCCSCCC1CCC1=O 62a_200016118888_100000730899 [0,0,0,0,2,0|2,0,0]=4 4759 B14R1.229 CSCCCCOCCC1CCC1=O 7a_100011217163_200016118888 [0,0,0,0,2,0|2,0,0]=4 4760 B14R1.229 NCCCCCCCOC1CCC1=O 34a_100011996573_100009892977 [0,0,0,0,2,0|2,0,0]=4 4761 B14R1.229 O=C1CCC1CCNCCCCCO 2230a_100000762737_200016118888 [0,0,0,0,2,0|2,0,0]=4 4762 B14R1.229 O=C1CCC1CCOCCCCCBr 7a_100000746331_200016118888 [0,0,0,0,2,0|2,0,0]=4 4763 B14R1.229 O=C1CCC1CCOCCCCCCl 7a_100000746330_200016118888 [0,0,0,0,2,0|2,0,0]=4 4764 B14R1.229 O=C1CCC1CCOCCCCCI 7a_200012148887_200016118888 [0,0,0,0,2,0|2,0,0]=4 4765 B14R1.229 O=C1CCC1CCSCCCCCF 62a_100000729378_200016118888 [0,0,0,0,2,0|2,0,0]=4 4766 B14R1.229 O=C1CCC1CCSCCCCCF 62a_200016118888_100000729378 [0,0,0,0,2,0|2,0,0]=4 4767 B14R1.229 O=C1CCC1CCSCCCCCO 62a_100000746330_200016118888 [0,0,0,0,2,0|2,0,0]=4 4768 B14R1.229 O=C1CCC1CCSCCCCCO 62a_200016118888_100000746330 [0,0,0,0,2,0|2,0,0]=4 4769 B14R1.229 O=C1CCC1NCCCCCCCO 34a_100011996573_100009892977 [0,0,0,0,2,0|2,0,0]=4 4770 B14R1.229 O=C1CCC1OCCCCCCCBr 34a_100000760002_100009892977 [0,0,0,0,2,0|2,0,0]=4 4771 B14R1.229 O=C1CCC1OCCCCCCCBr 7a_100000760002_100009892977 [0,0,0,0,2,0|2,0,0]=4 4772 B14R1.229 O=C1CCC1SCCCCCCCO 62a_100000760002_100009892977 [0,0,0,0,2,0|2,0,0]=4 4773 B14R1.229 O=C1CCC1SCCCCCCCO 62a_100009892977_100000760002 [0,0,0,0,2,0|2,0,0]=4 4774 B14R1.767 CCCCCCCCSC1CC(=O)C1 62a_100009894365_100000210317 [0,0,0,0,2,0|2,0,0]=4 4775 B14R1.767 CCCCCCCNCC1CC(=O)C1 2230a_100000229938_100009874392 [0,0,0,0,2,0|2,0,0]=4 4776 B14R1.767 CCCCCCCOCC1CC(=O)C1 34a_100000101936_100000210614 [0,0,0,0,2,0|2,0,0]=4 4777 B14R1.767 CCCCCCCOCC1CC(=O)C1 7a_100000210272_100009874392 [0,0,0,0,2,0|2,0,0]=4 4778 B14R1.767 CCCCCCCSCC1CC(=O)C1 62a_100000210614_100009874392 [0,0,0,0,2,0|2,0,0]=4 4779 B14R1.767 CCCCCCCSCC1CC(=O)C1 62a_100009874392_100000210316 [0,0,0,0,2,0|2,0,0]=4 4780 B16R0.1192 CCCCCCCCOC(CCl)COC(=O)C 7a_200000139349_100000210759 [0,0,1,0,0,1|2,0,0]=4