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m_207__5506080__134014 [0,1,0,0,0,0|3,0,0]=4 226 B11R0.29 CC(C)CCNCC(O)C(C)O m_207__12526012__134014 [0,1,0,0,0,0|2,0,0]=3 227 B11R0.29 CC(C)CCONC(=O)[C@@H](C)O m_22__13910456__17541882 [0,1,0,0,0,0|2,0,1]=4 228 B11R0.29 CC(C)CCSCC(C)C(C)C m_62__16618958__7021590 [0,1,0,0,0,0|2,1,0]=4 229 B11R0.29 CC(C)CCSCC(O)C(C)C m_7__22987856__11982594 [0,1,0,0,0,0|2,1,0]=4 230 B11R0.29 CC(F)CCNCC(O)C(C)C m_273610__11529660__17609376 [0,1,0,0,0,0|3,0,0]=4 231 B11R0.29 CC(F)CCSCC(C)C(C)C m_62__16618958__13165348 [0,1,0,0,0,0|2,1,0]=4 232 B11R0.29 CC(N)CCSCC(C)C(C)C m_34__20871470__16618956 [0,1,0,0,0,0|2,1,0]=4 233 B11R0.29 CC(N)CCSCC(O)C(C)C m_7__20871360__11982594 [0,1,0,0,0,0|2,1,0]=4 234 B11R0.29 CC(O)CCCNC(=O)[C@@H](C)O m_22__9448666__17541882 [0,1,0,0,0,0|2,0,1]=4 235 B11R0.29 CC(O)CCCNC(C)C(C)C m_269862__9448696__7200270 [0,1,0,0,0,0|3,0,0]=4 236 B11R0.29 CC(O)CCCN[C@@H](C)C(C)C m_2230__22399838__9227836 [0,1,0,0,0,0|3,0,0]=4 237 B11R0.29 CC(O)CCCN[C@H](C)[C@H](C)O m_2230__22400278__9227836 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[0,1,0,0,0,0|1,1,0]=3 263 B11R0.31 CC(C)CCSCCC(C)(F)F m_62__7021584__16619056 [0,1,0,0,0,0|2,1,0]=4 264 B11R0.31 CC(C)CNCCCC(C)(C)O m_207__13972434__121216 [0,1,0,0,0,0|3,0,0]=4 265 B11R0.31 CC(C)SCSCCC(C)(C)O m_7__11758710__12306378 [0,1,0,0,0,0|2,1,0]=4 266 B11R0.31 CC(F)CCNCCC(C)(C)C m_207__10546022__2989446 [0,1,0,0,0,0|3,0,0]=4 267 B11R0.31 CC(F)CCSCCC(C)(C)C m_62__9143140__13165348 [0,1,0,0,0,0|2,1,0]=4 268 B11R0.31 CC(F)CCSCCC(C)(C)F m_62__16725006__13165348 [0,1,0,0,0,0|2,1,0]=4 269 B11R0.31 CC(F)CCSCCC(C)(C)O m_7__11758710__13165340 [0,1,0,0,0,0|1,1,0]=3 270 B11R0.31 CC(F)CCSCCC(C)(F)F m_62__16619054__13165348 [0,1,0,0,0,0|2,1,0]=4 271 B11R0.31 CC(N)CCSCCC(C)(C)C m_34__20871470__9143136 [0,1,0,0,0,0|2,1,0]=4 272 B11R0.31 CC(N)CCSCCC(C)(C)F m_34__20871470__16725002 [0,1,0,0,0,0|2,1,0]=4 273 B11R0.31 CC(N)CCSCCC(C)(C)O m_34__20871470__11686962 [0,1,0,0,0,0|1,1,0]=3 274 B11R0.31 CC(N)CCSCCC(C)(F)F m_34__20871470__16619052 [0,1,0,0,0,0|2,1,0]=4 275 B11R0.31 CC(O)CCCNCC(C)(C)C m_207__9448672__2989454 [0,1,0,0,0,0|3,0,0]=4 276 B11R0.31 CC(O)CCCNCC(C)(C)F m_270004__9448698__17541580 [0,1,0,0,0,0|3,0,0]=4 277 B11R0.31 CC(O)CCCSCC(C)(C)C m_7__9780138__10688172 [0,1,0,0,0,0|3,0,0]=4 278 B11R0.31 CC(O)CCCSCC(C)(C)N m_7__22849170__10688172 [0,1,0,0,0,0|3,0,0]=4 279 B11R0.31 CC(O)CCCSCC(C)(C)O m_7__22987452__10688172 [0,1,0,0,0,0|2,0,0]=3 280 B11R0.31 CC(O)CCNCCC(C)(C)C m_207__4933440__2989446 [0,1,0,0,0,0|2,0,0]=3 281 B11R0.31 CC(O)CCNCCS(=O)(=O)C m_273610__11554168__11516080 [0,1,0,0,0,0|2,0,1]=4 282 B11R0.31 CC(O)CCSCCC(C)(C)C m_62__9143140__12057940 [0,1,0,0,0,0|1,1,0]=3 283 B11R0.31 CC(O)CCSCCC(C)(C)F m_62__16725006__12057940 [0,1,0,0,0,0|1,1,0]=3 284 B11R0.31 CC(O)CCSCCC(C)(C)O m_7__11758710__12057932 [0,1,0,0,0,0|0,1,0]=2 285 B11R0.31 CC(O)CCSCCC(C)(F)F m_62__16619054__12057940 [0,1,0,0,0,0|1,1,0]=3 286 B11R0.31 CC(O)CCSCCC(Cl)(Cl)Cl m_62__12057938__8858000 [0,1,0,0,0,0|2,1,0]=4 287 B11R0.31 CC(O)CCSCCC(F)(F)F m_62__12057938__9399796 [0,1,0,0,0,0|2,1,0]=4 288 B11R0.31 CC(O)CCSCCS(=O)(=O)C m_62__12057938__9458504 [0,1,0,0,0,0|1,1,1]=4 289 B11R0.31 CC(O)CNCCCC(C)(C)C m_273610__11528340__11516404 [0,1,0,0,0,0|3,0,0]=4 290 B11R0.31 CC(O)CNCCCC(C)(C)O m_273610__13972482__11516404 [0,1,0,0,0,0|2,0,0]=3 291 B11R0.31 CC(O)CNCCCC(C)(F)F m_273610__11529766__11516404 [0,1,0,0,0,0|3,0,0]=4 292 B11R0.31 CC(O)CNOCCC(F)(F)F m_273610__11527348__11516404 [0,1,0,0,0,0|3,0,0]=4 293 B11R0.31 CC(O)CSCCCC(C)(C)C m_7__10953796__9106506 [0,1,0,0,0,0|3,0,0]=4 294 B11R0.31 CC(O)CSCCCC(C)(F)F m_7__10953796__13167164 [0,1,0,0,0,0|3,0,0]=4 295 B11R0.31 CN(C)CCSCCC(C)(C)O m_7__11758710__391100 [0,1,0,0,0,0|2,1,0]=4 296 B11R0.31 CS(=O)CCSCCC(C)(C)O m_7__11758710__11566584 [0,1,0,0,0,0|1,1,1]=4 297 B11R0.85 C=C(C)CCN(C)CC[C@H](C)O m_2230__18186218__10158748 [0,1,0,0,0,0|2,0,1]=4 298 B11R0.85 CC(=O)CCN(C)CC[C@H](C)O m_2230__18186218__22368824 [0,1,0,0,0,0|1,0,2]=4 299 B11R0.85 CC(C)CCC(=O)NCC(C)O m_270062__7600310__17779374 [0,1,0,0,0,0|3,0,0]=4 300 B11R0.85 CC(C)CCC(=O)OCC(C)O m_1458__476366__9780094 [0,1,0,0,0,0|3,0,0]=4 301 B11R0.85 CC(C)CCC(C)NCC(C)O m_2230__22397544__9736146 [0,1,0,0,0,0|3,0,0]=4 302 B11R0.85 CC(C)CCC(C)SCC(C)O m_7__10953796__13655716 [0,1,0,0,0,0|3,0,0]=4 303 B11R0.85 CC(C)CCN(C)CCC(C)C m_2230__665438__2463448 [0,1,0,0,0,0|3,0,0]=4 304 B11R0.85 CC(C)CCN(C)CC[C@H](C)O m_2230__18186218__681192 [0,1,0,0,0,0|2,0,0]=3 305 B11R0.85 CC(F)CCN(C)CC[C@H](C)O m_2230__18186218__13165354 [0,1,0,0,0,0|2,0,0]=3 306 B11R0.85 CC(N)CCC(=O)NCC(C)O m_240690__17023110__9360654 [0,1,0,0,0,0|3,0,0]=4 307 B11R0.85 CC(O)CCN(C)CCC(=O)O m_269956__7329822__22419550 [0,1,0,0,0,0|2,0,1]=4 308 B11R0.85 CC(O)CCN(C)CC[C@H](C)O m_2230__18186218__12057944 [0,1,0,0,0,0|1,0,0]=2 309 B11R0.85 CC(O)CNC(C)CCC(C)Cl m_270004__8288774__24723046 [0,1,0,0,0,0|3,0,0]=4 310 B11R0.85 C[C@H](O)CCN(C)CCC(=O)O m_270122__18186296__22563306 [0,1,0,0,0,0|2,0,1]=4 311 B11R0.85 C[C@H](O)CCN(C)CCS(=O)C m_2230__18186218__11566586 [0,1,0,0,0,0|2,0,1]=4 312 B11R0.85 C[C@H](O)CCN(C)CC[C@@H](C)N m_269982__18186278__25012466 [0,1,0,0,0,0|2,0,0]=3 313 B11R0.111 C=C(C)CCNCCC(C)OC m_270004__10740086__24721380 [0,1,0,0,0,0|2,0,1]=4 314 B11R0.111 C=C(C)CCSCCC(C)OC m_7__22987798__10158738 [0,1,0,0,0,0|1,1,1]=4 315 B11R0.111 C=C(C)CCSCCC(O)CC m_62__10158742__16640710 [0,1,0,0,0,0|1,1,1]=4 316 B11R0.111 CC(C)CCCCNC(C)CO m_269862__24383728__15157990 [0,1,0,0,0,0|3,0,0]=4 317 B11R0.111 CC(C)CCCCN[C@H](C)CO m_2230__22399532__22384278 [0,1,0,0,0,0|3,0,0]=4 318 B11R0.111 CC(C)CCCNCC(C)CO m_207__1299194__7912414 [0,1,0,0,0,0|3,0,0]=4 319 B11R0.111 CC(C)CCCNCC(O)CF m_207__13905812__7912414 [0,1,0,0,0,0|3,0,0]=4 320 B11R0.111 CC(C)CCCNCC(O)CO m_207__9465132__7912414 [0,1,0,0,0,0|3,0,0]=4 321 B11R0.111 CC(C)CCCNC[C@H](O)CF m_273610__11521056__14323916 [0,1,0,0,0,0|3,0,0]=4 322 B11R0.111 CC(C)CCCSCC(C)CO m_7__8333108__7968760 [0,1,0,0,0,0|3,0,0]=4 323 B11R0.111 CC(C)CCCSCC(O)CF m_63__8333112__13936424 [0,1,0,0,0,0|3,0,0]=4 324 B11R0.111 CC(C)CCCSCC(O)CO m_7__8333108__3173190 [0,1,0,0,0,0|3,0,0]=4 325 B11R0.111 CC(C)CCNCCC(C)CO m_207__24471928__134014 [0,1,0,0,0,0|2,0,0]=3 326 B11R0.111 CC(C)CCNCC[C@@H](O)CO m_207__14590488__134014 [0,1,0,0,0,0|2,0,0]=3 327 B11R0.111 CC(C)CNCCCC(C)CO m_207__7874660__121216 [0,1,0,0,0,0|3,0,0]=4 328 B11R0.111 CC(O)CCCCCC(=O)NO m_527__388132__11982798 [0,1,0,0,0,0|2,0,1]=4 329 B11R0.111 CC(O)CCCNC[C@H](O)CF m_273610__11554480__14323916 [0,1,0,0,0,0|2,0,0]=3 330 B11R0.111 CC(O)CCCSCC(C)CO m_7__6078536__10688172 [0,1,0,0,0,0|2,0,0]=3 331 B11R0.111 CC(O)CCCSCC(O)CO m_7__6554250__10688172 [0,1,0,0,0,0|2,0,0]=3 332 B11R0.111 CC(O)CNCCCC(C)CO m_273610__11525942__11516404 [0,1,0,0,0,0|2,0,0]=3 333 B11R0.111 CCC(C)CCNCCC(C)C m_207__11970558__134014 [0,1,0,0,0,0|3,0,0]=4 334 B11R0.111 CCC(C)CCSCCC(C)C m_62__7021584__20058294 [0,1,0,0,0,0|2,1,0]=4 335 B11R0.111 CCC(C)CCSCCC(C)F m_62__13165346__20058294 [0,1,0,0,0,0|2,1,0]=4 336 B11R0.111 CCC(C)CCSCCC(C)N m_34__20871470__20058330 [0,1,0,0,0,0|2,1,0]=4 337 B11R0.111 CCC(C)CCSCCC(C)O m_62__12057938__20058294 [0,1,0,0,0,0|1,1,0]=3 338 B11R0.111 CCC(C)CNCCCC(C)O m_207__9448672__7687310 [0,1,0,0,0,0|3,0,0]=4 339 B11R0.111 CCC(C)CSCCCC(C)O m_7__7022538__10688172 [0,1,0,0,0,0|3,0,0]=4 340 B11R0.111 CCC(O)CCNCCC(C)C m_207__7143330__134014 [0,1,0,0,0,0|2,0,0]=3 341 B11R0.111 CCC(O)CCON=CC(C)C m_34__19446766__16640704 [0,1,0,0,0,0|2,0,1]=4 342 B11R0.111 CCC(O)CCSCCC(C)C m_62__7021584__16640710 [0,1,0,0,0,0|1,1,0]=3 343 B11R0.111 CCC(O)CCSCCC(C)F m_62__13165346__16640710 [0,1,0,0,0,0|1,1,0]=3 344 B11R0.111 CCC(O)CCSCCC(C)N m_34__20871470__16640704 [0,1,0,0,0,0|1,1,0]=3 345 B11R0.111 CCC(O)CCSCCC(C)O m_62__12057938__16640710 [0,1,0,0,0,0|0,1,0]=2 346 B11R0.111 CCC(O)CCSCCC(F)F m_7__22986868__16640702 [0,1,0,0,0,0|2,1,0]=4 347 B11R0.111 CCC(O)CCSCCN(C)C m_7__6950568__16640702 [0,1,0,0,0,0|2,1,0]=4 348 B11R0.111 CCC(O)CNCCCC(C)C m_207__11354014__7912414 [0,1,0,0,0,0|3,0,0]=4 349 B11R0.111 CCC(O)CNCCCC(C)O m_273610__11554480__11516276 [0,1,0,0,0,0|2,0,0]=3 350 B11R0.111 CCC(O)CSCCCC(C)C m_63__8333112__9043956 [0,1,0,0,0,0|3,0,0]=4 351 B11R0.111 CCC(O)CSCCCC(C)O m_7__22988104__10688172 [0,1,0,0,0,0|2,0,0]=3 352 B11R0.111 CCN(C)CCSCCC(C)O m_7__14769896__12057932 [0,1,0,0,0,0|2,1,0]=4 353 B11R0.111 CC[C@H](N)CSCCCC(C)O m_7__20871354__10688172 [0,1,0,0,0,0|3,0,0]=4 354 B11R0.111 CNC(=O)CCCCCC(C)O m_22__387492__11982908 [0,1,0,0,0,0|1,0,2]=4 355 B11R0.111 COC(=O)CCCCCC(C)O m_1458__11982576__483916 [0,1,0,0,0,0|1,0,2]=4 356 B11R0.111 COC(=O)CCSCCC(C)O m_7__27270__12057932 [0,1,0,0,0,0|0,1,2]=4 357 B11R0.111 COC(C)CCCNCC(C)C m_270004__25073126__8127718 [0,1,0,0,0,0|3,0,0]=4 358 B11R0.111 COC(C)CCNCCC(C)C m_207__10742040__134014 [0,1,0,0,0,0|2,0,0]=3 359 B11R0.111 COC(C)CCNCCC(C)F m_270004__10546066__24721380 [0,1,0,0,0,0|2,0,0]=3 360 B11R0.111 COC(C)CCNCCC(C)O m_270004__8296476__24721380 [0,1,0,0,0,0|1,0,0]=2 361 B11R0.111 COC(C)CCNCCC(Cl)Cl m_270004__23845876__24721380 [0,1,0,0,0,0|3,0,0]=4 362 B11R0.111 COC(C)CCNCCC(F)F m_270004__13943058__24721380 [0,1,0,0,0,0|3,0,0]=4 363 B11R0.111 COC(C)CCNCCN(C)C m_270004__9143630__24721380 [0,1,0,0,0,0|3,0,0]=4 364 B11R0.111 COC(C)CCNCCS(=O)C m_270004__8296826__24721380 [0,1,0,0,0,0|2,0,1]=4 365 B11R0.111 COC(C)CCSCCC(=O)C m_7__22987798__107330 [0,1,0,0,0,0|0,1,2]=4 366 B11R0.111 COC(C)CCSCCC(C)C m_7__22987798__102951 [0,1,0,0,0,0|1,1,0]=3 367 B11R0.111 COC(C)CCSCCC(C)F m_7__22987798__13165340 [0,1,0,0,0,0|1,1,0]=3 368 B11R0.111 COC(C)CCSCCC(C)O m_7__22987798__12057932 [0,1,0,0,0,0|0,1,0]=2 369 B11R0.111 COC(C)CCSCCN(C)C m_7__22987798__391100 [0,1,0,0,0,0|2,1,0]=4 370 B11R0.111 COC(C)CCSCCS(=O)C m_7__22987798__11566584 [0,1,0,0,0,0|1,1,1]=4 371 B11R0.111 COC(C)CCSCSC(C)C m_7__22987798__12306378 [0,1,0,0,0,0|2,1,0]=4 372 B11R0.111 COC(C)CNCCCC(C)C m_207__9164142__7912414 [0,1,0,0,0,0|3,0,0]=4 373 B11R0.111 COC(C)CSCCCC(C)C m_62__10892842__8738872 [0,1,0,0,0,0|3,0,0]=4 374 B11R0.111 COC(C)CSCCCC(C)O m_7__22986820__10688172 [0,1,0,0,0,0|2,0,0]=3 375 B11R0.111 CON(C)CCCCCC(C)C m_2230__679026__22383874 [0,1,0,0,0,0|3,0,0]=4 376 B11R0.111 CON(C)CCCNCC(C)O m_273610__13859400__11516404 [0,1,0,0,0,0|3,0,0]=4 377 B11R0.111 CON(C)CCNCCC(C)C m_207__12052888__134014 [0,1,0,0,0,0|3,0,0]=4 378 B11R0.111 CON(C)CCOCCC(=O)C m_2230__679026__22368848 [0,1,0,0,0,0|1,0,2]=4 379 B11R0.111 CON(C)CCOCCC(C)C m_2230__679026__1160064 [0,1,0,0,0,0|2,0,0]=3 380 B11R0.111 CON(C)CCOCCN(C)C m_2230__679026__22379714 [0,1,0,0,0,0|3,0,0]=4 381 B11R0.111 CSC(C)CCNCCC(C)C m_207__2730222__134014 [0,1,0,0,0,0|2,1,0]=4 382 B11R0.111 CSC(C)CCNCCC(C)F m_270004__10546066__24721392 [0,1,0,0,0,0|2,1,0]=4 383 B11R0.111 CSC(C)CCNCCC(C)O m_270004__8296476__24721392 [0,1,0,0,0,0|1,1,0]=3 384 B11R1.75 C=C(C)CCN1CC[C@@H](C1)O m_2230__3351214__10158748 [0,0,0,1,0,0|2,0,1]=4 385 B11R1.75 C=C1CCN(C1)CCC(C)O m_2230__13656258__12057944 [0,0,0,1,0,0|2,0,1]=4 386 B11R1.75 CC(=O)CCN1CC[C@@H](C1)O m_2230__3351214__22368824 [0,0,0,1,0,0|1,0,2]=4 387 B11R1.75 CC(C)CCN1CCC(C1)C m_2230__6813990__681192 [0,0,0,1,0,0|3,0,0]=4 388 B11R1.75 CC(C)CCN1CC[C@@H](C1)F m_2230__10719192__681192 [0,0,0,1,0,0|3,0,0]=4 389 B11R1.75 CC(C)CCN1CC[C@@H](C1)O m_2230__3351214__681192 [0,0,0,1,0,0|2,0,0]=3 390 B11R1.75 CC(C)CCN1CC[C@H](C1)F m_2230__10719368__681192 [0,0,0,1,0,0|3,0,0]=4 391 B11R1.75 CC(C)CCN1CC[C@H](C1)N m_269982__7368756__7393366 [0,0,0,1,0,0|3,0,0]=4 392 B11R1.75 CC(C)CN[C@@H]1CC[C@@H](C1)O m_207__11714036__121216 [0,0,0,1,0,0|3,0,0]=4 393 B11R1.75 CC(C)CN[C@H]1CC[C@@H](C1)O m_270004__24793980__8127718 [0,0,0,1,0,0|3,0,0]=4 394 B11R1.75 CC(C)CN[C@H]1CC[C@H](C1)O m_207__21695440__121216 [0,0,0,1,0,0|3,0,0]=4 395 B11R1.75 CC(C)CSC1CCC(C1)O m_7__17795750__1010132 [0,0,0,1,0,0|3,0,0]=4 396 B11R1.75 CC(C)NCC1CCC(C1)O m_269862__9226058__7204804 [0,0,0,1,0,0|3,0,0]=4 397 B11R1.75 CC(F)CCN1CCC(C1)C m_2230__6813990__13165354 [0,0,0,1,0,0|3,0,0]=4 398 B11R1.75 CC(F)CCN1CC[C@@H](C1)F m_2230__10719192__13165354 [0,0,0,1,0,0|3,0,0]=4 399 B11R1.75 CC(F)CCN1CC[C@@H](C1)O m_2230__3351214__13165354 [0,0,0,1,0,0|2,0,0]=3 400 B11R1.75 CC(F)CCN1CC[C@H](C1)F m_2230__10719368__13165354 [0,0,0,1,0,0|3,0,0]=4 401 B11R1.75 CC(F)CCN1CC[C@H](C1)N m_269982__7368756__13165362 [0,0,0,1,0,0|3,0,0]=4 402 B11R1.75 CC(O)CCN1CCC(C1)C m_2230__6813990__12057944 [0,0,0,1,0,0|2,0,0]=3 403 B11R1.75 CC(O)CCN1CC[C@@H](C1)F m_2230__10719192__12057944 [0,0,0,1,0,0|2,0,0]=3 404 B11R1.75 CC(O)CCN1CC[C@@H](C1)O m_2230__3351214__12057944 [0,0,0,1,0,0|1,0,0]=2 405 B11R1.75 CC(O)CCN1CC[C@H](C1)F m_2230__10719368__12057944 [0,0,0,1,0,0|2,0,0]=3 406 B11R1.75 CC(O)CCN1CC[C@H](C1)N m_269982__7368756__22488918 [0,0,0,1,0,0|2,0,0]=3 407 B11R1.75 CC1CCN(C1)CC[C@@H](C)N m_269982__7372840__25012466 [0,0,0,1,0,0|3,0,0]=4 408 B11R1.75 CS(=O)CCN1CC[C@@H](C1)O m_2230__3351214__11566586 [0,0,0,1,0,0|2,0,1]=4 409 B11R1.75 C[C@@H](N)CCN1CC[C@@H](C1)O m_269982__13594114__25012466 [0,0,0,1,0,0|2,0,0]=3 410 B11R1.75 C[C@@H](N)CCN1CC[C@H](C1)F m_269982__17669062__25012466 [0,0,0,1,0,0|3,0,0]=4 411 B11R1.75 C[C@@H](N)CCN1CC[C@H](C1)N m_269982__7368756__25012466 [0,0,0,1,0,0|3,0,0]=4 412 B11R1.75 O=C(O)CCN1CC[C@@H](C1)O m_270122__17675304__22563306 [0,0,0,1,0,0|2,0,1]=4 413 B11R1.102 CC(C)CCCN[C@@H]1C[C@H]1O m_207__23835494__7912414 [0,0,0,1,0,0|3,0,0]=4 414 B11R1.102 CC(C)CCNCC1CC1C m_207__746348__134014 [0,0,0,1,0,0|3,0,0]=4 415 B11R1.102 CC(C)CCNCC1CC1Cl m_207__18333420__134014 [0,0,0,1,0,0|3,0,0]=4 416 B11R1.102 CC(C)CCNC[C@@H]1C[C@H]1C m_207__16491682__134014 [0,0,0,1,0,0|3,0,0]=4 417 B11R1.102 CC(C)CCSCC1CC1Br m_7__22987856__15765428 [0,0,0,1,0,0|2,1,0]=4 418 B11R1.102 CC(C)CCSCC1CC1C m_62__7021584__12216594 [0,0,0,1,0,0|2,1,0]=4 419 B11R1.102 CC(C)CCSC[C@@H]1C[C@H]1C m_62__7021584__23861442 [0,0,0,1,0,0|2,1,0]=4 420 B11R1.102 CC(F)CCSC[C@@H]1C[C@H]1C m_62__13165346__23861442 [0,0,0,1,0,0|2,1,0]=4 421 B11R1.102 CC(N)CCSC[C@@H]1C[C@H]1C m_34__20871470__23861436 [0,0,0,1,0,0|2,1,0]=4 422 B11R1.102 CC(O)CCSC[C@@H]1C[C@H]1C m_62__12057938__23861442 [0,0,0,1,0,0|1,1,0]=3 423 B11R1.154 CC(C)C=NOC1CC(C1)O m_34__19446766__17696138 [0,0,0,1,0,0|2,0,1]=4 424 B11R1.154 CC(C)CCNC1CC(C1)C m_269862__7192680__8852816 [0,0,0,1,0,0|3,0,0]=4 425 B11R1.154 CC(C)CCNC1CC(C1)O m_207__20075630__134014 [0,0,0,1,0,0|2,0,0]=3 426 B11R1.154 CC(C)CCN[C@H]1C[C@@H](C1)C m_207__22435044__134014 [0,0,0,1,0,0|3,0,0]=4 427 B11R1.154 CC(C)CCSC1CC(C1)O m_7__22987856__10953812 [0,0,0,1,0,0|1,1,0]=3 428 B11R1.154 CC(C)CNCC1CC(C1)O m_207__12309036__121216 [0,0,0,1,0,0|3,0,0]=4 429 B11R1.154 CC(C)NCC[C@H]1C[C@H](C1)O m_269862__17837642__7204804 [0,0,0,1,0,0|3,0,0]=4 430 B11R1.154 CC(F)CCNC1CC(C1)C m_269862__10546064__8852816 [0,0,0,1,0,0|3,0,0]=4 431 B11R1.154 CC(N)CCSC1CC(C1)O m_34__20871470__17696138 [0,0,0,1,0,0|1,1,0]=3 432 B11R1.154 CC(O)CCCN1CC(C1)F m_2230__15542798__9227836 [0,0,0,1,0,0|3,0,0]=4 433 B11R1.154 CC(O)CCNC1CC(C1)C m_269862__7198110__8852816 [0,0,0,1,0,0|2,0,0]=3 434 B11R1.154 CC(O)CNCC1CC(C1)C m_273610__12156676__11516404 [0,0,0,1,0,0|3,0,0]=4 435 B11R1.154 CC(O)CNCC1CC(C1)F m_273610__13970780__11516404 [0,0,0,1,0,0|3,0,0]=4 436 B11R1.154 CC(O)CNCC1CC(C1)O m_273610__12309062__11516404 [0,0,0,1,0,0|2,0,0]=3 437 B11R1.154 CC(O)CSCC1CC(C1)C m_7__10953796__13451104 [0,0,0,1,0,0|3,0,0]=4 438 B11R1.154 CC(O)CSCC1CC(C1)F m_7__10953796__13773712 [0,0,0,1,0,0|3,0,0]=4 439 B11R1.154 CC(O)CSCC1CC(C1)N m_7__20871408__10902704 [0,0,0,1,0,0|3,0,0]=4 440 B11R1.154 CN(C)CCSC1CC(C1)O m_7__6950568__10953812 [0,0,0,1,0,0|2,1,0]=4 441 B11R1.154 OC1CC(C1)SCCC(F)F m_7__22986868__10953812 [0,0,0,1,0,0|2,1,0]=4 442 B11R1.157 CC(C)CC1CN(CCO1)C m_2230__22407200__2463448 [0,0,0,1,0,0|3,0,0]=4 443 B11R1.157 CC(C)CN1CCCC(C1)O m_2230__678744__681214 [0,0,0,1,0,0|3,0,0]=4 444 B11R1.157 CC(C)NC1CCCC(C1)O m_269862__7194894__7204804 [0,0,0,1,0,0|3,0,0]=4 445 B11R1.157 CC(C)S[C@@H]1CCC[C@@H](C1)O m_7__17656074__5048 [0,0,0,1,0,0|3,0,0]=4 446 B11R1.157 CC(F)CN1CCCC(C1)O m_2230__678744__16970752 [0,0,0,1,0,0|3,0,0]=4 447 B11R1.157 CC(O)CN1CCCC(C1)C m_2230__678730__9736146 [0,0,0,1,0,0|3,0,0]=4 448 B11R1.157 CC(O)CN1CCCC(C1)F m_2230__13466020__9736146 [0,0,0,1,0,0|3,0,0]=4 449 B11R1.157 CC(O)CN1CCCC(C1)O m_2230__678744__9736146 [0,0,0,1,0,0|2,0,0]=3 450 B11R1.157 CC(O)CN1CCC[C@@H](C1)N m_269982__13151830__13193380 [0,0,0,1,0,0|3,0,0]=4 451 B11R1.157 C[C@H](N)CN1CCCC(C1)O m_269982__11723266__25012480 [0,0,0,1,0,0|3,0,0]=4 452 B11R1.176 CC(C)CCNCCC1CC1 m_207__6108200__134014 [0,0,0,1,0,0|3,0,0]=4 453 B11R1.176 CC(C)CCSCCC1CC1 m_62__7021584__9143162 [0,0,0,1,0,0|2,1,0]=4 454 B11R1.176 CC(F)CCNCCC1CC1 m_270004__10546066__13455800 [0,0,0,1,0,0|3,0,0]=4 455 B11R1.176 CC(F)CCSCCC1CC1 m_62__13165346__9143162 [0,0,0,1,0,0|2,1,0]=4 456 B11R1.176 CC(N)CCSCCC1CC1 m_34__20871470__9143156 [0,0,0,1,0,0|2,1,0]=4 457 B11R1.176 CC(O)CCCNCC1CC1 m_207__9448672__2989440 [0,0,0,1,0,0|3,0,0]=4 458 B11R1.176 CC(O)CCCSCC1CC1 m_7__10390288__10688172 [0,0,0,1,0,0|3,0,0]=4 459 B11R1.176 CC(O)CCNCCC1CC1 m_270004__8296476__13455800 [0,0,0,1,0,0|2,0,0]=3 460 B11R1.176 CC(O)CCSCCC1CC1 m_62__12057938__9143162 [0,0,0,1,0,0|1,1,0]=3 461 B11R1.176 CC(O)CNCCCC1CC1 m_273610__12100314__11516404 [0,0,0,1,0,0|3,0,0]=4 462 B11R1.176 CC(O)CSCCCC1CC1 m_7__10953796__16975596 [0,0,0,1,0,0|3,0,0]=4 463 B11R1.176 CS(=O)CCOCCC1CC1 m_265282__17591352__4273530 [0,0,0,1,0,0|2,0,1]=4 464 B11R1.177 CN(C)[C@H]1CCCC[C@]1(C)O m_2230__22408990__2463448 [0,0,0,1,0,0|3,0,0]=4 465 B11R1.234 CC(C)NC1CCCC1(C)O m_2230__13973604__680832 [0,0,0,1,0,0|3,0,0]=4 466 B11R1.234 CC(O)CN1CCCC1(C)C m_2230__5789082__9736146 [0,0,0,1,0,0|3,0,0]=4 467 B11R1.497 CC(C)C1COCCN(C1)C m_2230__15428036__2463448 [0,0,0,1,0,0|3,0,0]=4 468 B11R1.708 CC(C)CN1CCC1C(C)O m_270004__24177142__8127718 [0,0,0,1,0,0|3,0,0]=4 469 B11R1.708 CC(O)CN1CCC1C(C)C m_63__8755190__10903854 [0,0,0,1,0,0|3,0,0]=4 470 B11R1.711 CC(C)CN[C@H]1C[C@@H]1C(C)O m_207__17314814__121216 [0,0,0,1,0,0|3,0,0]=4 471 B11R1.711 CC(O)CN[C@H]1C[C@@H]1C(C)C m_273610__11530344__11516404 [0,0,0,1,0,0|3,0,0]=4 472 B11R1.922 CC(O)CNC1CCC1(C)C m_2230__10738242__9736146 [0,0,0,1,0,0|3,0,0]=4 473 B11R1.923 CC(C)CCNC1CC1(C)C m_207__1198750__134014 [0,0,0,1,0,0|3,0,0]=4 474 B11R1.923 CC(O)CNCC1CC1(C)C m_273610__11522694__11516404 [0,0,0,1,0,0|3,0,0]=4 475 B9R0.55 C=C(C)CCNCC(C)O m_273610__11529954__11516404 [0,0,0,0,1,0|2,0,1]=4 476 B9R0.55 C=C(C)CCSCC(C)O m_7__10953796__10158738 [0,0,0,0,1,0|1,1,1]=4 477 B9R0.55 C=C(C)CSCCC(C)O m_62__6464432__12057940 [0,0,0,0,1,0|1,1,1]=4 478 B9R0.55 CC(=O)CCSCC(C)O m_7__10953796__107330 [0,0,0,0,1,0|0,1,2]=4 479 B9R0.55 CC(=O)NCCCC(C)O m_270062__16413862__15585492 [0,0,0,0,1,0|1,0,2]=4 480 B9R0.55 CC(=O)NOCCC(C)O m_270062__21889814__15585492 [0,0,0,0,1,0|1,0,2]=4 481 B9R0.55 CC(=O)OCCCC(C)O m_1458__473186__9475682 [0,0,0,0,1,0|1,0,2]=4 482 B9R0.55 CC(C)CCCCN(C)C m_2230__22405628__2463448 [0,0,0,0,1,0|3,0,0]=4 483 B9R0.55 CC(C)CCCNC(C)C m_269862__8257596__7204804 [0,0,0,0,1,0|3,0,0]=4 484 B9R0.55 CC(C)CCCSC(C)C m_62__10892842__2390352 [0,0,0,0,1,0|3,0,0]=4 485 B9R0.55 CC(C)CCNCC(C)C m_207__109450__134014 [0,0,0,0,1,0|3,0,0]=4 486 B9R0.55 CC(C)CCNCC(C)O m_207__109407__134014 [0,0,0,0,1,0|2,0,0]=3 487 B9R0.55 CC(C)CCSCC(C)C m_62__7021584__2558630 [0,0,0,0,1,0|2,1,0]=4 488 B9R0.55 CC(C)CCSCC(C)F m_62__7021584__16913488 [0,0,0,0,1,0|2,1,0]=4 489 B9R0.55 CC(C)CCSCC(C)O m_7__22987856__10902704 [0,0,0,0,1,0|1,1,0]=3 490 B9R0.55 CC(C)CCSC[C@H](C)N m_7__20871336__102951 [0,0,0,0,1,0|2,1,0]=4 491 B9R0.55 CC(C)CNCCC(C)F m_207__10546022__121216 [0,0,0,0,1,0|3,0,0]=4 492 B9R0.55 CC(C)CNCCC(C)O m_207__4933440__121216 [0,0,0,0,1,0|2,0,0]=3 493 B9R0.55 CC(C)CONCC(C)O m_273610__11525656__11516404 [0,0,0,0,1,0|2,0,0]=3 494 B9R0.55 CC(C)CSCCC(C)F m_62__13165346__2558630 [0,0,0,0,1,0|2,1,0]=4 495 B9R0.55 CC(C)CSCCC(C)N m_34__20871470__6894142 [0,0,0,0,1,0|2,1,0]=4 496 B9R0.55 CC(C)CSCCC(C)O m_62__12057938__2558630 [0,0,0,0,1,0|1,1,0]=3 497 B9R0.55 CC(F)CCSCC(C)F m_62__13165346__16913488 [0,0,0,0,1,0|2,1,0]=4 498 B9R0.55 CC(F)CCSC[C@H](C)N m_7__20871336__13165340 [0,0,0,0,1,0|2,1,0]=4 499 B9R0.55 CC(N)CCSCC(C)F m_34__20871470__16970748 [0,0,0,0,1,0|2,1,0]=4 500 B9R0.55 CC(N)CCSCC(C)O m_7__20871360__10902704 [0,0,0,0,1,0|1,1,0]=3 501 B9R0.55 CC(O)CCCNC(C)C m_269862__9448696__7204804 [0,0,0,0,1,0|2,0,0]=3 502 B9R0.55 CC(O)CCNCC(C)O m_273610__11554168__11516404 [0,0,0,0,1,0|1,0,0]=2 503 B9R0.55 CC(O)CCSCC(=O)O m_7__26823__12057932 [0,0,0,0,1,0|1,1,1]=4 504 B9R0.55 CC(O)CCSCC(C)F m_62__12057938__16913488 [0,0,0,0,1,0|1,1,0]=3 505 B9R0.55 CC(O)CCSCC(C)O m_7__10953796__12057932 [0,0,0,0,1,0|0,1,0]=2 506 B9R0.55 CC(O)CCSCC(F)F m_7__22987700__12057932 [0,0,0,0,1,0|2,1,0]=4 507 B9R0.55 CC(O)CCSC[C@H](C)N m_7__20871336__12057932 [0,0,0,0,1,0|1,1,0]=3 508 B9R0.55 CC(O)CNCCC(C)F m_273610__11529660__11516404 [0,0,0,0,1,0|2,0,0]=3 509 B9R0.55 CC(O)CNCCC(Cl)Cl m_273610__23816588__11516404 [0,0,0,0,1,0|3,0,0]=4 510 B9R0.55 CC(O)CNCCC(F)F m_273610__13857570__11516404 [0,0,0,0,1,0|3,0,0]=4 511 B9R0.55 CC(O)CNCCN(C)C m_273610__13857018__11516404 [0,0,0,0,1,0|3,0,0]=4 512 B9R0.55 CC(O)CNCCS(=O)C m_273610__11522046__11516404 [0,0,0,0,1,0|2,0,1]=4 513 B9R0.55 CC(O)CSCCC(C)F m_7__10953796__13165340 [0,0,0,0,1,0|1,1,0]=3 514 B9R0.55 CC(O)CSCCC(F)F m_7__22986868__10902704 [0,0,0,0,1,0|2,1,0]=4 515 B9R0.55 CC(O)CSCCN(C)C m_7__10953796__391100 [0,0,0,0,1,0|2,1,0]=4 516 B9R0.55 CC(O)CSCCS(=O)C m_7__10953796__11566584 [0,0,0,0,1,0|1,1,1]=4 517 B9R0.55 CC(O)CSCSC(C)C m_7__10953796__12306378 [0,0,0,0,1,0|2,1,0]=4 518 B11R0.30 C=C(C)CCCCNCC(C)O m_270004__8288774__23155964 [0,0,0,0,0,1|2,0,1]=4 519 B11R0.30 C=C(C)CCCNCCC(C)O m_270004__8296476__23155958 [0,0,0,0,0,1|2,0,1]=4 520 B11R0.30 C=C(C)CCCSCCC(C)O m_62__13608160__12057940 [0,0,0,0,0,1|1,1,1]=4 521 B11R0.30 CC(=CCCSCCC(C)O)C m_62__12121620__12057940 [0,0,0,0,0,1|1,1,1]=4 522 B11R0.30 CC(=O)CCCCSCC(C)O m_7__10953796__322716 [0,0,0,0,0,1|1,0,2]=4 523 B11R0.30 CC(=O)NCCOCCC(C)C m_270062__7607990__15585492 [0,0,0,0,0,1|1,0,2]=4 524 B11R0.30 CC(=O)NCCSCCC(C)O m_7__17756534__12057932 [0,0,0,0,0,1|0,1,2]=4 525 B11R0.30 CC(=O)OCCOCCC(C)C m_276436__14076890__14088324 [0,0,0,0,0,1|1,0,2]=4 526 B11R0.30 CC(C)CCCCCNC(C)C m_269862__21496978__7204804 [0,0,0,0,0,1|3,0,0]=4 527 B11R0.30 CC(C)CCCCNCC(C)C m_207__24383722__121216 [0,0,0,0,0,1|3,0,0]=4 528 B11R0.30 CC(C)CCCCNCC(C)F m_270004__13461138__12202092 [0,0,0,0,0,1|3,0,0]=4 529 B11R0.30 CC(C)CCCCNCC(C)O m_273610__24383694__11516404 [0,0,0,0,0,1|2,0,0]=3 530 B11R0.30 CC(C)CCCNCCC(C)C m_207__3310150__134014 [0,0,0,0,0,1|3,0,0]=4 531 B11R0.30 CC(C)CCCNCCC(C)F m_207__10546022__7912414 [0,0,0,0,0,1|3,0,0]=4 532 B11R0.30 CC(C)CCCNCCC(C)O m_207__4933440__7912414 [0,0,0,0,0,1|2,0,0]=3 533 B11R0.30 CC(C)CCCSCCC(C)C m_62__10892842__7021590 [0,0,0,0,0,1|2,1,0]=4 534 B11R0.30 CC(C)CCCSCCC(C)F m_62__10892842__13165348 [0,0,0,0,0,1|2,1,0]=4 535 B11R0.30 CC(C)CCCSCCC(C)N m_34__20871470__10892838 [0,0,0,0,0,1|2,1,0]=4 536 B11R0.30 CC(C)CCCSCCC(C)O m_62__10892842__12057940 [0,0,0,0,0,1|1,1,0]=3 537 B11R0.30 CC(C)CCNCCCC(C)O m_207__9448672__134014 [0,0,0,0,0,1|2,0,0]=3 538 B11R0.30 CC(C)CCNCCOC(C)C m_207__8750450__134014 [0,0,0,0,0,1|3,0,0]=4 539 B11R0.30 CC(C)CCNCCSC(C)C m_207__10176190__134014 [0,0,0,0,0,1|3,0,0]=4 540 B11R0.30 CC(C)CCOCCNC(C)C m_269862__7196032__7204804 [0,0,0,0,0,1|2,0,0]=3 541 B11R0.30 CC(C)CCOCCSC(C)C m_62__15357102__2390352 [0,0,0,0,0,1|2,0,0]=3 542 B11R0.30 CC(C)CCSCCCC(C)O m_7__22987856__10688172 [0,0,0,0,0,1|1,1,0]=3 543 B11R0.30 CC(C)CCSCCOC(C)C m_62__7021584__503040 [0,0,0,0,0,1|2,1,0]=4 544 B11R0.30 CC(C)CCSCCSC(C)C m_62__7021584__10158466 [0,0,0,0,0,1|2,1,0]=4 545 B11R0.30 CC(C)CCSCOCC(C)C m_7__22987856__12637718 [0,0,0,0,0,1|2,1,0]=4 546 B11R0.30 CC(C)CCSCSCC(C)C m_7__22987856__15703842 [0,0,0,0,0,1|2,1,0]=4 547 B11R0.30 CC(C)COCCNCC(C)O m_273610__11519020__11516404 [0,0,0,0,0,1|3,0,0]=4 548 B11R0.30 CC(C)COCCSCC(C)O m_7__22987970__10902704 [0,0,0,0,0,1|3,0,0]=4 549 B11R0.30 CC(C)COCSCCC(C)N m_7__20871360__12637718 [0,0,0,0,0,1|2,1,0]=4 550 B11R0.30 CC(C)CSCCNCC(C)O m_273610__11525884__11516404 [0,0,0,0,0,1|3,0,0]=4 551 B11R0.30 CC(C)CSCCSCC(C)O m_7__10953796__7912560 [0,0,0,0,0,1|3,0,0]=4 552 B11R0.30 CC(C)CSCSCCC(C)N m_7__20871360__15703842 [0,0,0,0,0,1|2,1,0]=4 553 B11R0.30 CC(C)NCCOCCN(C)C m_269862__9208284__7204804 [0,0,0,0,0,1|3,0,0]=4 554 B11R0.30 CC(F)CCSCCOC(C)C m_62__13165346__503040 [0,0,0,0,0,1|2,1,0]=4 555 B11R0.30 CC(F)CCSCCSC(C)C m_62__13165346__10158466 [0,0,0,0,0,1|2,1,0]=4 556 B11R0.30 CC(N)CCSCCCC(C)O m_7__20871360__10688172 [0,0,0,0,0,1|1,1,0]=3 557 B11R0.30 CC(N)CCSCCOC(C)C m_34__20871470__8962500 [0,0,0,0,0,1|2,1,0]=4 558 B11R0.30 CC(N)CCSCCSC(C)C m_34__20871470__10158464 [0,0,0,0,0,1|2,1,0]=4 559 B11R0.30 CC(O)CCCSCCC(F)F m_7__22986868__10688172 [0,0,0,0,0,1|2,1,0]=4 560 B11R0.30 CC(O)CCCSCCN(C)C m_7__6950568__10688172 [0,0,0,0,0,1|2,1,0]=4 561 B11R0.30 CC(O)CCSCCCC(Cl)Cl m_62__12057938__23915480 [0,0,0,0,0,1|2,1,0]=4 562 B11R0.30 CC(O)CCSCCCC(F)F m_62__12057938__18239798 [0,0,0,0,0,1|2,1,0]=4 563 B11R0.30 CC(O)CCSCCCN(C)C m_7__15765946__12057932 [0,0,0,0,0,1|2,1,0]=4 564 B11R0.30 CC(O)CCSCCOC(C)C m_62__12057938__503040 [0,0,0,0,0,1|1,1,0]=3 565 B11R0.30 CC(O)CCSCCOC(F)F m_62__12057938__13445084 [0,0,0,0,0,1|2,1,0]=4 566 B11R0.30 CC(O)CCSCCSC(C)C m_62__12057938__10158466 [0,0,0,0,0,1|1,1,0]=3 567 B11R0.30 CC(O)CNCCCCC(F)F m_273610__21500272__11516404 [0,0,0,0,0,1|3,0,0]=4 568 B11R0.30 CC(O)CNCCCCN(C)C m_273610__13857160__11516404 [0,0,0,0,0,1|3,0,0]=4 569 B11R0.30 CC(O)CNCCCOC(C)C m_273610__11516532__11516404 [0,0,0,0,0,1|3,0,0]=4 570 B11R0.30 CC(O)CNOCCOC(C)C m_273610__11529470__11516404 [0,0,0,0,0,1|2,0,0]=3 571 B11R0.30 CC(O)CSCCCCN(C)C m_7__10953796__22787544 [0,0,0,0,0,1|3,0,0]=4 572 B11R0.30 CC(O)CSCCCOC(C)C m_7__10953796__5631256 [0,0,0,0,0,1|3,0,0]=4 573 B11R0.30 C[C@@H](O)CNCCCCC(=O)O m_273456__11071642__23171790 [0,0,0,0,0,1|2,0,1]=4 574 B8R0.4 CCC=NOCCCC m_34__17309904__10978696 [2,0,0,0,0,0|1,0,1]=4 575 B8R0.4 CCC=NOCCCO m_34__17309904__7931512 [2,0,0,0,0,0|1,0,1]=4 576 B8R0.4 CCCCCCCSC m_62__875850__7284636 [2,0,0,0,0,0|2,0,0]=4 577 B8R0.4 CCCCCCNCC m_270004__8288590__24715004 [2,0,0,0,0,0|2,0,0]=4 578 B8R0.4 CCCCCCSCC m_62__8854732__6469026 [2,0,0,0,0,0|2,0,0]=4 579 B8R0.4 CCCCCSCCC m_62__5063390__875868 [2,0,0,0,0,0|2,0,0]=4 580 B8R0.4 CCCCCSCCO m_7__8271838__102708 [2,0,0,0,0,0|2,0,0]=4 581 B8R0.4 CCCCOCCSC m_7__22987848__5046 [2,0,0,0,0,0|1,0,0]=3 582 B8R0.4 CCCCOCSCC m_7__22987770__17643698 [2,0,0,0,0,0|1,0,0]=3 583 B8R0.4 CCCCSCCCC m_62__875776__7021588 [2,0,0,0,0,0|0,1,0]=3 584 B8R0.4 CCCCSCCCN m_7__20871288__131272 [2,0,0,0,0,0|1,1,0]=4 585 B8R0.4 CCCCSCCCO m_7__10972294__770176 [2,0,0,0,0,0|0,1,0]=3 586 B8R0.4 CCCCSCCNC m_7__22986920__770176 [2,0,0,0,0,0|1,1,0]=4 587 B8R0.4 CCCCSCCOC m_7__6362310__770176 [2,0,0,0,0,0|1,1,0]=4 588 B8R0.4 CCCCSCCSC m_62__875776__8268572 [2,0,0,0,0,0|1,1,0]=4 589 B8R0.4 CCCCSCSCC m_7__22987770__10542654 [2,0,0,0,0,0|1,1,0]=4 590 B8R0.4 CCCSCCCCO m_7__22986886__3191338 [2,0,0,0,0,0|2,0,0]=4 591 B8R0.4 CCNCCCCCO m_270004__9456968__24715004 [2,0,0,0,0,0|2,0,0]=4 592 B8R0.4 CCOCSCCCO m_7__10972294__10176980 [2,0,0,0,0,0|1,1,0]=4 593 B8R0.4 CCSCCCCCO m_7__22987770__6079158 [2,0,0,0,0,0|2,0,0]=4 594 B8R0.4 CCSCSCCCO m_7__10972294__9456150 [2,0,0,0,0,0|1,1,0]=4 595 B8R0.4 CNCCSCCCO m_7__22986920__6354 [2,0,0,0,0,0|1,1,0]=4 596 B8R0.4 COCCOCCSC m_62__8738860__876088 [2,0,0,0,0,0|2,0,0]=4 597 B8R0.4 COCCSCCCO m_7__6362310__6354 [2,0,0,0,0,0|1,1,0]=4 598 B8R0.4 CSCCSCCCO m_7__10972294__7912552 [2,0,0,0,0,0|1,1,0]=4 599 B8R0.4 NCCCSCCCO m_7__20871288__6354 [2,0,0,0,0,0|1,1,0]=4 600 B8R0.4 OCCCCSCCO m_7__22849690__102708 [2,0,0,0,0,0|2,0,0]=4 601 B8R0.4 OCCCSCCCF m_7__10972294__16896928 [2,0,0,0,0,0|1,1,0]=4 602 B8R0.4 OCCCSCCCO m_7__10972294__6354 [2,0,0,0,0,0|0,1,0]=3 603 B8R0.7 CC(C)CCNCCO m_207__121484__134014 [2,0,0,0,0,0|2,0,0]=4 604 B8R0.7 CC(C)CCSCCO m_7__22987856__102708 [2,0,0,0,0,0|1,1,0]=4 605 B8R0.7 CC(C)CNCCCO m_207__109475__121216 [2,0,0,0,0,0|2,0,0]=4 606 B8R0.7 CC(C)CSCCCO m_7__27301__6354 [2,0,0,0,0,0|1,1,0]=4 607 B8R0.7 CC(C)NCCCCO m_269862__9433176__7204804 [2,0,0,0,0,0|2,0,0]=4 608 B8R0.7 CC(C)SCCCCO m_7__22849690__5048 [2,0,0,0,0,0|2,0,0]=4 609 B8R0.7 CC(F)CCSCCO m_62__13165346__10178562 [2,0,0,0,0,0|1,1,0]=4 610 B8R0.7 CC(F)CSCCCO m_7__10972294__16970746 [2,0,0,0,0,0|1,1,0]=4 611 B8R0.7 CC(N)CCSCCO m_7__20871360__102708 [2,0,0,0,0,0|1,1,0]=4 612 B8R0.7 CC(O)CCSCCN m_7__20871276__12057932 [2,0,0,0,0,0|1,1,0]=4 613 B8R0.7 CC(O)CCSCCO m_62__12057938__10178562 [2,0,0,0,0,0|0,1,0]=3 614 B8R0.7 CC(O)CNCCCF m_273610__17065614__11516404 [2,0,0,0,0,0|2,0,0]=4 615 B8R0.7 CC(O)CNCCCO m_273610__11554108__11516404 [2,0,0,0,0,0|1,0,0]=3 616 B8R0.7 CC(O)CSCCCF m_63__17315394__10903854 [2,0,0,0,0,0|1,1,0]=4 617 B8R0.7 CC(O)CSCCCN m_7__20871288__10902704 [2,0,0,0,0,0|1,1,0]=4 618 B8R0.7 CC(O)CSCCCO m_7__10953796__6354 [2,0,0,0,0,0|0,1,0]=3 619 B8R0.7 CCCCCCN(C)C m_2230__22406770__2463448 [2,0,0,0,0,0|2,0,0]=4 620 B8R0.7 CCCCCCS(=O)C m_265282__18991470__4273530 [2,0,0,0,0,0|1,0,1]=4 621 B8R0.7 CCCCCNC(C)C m_269862__7192702__7204804 [2,0,0,0,0,0|2,0,0]=4 622 B8R0.7 CCCCCSC(C)C m_62__2390328__5063392 [2,0,0,0,0,0|2,0,0]=4 623 B8R0.7 CCCCNCC(C)C m_207__109452__121216 [2,0,0,0,0,0|2,0,0]=4 624 B8R0.7 CCCCNCC(C)O m_273610__13857014__11516404 [2,0,0,0,0,0|1,0,0]=3 625 B8R0.7 CCCCSCC(C)C m_7__27301__770176 [2,0,0,0,0,0|1,1,0]=4 626 B8R0.7 CCCCSCC(C)F m_62__875776__16913488 [2,0,0,0,0,0|1,1,0]=4 627 B8R0.7 CCCCSCC(C)O m_7__10953796__770176 [2,0,0,0,0,0|0,1,0]=3 628 B8R0.7 CCCCSC[C@H](C)N m_7__20871336__131272 [2,0,0,0,0,0|1,1,0]=4 629 B8R0.7 CCCNCCC(C)C m_207__109413__134014 [2,0,0,0,0,0|2,0,0]=4 630 B8R0.7 CCCSCCC(C)C m_62__7021584__875868 [2,0,0,0,0,0|1,1,0]=4 631 B8R0.7 CCCSCCC(C)F m_62__13165346__875868 [2,0,0,0,0,0|1,1,0]=4 632 B8R0.7 CCCSCCC(C)N m_34__20871470__13271108 [2,0,0,0,0,0|1,1,0]=4 633 B8R0.7 CCCSCCC(C)O m_62__12057938__875868 [2,0,0,0,0,0|0,1,0]=3 634 B8R0.7 CCNCCCC(C)C m_207__121480__7912414 [2,0,0,0,0,0|2,0,0]=4 635 B8R0.7 CCNCCCC(C)O m_270004__9448698__24715004 [2,0,0,0,0,0|1,0,0]=3 636 B8R0.7 CCOCSCC(C)O m_7__10953796__10176980 [2,0,0,0,0,0|1,1,0]=4 637 B8R0.7 CCSCCCC(C)C m_62__10892842__6469026 [2,0,0,0,0,0|2,0,0]=4 638 B8R0.7 CCSCCCC(C)O m_7__22987770__10688172 [2,0,0,0,0,0|1,0,0]=3 639 B8R0.7 CCSCOCC(C)C m_7__22987770__12637718 [2,0,0,0,0,0|2,0,0]=4 640 B8R0.7 CCSCSCC(C)O m_7__10953796__9456150 [2,0,0,0,0,0|1,1,0]=4 641 B8R0.7 CN(C)CCCCCO m_2230__9449864__2463448 [2,0,0,0,0,0|2,0,0]=4 642 B8R0.7 CN(C)CCOCCO m_2230__9824938__2463448 [2,0,0,0,0,0|2,0,0]=4 643 B8R0.7 CNCCSCC(C)O m_7__22986920__10902704 [2,0,0,0,0,0|1,1,0]=4 644 B8R0.7 COCCNCC(C)O m_273610__13857010__11516404 [2,0,0,0,0,0|2,0,0]=4 645 B8R0.7 COCCSCC(C)O m_7__10953796__149891 [2,0,0,0,0,0|1,1,0]=4 646 B8R0.7 CSCCNCC(C)O m_273610__13857796__11516404 [2,0,0,0,0,0|2,0,0]=4 647 B8R0.7 CSCCOCC(C)C m_62__9820342__876088 [2,0,0,0,0,0|2,0,0]=4 648 B8R0.7 CSCCSCC(C)O m_7__10953796__7912552 [2,0,0,0,0,0|1,1,0]=4 649 B8R0.7 C[C@H](N)CSCCCO m_7__20871336__6354 [2,0,0,0,0,0|1,1,0]=4 650 B10R0.3 CC(C)CCNC(C)CCO m_207__5349870__134014 [1,1,0,0,0,0|2,0,0]=4 651 B10R0.3 CC(C)CCSC(C)CCO m_7__22987856__14772890 [1,1,0,0,0,0|1,1,0]=4 652 B10R0.3 CC(F)CCNC(C)CCO m_2230__22400640__13165354 [1,1,0,0,0,0|2,0,0]=4 653 B10R0.3 CC(F)CCSC(C)CCO m_7__5819074__13165340 [1,1,0,0,0,0|1,1,0]=4 654 B10R0.3 CC(N)CCSC(C)CCO m_7__20871360__14772890 [1,1,0,0,0,0|1,1,0]=4 655 B10R0.3 CC(O)CCCN(C)CCO m_2230__679202__9227836 [1,1,0,0,0,0|2,0,0]=4 656 B10R0.3 CC(O)CCNC(=O)CCO m_487__4933442__12879784 [1,1,0,0,0,0|1,0,1]=4 657 B10R0.3 CC(O)CCNC(C)CCN m_269982__22505446__22488918 [1,1,0,0,0,0|2,0,0]=4 658 B10R0.3 CC(O)CCNC(C)CCO m_2230__22400640__12057944 [1,1,0,0,0,0|1,0,0]=3 659 B10R0.3 CC(O)CCN[C@H](C)CCF m_2230__22404666__12057944 [1,1,0,0,0,0|2,0,0]=4 660 B10R0.3 CC(O)CCSC(C)CCO m_7__5819074__12057932 [1,1,0,0,0,0|0,1,0]=3 661 B10R0.3 CC(O)CNCC(C)CCO m_273610__11554544__11516404 [1,1,0,0,0,0|2,0,0]=4 662 B10R0.3 CC(O)CNC[C@@H](O)CCO m_273610__21538890__11516404 [1,1,0,0,0,0|2,0,0]=4 663 B10R0.3 CCCC(=O)NCCC(C)O m_270062__7618672__17814498 [1,1,0,0,0,0|1,0,1]=4 664 B10R0.3 CCCC(=O)NCC[C@@H](C)O m_22__7344840__58866 [1,1,0,0,0,0|1,0,1]=4 665 B10R0.3 CCCC(=O)OCCC(C)C m_276436__14076546__14088342 [1,1,0,0,0,0|1,0,1]=4 666 B10R0.3 CCCC(=O)OCCC(C)F m_1458__473330__13165350 [1,1,0,0,0,0|1,0,1]=4 667 B10R0.3 CCCC(=O)OCCC(C)O m_1458__473330__12057942 [1,1,0,0,0,0|0,0,1]=3 668 B10R0.3 CCCC(=O)OCC[C@H](C)F m_276436__17563626__14088342 [1,1,0,0,0,0|1,0,1]=4 669 B10R0.3 CCCC(C)CNCC(C)O m_273610__18902484__11516404 [1,1,0,0,0,0|2,0,0]=4 670 B10R0.3 CCCC(C)NCCC(C)C m_2230__22397382__681192 [1,1,0,0,0,0|2,0,0]=4 671 B10R0.3 CCCC(C)NCCC(C)F m_2230__22397382__13165354 [1,1,0,0,0,0|2,0,0]=4 672 B10R0.3 CCCC(C)NCCC(C)O m_2230__22397382__12057944 [1,1,0,0,0,0|1,0,0]=3 673 B10R0.3 CCCC(C)NCC[C@H](C)N m_272690__12628774__11346328 [1,1,0,0,0,0|2,0,0]=4 674 B10R0.3 CCCC(C)SCCC(C)C m_62__7021584__10638528 [1,1,0,0,0,0|1,1,0]=4 675 B10R0.3 CCCC(C)SCCC(C)F m_62__13165346__10638528 [1,1,0,0,0,0|1,1,0]=4 676 B10R0.3 CCCC(C)SCCC(C)N m_7__20871360__6493860 [1,1,0,0,0,0|1,1,0]=4 677 B10R0.3 CCCC(C)SCCC(C)O m_62__12057938__10638528 [1,1,0,0,0,0|0,1,0]=3 678 B10R0.3 CCCC(O)CNCC(C)O m_273610__11554442__11516404 [1,1,0,0,0,0|2,0,0]=4 679 B10R0.3 CCCC(O)CSCC(C)O m_7__10953796__15745978 [1,1,0,0,0,0|2,0,0]=4 680 B10R0.3 CCCN(C)CCCC(C)O m_2230__2261920__10688176 [1,1,0,0,0,0|2,0,0]=4 681 B10R0.3 CNCC(C)NCCC(C)O m_269982__22505308__22488918 [1,1,0,0,0,0|2,0,0]=4 682 B10R0.3 COCC(=O)OCCC(C)O m_1458__473580__12057942 [1,1,0,0,0,0|1,0,1]=4 683 B10R0.3 COCC(C)NCCC(C)O m_270004__8296476__8844972 [1,1,0,0,0,0|2,0,0]=4 684 B10R0.3 COCC(C)SCCC(C)O m_62__12057938__6339276 [1,1,0,0,0,0|1,1,0]=4 685 B10R0.3 COC[C@@H](C)NCCC(C)O m_2230__22399844__12057944 [1,1,0,0,0,0|2,0,0]=4 686 B10R0.3 CSCC(C)NCCC(C)O m_2230__22400632__12057944 [1,1,0,0,0,0|2,0,0]=4 687 B10R0.4 C#CCCCSCCC(C)O m_62__12057938__17850946 [1,1,0,0,0,0|0,1,1]=4 688 B10R0.4 C/C=C/CCSCCC(C)O m_62__12057938__23858416 [1,1,0,0,0,0|0,1,1]=4 689 B10R0.4 C=CCCCNCCC(C)O m_270004__8296476__17507834 [1,1,0,0,0,0|1,0,1]=4 690 B10R0.4 C=CCCCSCCC(C)O m_62__12057938__16929012 [1,1,0,0,0,0|0,1,1]=4 691 B10R0.4 CC(=O)NCCOCCCO m_270062__16417532__15585492 [1,1,0,0,0,0|0,0,2]=4 692 B10R0.4 CC(C)CCCCNCCO m_270004__8349608__12202092 [1,1,0,0,0,0|2,0,0]=4 693 B10R0.4 CC(C)CCCNCCCO m_207__109475__7912414 [1,1,0,0,0,0|2,0,0]=4 694 B10R0.4 CC(C)CCCSCCCO m_7__8333108__6354 [1,1,0,0,0,0|1,1,0]=4 695 B10R0.4 CC(C)CCNCCCCCl m_270004__8288586__24721168 [1,1,0,0,0,0|2,0,0]=4 696 B10R0.4 CC(C)CCNCCCCF m_207__10390152__134014 [1,1,0,0,0,0|2,0,0]=4 697 B10R0.4 CC(C)CCNCCCCO m_207__9433150__134014 [1,1,0,0,0,0|2,0,0]=4 698 B10R0.4 CC(C)CCSCCCCF m_62__7021584__10157916 [1,1,0,0,0,0|1,1,0]=4 699 B10R0.4 CC(C)CCSCCCCN m_34__20871448__6894144 [1,1,0,0,0,0|1,1,0]=4 700 B10R0.4 CC(C)CCSCCCCO m_7__22987856__3191338 [1,1,0,0,0,0|1,1,0]=4 701 B10R0.4 CC(C)CCSCCCON m_7__22987730__102951 [1,1,0,0,0,0|1,1,0]=4 702 B10R0.4 CC(C)CNCCCCCO m_207__9456940__121216 [1,1,0,0,0,0|2,0,0]=4 703 B10R0.4 CC(C)COCSCCCO m_7__10972294__12637718 [1,1,0,0,0,0|1,1,0]=4 704 B10R0.4 CC(C)CSCCCCCO m_7__27301__6079158 [1,1,0,0,0,0|2,0,0]=4 705 B10R0.4 CC(C)CSCSCCCO m_7__10972294__15703842 [1,1,0,0,0,0|1,1,0]=4 706 B10R0.4 CC(C)NCCCCCCO m_269862__8283026__7204804 [1,1,0,0,0,0|2,0,0]=4 707 B10R0.4 CC(C)NCCOCCCO m_269862__10126304__7204804 [1,1,0,0,0,0|1,0,0]=3 708 B10R0.4 CC(C)NCCSCCCO m_269862__7197364__7204804 [1,1,0,0,0,0|1,1,0]=4 709 B10R0.4 CC(C)OCCSCCCO m_7__22987390__6354 [1,1,0,0,0,0|1,1,0]=4 710 B10R0.4 CC(C)SCCSCCCO m_7__10972294__9870380 [1,1,0,0,0,0|1,1,0]=4 711 B10R0.4 CC(F)CCNCCCCCl m_270004__10546066__24721168 [1,1,0,0,0,0|2,0,0]=4 712 B10R0.4 CC(F)CCSCCCCF m_62__13165346__10157916 [1,1,0,0,0,0|1,1,0]=4 713 B10R0.4 CC(F)CCSCCCCN m_34__20871448__13165342 [1,1,0,0,0,0|1,1,0]=4 714 B10R0.4 CC(F)CCSCCCCO m_7__22849690__13165340 [1,1,0,0,0,0|1,1,0]=4 715 B10R0.4 CC(F)CCSCCCON m_7__22987730__13165340 [1,1,0,0,0,0|1,1,0]=4 716 B10R0.4 CC(N)CCSCCCCF m_34__20871470__10157910 [1,1,0,0,0,0|1,1,0]=4 717 B10R0.4 CC(N)CCSCCCCO m_7__20871360__3191338 [1,1,0,0,0,0|1,1,0]=4 718 B10R0.4 CC(O)CCCSCCCN m_7__20871288__10688172 [1,1,0,0,0,0|1,1,0]=4 719 B10R0.4 CC(O)CCCSCCCO m_7__10972294__10688172 [1,1,0,0,0,0|0,1,0]=3 720 B10R0.4 CC(O)CCNCCCCCl m_270004__8296476__24721168 [1,1,0,0,0,0|1,0,0]=3 721 B10R0.4 CC(O)CCSCC#CCO m_62__12057938__15141012 [1,1,0,0,0,0|0,1,1]=4 722 B10R0.4 CC(O)CCSCCCC#N m_62__12057938__9273958 [1,1,0,0,0,0|0,1,1]=4 723 B10R0.4 CC(O)CCSCCCCF m_62__12057938__10157916 [1,1,0,0,0,0|0,1,0]=3 724 B10R0.4 CC(O)CCSCCCCN m_34__20871448__12057934 [1,1,0,0,0,0|0,1,0]=3 725 B10R0.4 CC(O)CCSCCCCO m_7__22849690__12057932 [1,1,0,0,0,0|0,1,0]=3 726 B10R0.4 CC(O)CCSCCCON m_7__22987730__12057932 [1,1,0,0,0,0|0,1,0]=3 727 B10R0.4 CC(O)CNCC#CCCO m_273610__21536048__11516404 [1,1,0,0,0,0|1,0,1]=4 728 B10R0.4 CC(O)CNCCCCCCl m_270004__8288774__24721510 [1,1,0,0,0,0|2,0,0]=4 729 B10R0.4 CC(O)CNCCCCCF m_273610__15773432__11516404 [1,1,0,0,0,0|2,0,0]=4 730 B10R0.4 CC(O)CNCCCCCO m_273610__11554132__11516404 [1,1,0,0,0,0|1,0,0]=3 731 B10R0.4 CC(O)CNCCOCCO m_273610__11554120__11516404 [1,1,0,0,0,0|2,0,0]=4 732 B10R0.4 CC(O)CNCCSCCO m_273610__21508864__11516404 [1,1,0,0,0,0|2,0,0]=4 733 B10R0.4 CC(O)CSCCCCCF m_7__10953796__9984626 [1,1,0,0,0,0|2,0,0]=4 734 B10R0.4 CC(O)CSCCCCCN m_7__20871376__10902704 [1,1,0,0,0,0|2,0,0]=4 735 B10R0.4 CC(O)CSCCCCCO m_7__10953796__6079158 [1,1,0,0,0,0|1,0,0]=3 736 B10R0.4 CC(O)CSCCOCCO m_7__10953796__11974692 [1,1,0,0,0,0|2,0,0]=4 737 B10R0.4 CCC#CCSCCC(C)O m_7__20984246__12057932 [1,1,0,0,0,0|0,1,1]=4 738 B10R0.4 CCCC=CCNCC(C)O m_273610__14718678__11516404 [1,1,0,0,0,0|1,0,1]=4 739 B10R0.4 CCCCCCCNC(C)C m_269862__8315612__7204804 [1,1,0,0,0,0|2,0,0]=4 740 B10R0.4 CCCCCCCSC(C)C m_62__2390328__7284636 [1,1,0,0,0,0|2,0,0]=4 741 B10R0.4 CCCCCCNCC(C)C m_207__109479__121216 [1,1,0,0,0,0|2,0,0]=4 742 B10R0.4 CCCCCCNCC(C)F m_270004__13461138__24715030 [1,1,0,0,0,0|2,0,0]=4 743 B10R0.4 CCCCCCNCC(C)O m_273610__11517344__11516404 [1,1,0,0,0,0|1,0,0]=3 744 B10R0.4 CCCCCCSCC(C)C m_62__1010136__8854724 [1,1,0,0,0,0|2,0,0]=4 745 B10R0.4 CCCCCCSCC(C)F m_62__8854732__16913488 [1,1,0,0,0,0|2,0,0]=4 746 B10R0.4 CCCCCCSCC(C)O m_63__18991476__10903854 [1,1,0,0,0,0|1,0,0]=3 747 B10R0.4 CCCCCCSC[C@H](C)N m_7__20871336__846538 [1,1,0,0,0,0|2,0,0]=4 748 B10R0.4 CCCCCNCCC(C)C m_207__109488__134014 [1,1,0,0,0,0|2,0,0]=4 749 B10R0.4 CCCCCSCCC(C)C m_62__7021584__5063392 [1,1,0,0,0,0|1,1,0]=4 750 B10R0.4 CCCCCSCCC(C)F m_62__13165346__5063392 [1,1,0,0,0,0|1,1,0]=4 751 B10R0.4 CCCCCSCCC(C)N m_34__20871470__7966626 [1,1,0,0,0,0|1,1,0]=4 752 B10R0.4 CCCCCSCCC(C)O m_62__12057938__5063392 [1,1,0,0,0,0|0,1,0]=3 753 B10R0.4 CCCCNCCCC(C)C m_207__109452__7912414 [1,1,0,0,0,0|2,0,0]=4 754 B10R0.4 CCCCOCCNC(=O)C m_270062__7607992__15585492 [1,1,0,0,0,0|0,0,2]=4 755 B10R0.4 CCCCOCCNC(C)C m_269862__7196034__7204804 [1,1,0,0,0,0|1,0,0]=3 756 B10R0.4 CCCCOCCOC(=O)C m_276436__14076612__14088324 [1,1,0,0,0,0|0,0,2]=4 757 B10R0.4 CCCCOCCSC(C)C m_7__22987848__5048 [1,1,0,0,0,0|1,0,0]=3 758 B10R0.4 CCCCOCSCC(C)C m_7__27301__17643698 [1,1,0,0,0,0|1,0,0]=3 759 B10R0.4 CCCCOCSCC(C)O m_7__10953796__17643698 [1,1,0,0,0,0|0,0,0]=2 760 B10R0.4 CCCCOCSCC(F)F m_7__22987700__17643698 [1,1,0,0,0,0|2,0,0]=4 761 B10R0.4 CCCCSCCCC(C)C m_7__8333108__770176 [1,1,0,0,0,0|1,1,0]=4 762 B10R0.4 CCCCSCCOC(C)C m_7__22987390__770176 [1,1,0,0,0,0|1,1,0]=4 763 B10R0.4 CCCCSCCSC(C)C m_62__875776__10158466 [1,1,0,0,0,0|1,1,0]=4 764 B10R0.4 CCCCSCSCC(C)C m_7__27301__10542654 [1,1,0,0,0,0|1,1,0]=4 765 B10R0.4 CCCCSCSCC(C)O m_7__10953796__10542654 [1,1,0,0,0,0|0,1,0]=3 766 B10R0.4 CCCCSCSC[C@H](C)N m_7__20871336__10542654 [1,1,0,0,0,0|1,1,0]=4 767 B10R0.4 CCCNCCCCC(C)C m_270004__8288780__12202092 [1,1,0,0,0,0|2,0,0]=4 768 B10R0.4 CCCOCCSCC(C)O m_7__10953796__15503586 [1,1,0,0,0,0|2,0,0]=4 769 B10R0.4 CCCOCSCCC(C)C m_7__22987856__12361582 [1,1,0,0,0,0|1,1,0]=4 770 B10R0.4 CCCOCSCCC(C)N m_7__20871360__12361582 [1,1,0,0,0,0|1,1,0]=4 771 B10R0.4 CCNCCCCCC(C)C m_270004__21496980__24715004 [1,1,0,0,0,0|2,0,0]=4 772 B10R0.4 CCNCCOCCC(C)C m_270004__8292090__24715004 [1,1,0,0,0,0|1,0,0]=3 773 B10R0.4 CCNCCSCCC(C)C m_7__22986872__102951 [1,1,0,0,0,0|1,1,0]=4 774 B10R0.4 CCNCCSCCC(C)F m_7__22986872__13165340 [1,1,0,0,0,0|1,1,0]=4 775 B10R0.4 CCNCCSCCC(C)O m_7__22986872__12057932 [1,1,0,0,0,0|0,1,0]=3 776 B10R0.4 CCOCCCNCC(C)O m_273610__11516512__11516404 [1,1,0,0,0,0|2,0,0]=4 777 B10R0.4 CCOCCCSCC(C)O m_7__10953796__5730872 [1,1,0,0,0,0|2,0,0]=4 778 B10R0.4 CCOCCNCCC(C)C m_207__872232__134014 [1,1,0,0,0,0|2,0,0]=4 779 B10R0.4 CCOCCOCCN(C)C m_2230__9194270__2463448 [1,1,0,0,0,0|2,0,0]=4 780 B10R0.4 CCOCCONCC(C)O m_273610__11527208__11516404 [1,1,0,0,0,0|1,0,0]=3 781 B10R0.4 CCOCCSCCC(C)C m_62__7021584__204256 [1,1,0,0,0,0|1,1,0]=4 782 B10R0.4 CCOCCSCCC(C)F m_62__13165346__204256 [1,1,0,0,0,0|1,1,0]=4 783 B10R0.4 CCOCCSCCC(C)N m_34__20871470__8157270 [1,1,0,0,0,0|1,1,0]=4 784 B10R0.4 CCOCCSCCC(C)O m_62__12057938__204256 [1,1,0,0,0,0|0,1,0]=3 785 B10R0.4 CCSCCCNCC(C)O m_273610__11528542__11516404 [1,1,0,0,0,0|2,0,0]=4 786 B10R0.4 CCSCCCSCC(C)O m_7__10953796__6078538 [1,1,0,0,0,0|2,0,0]=4 787 B10R0.4 CCSCCNCCC(C)C m_207__13975948__134014 [1,1,0,0,0,0|2,0,0]=4 788 B10R0.4 CCSCCNCCC(C)F m_270004__10546066__8765926 [1,1,0,0,0,0|2,0,0]=4 789 B10R0.4 CCSCCNCCC(C)O m_270004__8296476__8765926 [1,1,0,0,0,0|1,0,0]=3 790 B10R0.4 CCSCCOCCC(=O)C m_7__22987770__13817868 [1,1,0,0,0,0|0,0,2]=4 791 B10R0.4 CCSCCOCCC(C)C m_62__15357102__6469026 [1,1,0,0,0,0|1,0,0]=3 792 B10R0.4 CCSCCOCCN(C)C m_7__22987770__22787330 [1,1,0,0,0,0|2,0,0]=4 793 B10R0.4 CCSCCSCCC(C)C m_7__8765656__102951 [1,1,0,0,0,0|1,1,0]=4 794 B10R0.4 CCSCCSCCC(C)F m_7__8765656__13165340 [1,1,0,0,0,0|1,1,0]=4 795 B10R0.4 CCSCCSCCC(C)N m_34__20871470__8124554 [1,1,0,0,0,0|1,1,0]=4 796 B10R0.4 CCSCCSCCC(C)O m_7__8765656__12057932 [1,1,0,0,0,0|0,1,0]=3 797 B10R0.4 CNCCCOCCN(C)C m_269982__22504962__14064228 [1,1,0,0,0,0|2,0,0]=4 798 B10R0.4 CNCCSCCCC(C)O m_7__22986920__10688172 [1,1,0,0,0,0|1,1,0]=4 799 B10R0.4 COCCCCNCC(C)O m_273610__11518540__11516404 [1,1,0,0,0,0|2,0,0]=4 800 B10R0.4 COCCCCSCC(C)O m_7__10953796__4903360 [1,1,0,0,0,0|2,0,0]=4 801 B10R0.4 COCCCNCCC(C)C m_207__109474__134014 [1,1,0,0,0,0|2,0,0]=4 802 B10R0.4 COCCCNCCC(C)F m_270004__10546066__24710510 [1,1,0,0,0,0|2,0,0]=4 803 B10R0.4 COCCCNCCC(C)O m_270004__8296476__24710510 [1,1,0,0,0,0|1,0,0]=3 804 B10R0.4 COCCCOCCN(C)C m_2230__8266238__2463448 [1,1,0,0,0,0|2,0,0]=4 805 B10R0.4 COCCCONCC(C)O m_273610__11529114__11516404 [1,1,0,0,0,0|1,0,0]=3 806 B10R0.4 COCCCSCCC(C)C m_62__7021584__9108904 [1,1,0,0,0,0|1,1,0]=4 807 B10R0.4 COCCCSCCC(C)F m_62__13165346__9108904 [1,1,0,0,0,0|1,1,0]=4 808 B10R0.4 COCCCSCCC(C)N m_34__20871470__9108882 [1,1,0,0,0,0|1,1,0]=4 809 B10R0.4 COCCCSCCC(C)O m_62__12057938__9108904 [1,1,0,0,0,0|0,1,0]=3 810 B10R0.4 COCCOCCNC(C)C m_269862__7195076__7204804 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CNC(=O)CCOCCCO m_22__387492__17833552 [1,1,0,0,0,0|0,0,2]=4 956 B10R0.74 COC(C)CCNCCCF m_270004__17065596__24721380 [1,1,0,0,0,0|2,0,0]=4 957 B10R0.74 COC(C)CCNCCCO m_270004__8288584__24721380 [1,1,0,0,0,0|1,0,0]=3 958 B10R0.74 COC(C)CCNCCSC m_270004__11963796__24721380 [1,1,0,0,0,0|2,0,0]=4 959 B10R0.74 COC(C)CCSCCCF m_7__22987798__16896928 [1,1,0,0,0,0|1,1,0]=4 960 B10R0.74 COC(C)CCSCCCO m_7__22987798__6354 [1,1,0,0,0,0|0,1,0]=3 961 B10R0.74 COC(C)CCSCCSC m_7__22987798__7912552 [1,1,0,0,0,0|1,1,0]=4 962 B10R0.74 COC(C)CSCCCCO m_7__22986820__3191338 [1,1,0,0,0,0|2,0,0]=4 963 B10R0.74 COCCNCCC(C)OC m_270004__8288600__24721380 [1,1,0,0,0,0|2,0,0]=4 964 B10R0.74 COCCOCCN(C)OC m_2230__679026__8160800 [1,1,0,0,0,0|2,0,0]=4 965 B10R0.74 COCCONC[C@H](O)CF m_273610__11528094__14323916 [1,1,0,0,0,0|2,0,0]=4 966 B10R0.74 COCCSCCC(C)OC m_7__22987798__149891 [1,1,0,0,0,0|1,1,0]=4 967 B10R0.74 CON(C)CCCCCCO m_2230__679026__13038782 [1,1,0,0,0,0|2,0,0]=4 968 B10R0.74 CON(C)CCOCCCF m_2230__679026__22994160 [1,1,0,0,0,0|2,0,0]=4 969 B10R0.74 CSC(C)CCNCCCO m_270004__8288584__24721392 [1,1,0,0,0,0|1,1,0]=4 970 B10R0.74 CSCCONC[C@H](O)CF m_273610__11528236__14323916 [1,1,0,0,0,0|2,0,0]=4 971 B10R0.74 C[C@H](CO)NCCCCCO m_2230__22399532__6079162 [1,1,0,0,0,0|2,0,0]=4 972 B10R0.74 OCCCCNC[C@H](O)CF m_273610__11554164__14323916 [1,1,0,0,0,0|2,0,0]=4 973 B10R0.74 OCCCCSCC(O)CF m_7__22849690__13890448 [1,1,0,0,0,0|2,0,0]=4 974 B10R0.74 OCCCCSCC(O)CO m_7__22849690__3173190 [1,1,0,0,0,0|2,0,0]=4 975 B10R0.75 CC(C)C(C)CSCCCO m_7__10972294__16618954 [1,1,0,0,0,0|1,1,0]=4 976 B10R0.75 CC(C)C(O)CNCCCO m_273610__11554108__17609376 [1,1,0,0,0,0|2,0,0]=4 977 B10R0.75 CC(C)C(O)CSCCCO m_7__10972294__11982594 [1,1,0,0,0,0|1,1,0]=4 978 B10R0.75 CC(O)C(C)NCCCCO m_269862__9433176__13817824 [1,1,0,0,0,0|2,0,0]=4 979 B10R0.75 CC(O)C(C)SCCCCO m_7__22849690__12202248 [1,1,0,0,0,0|2,0,0]=4 980 B10R0.75 CC(O)C(O)CSCCCF m_63__17315394__13936428 [1,1,0,0,0,0|1,1,0]=4 981 B10R0.75 CCCCCNC(C)C(C)O m_269862__7192702__13817824 [1,1,0,0,0,0|2,0,0]=4 982 B10R0.75 CCCCCN[C@H](C)[C@H](C)O m_2230__22400278__5063396 [1,1,0,0,0,0|2,0,0]=4 983 B10R0.75 CCCCCSC(C)C(C)O m_7__8271838__12202248 [1,1,0,0,0,0|2,0,0]=4 984 B10R0.75 CCCCNCC(O)C(C)C m_273610__13857014__17609376 [1,1,0,0,0,0|2,0,0]=4 985 B10R0.75 CCCCONC(=O)[C@@H](C)O m_22__14728982__17541882 [1,1,0,0,0,0|1,0,1]=4 986 B10R0.75 CCCCSCC(C)C(C)C m_62__16618958__7021588 [1,1,0,0,0,0|1,1,0]=4 987 B10R0.75 C[C@@H](O)C(=O)NOCCCO m_22__10551048__17541882 [1,1,0,0,0,0|1,0,1]=4 988 B10R0.75 C[C@H](O)[C@@H](C)NCCCCO m_2230__22400278__3191342 [1,1,0,0,0,0|2,0,0]=4 989 B10R0.78 CC(C)CCN(C)CCCO m_2230__9787816__681192 [1,1,0,0,0,0|2,0,0]=4 990 B10R0.78 CC(F)CCN(C)CCCO m_2230__9787816__13165354 [1,1,0,0,0,0|2,0,0]=4 991 B10R0.78 CC(O)CCN(C)CCCF m_2230__13040470__12057944 [1,1,0,0,0,0|2,0,0]=4 992 B10R0.78 CC(O)CCN(C)CCCN m_269982__11965286__22488918 [1,1,0,0,0,0|2,0,0]=4 993 B10R0.78 CC(O)CCN(C)CCCO m_2230__9787816__12057944 [1,1,0,0,0,0|1,0,0]=3 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[1,1,0,0,0,0|2,0,0]=4 1007 B10R0.78 CSCCN(C)CCC(C)O m_2230__7207368__12057944 [1,1,0,0,0,0|2,0,0]=4 1008 B10R0.78 CSCCN(C)CC[C@H](C)O m_2230__18186218__681390 [1,1,0,0,0,0|2,0,0]=4 1009 B10R0.78 C[C@@H](N)CCN(C)CCCO m_269982__17669188__25012466 [1,1,0,0,0,0|2,0,0]=4 1010 B10R0.78 C[C@H](O)CCN(C)CCCF m_2230__18186218__16896936 [1,1,0,0,0,0|2,0,0]=4 1011 B10R0.78 C[C@H](O)CCN(C)CCCN m_269982__18186278__10880302 [1,1,0,0,0,0|2,0,0]=4 1012 B10R0.78 C[C@H](O)CCN(C)CCCO m_2230__18186218__680950 [1,1,0,0,0,0|1,0,0]=3 1013 B10R0.15 CC(C)CCNCC(C)(C)O m_207__4567508__134014 [0,1,0,0,1,0|2,0,0]=4 1014 B10R0.15 CC(C)CCSCC(C)(C)O m_7__22987856__8331390 [0,1,0,0,1,0|1,1,0]=4 1015 B10R0.15 CC(C)CNCCC(C)(C)O m_207__8992650__121216 [0,1,0,0,1,0|2,0,0]=4 1016 B10R0.15 CC(C)CSCCC(C)(C)O m_7__27301__11686960 [0,1,0,0,1,0|1,1,0]=4 1017 B10R0.15 CC(C)NCCCC(C)(C)O m_269862__13972466__7204804 [0,1,0,0,1,0|2,0,0]=4 1018 B10R0.15 CC(F)CCSCC(C)(C)O m_7__22987452__13165340 [0,1,0,0,1,0|1,1,0]=4 1019 B10R0.15 CC(F)CSCCC(C)(C)O m_7__11758710__16970746 [0,1,0,0,1,0|1,1,0]=4 1020 B10R0.15 CC(N)CCSCC(C)(C)O m_7__20871360__8331390 [0,1,0,0,1,0|1,1,0]=4 1021 B10R0.15 CC(O)CCCNC(C)(C)C m_2230__3081242__9227836 [0,1,0,0,1,0|2,0,0]=4 1022 B10R0.15 CC(O)CCNCC(C)(C)C m_207__4933440__2989454 [0,1,0,0,1,0|2,0,0]=4 1023 B10R0.15 CC(O)CCNCC(C)(C)F m_270004__8296476__17541580 [0,1,0,0,1,0|2,0,0]=4 1024 B10R0.15 CC(O)CCSCC(C)(C)C m_7__9780138__12057932 [0,1,0,0,1,0|1,1,0]=4 1025 B10R0.15 CC(O)CCSCC(C)(C)F m_62__23075284__12057940 [0,1,0,0,1,0|1,1,0]=4 1026 B10R0.15 CC(O)CCSCC(C)(C)N m_7__22849170__12057932 [0,1,0,0,1,0|1,1,0]=4 1027 B10R0.15 CC(O)CCSCC(C)(C)O m_7__22987452__12057932 [0,1,0,0,1,0|0,1,0]=3 1028 B10R0.15 CC(O)CNCCC(C)(C)C m_273610__11518116__11516404 [0,1,0,0,1,0|2,0,0]=4 1029 B10R0.15 CC(O)CNCCC(C)(C)F m_273610__13858842__11516404 [0,1,0,0,1,0|2,0,0]=4 1030 B10R0.15 CC(O)CNCCC(C)(C)O m_273610__11527254__11516404 [0,1,0,0,1,0|1,0,0]=3 1031 B10R0.15 CC(O)CNCCC(C)(F)F m_273610__11529770__11516404 [0,1,0,0,1,0|2,0,0]=4 1032 B10R0.15 CC(O)CSCCC(C)(C)C m_7__22988126__10902704 [0,1,0,0,1,0|1,1,0]=4 1033 B10R0.15 CC(O)CSCCC(C)(C)F m_7__10953796__16725000 [0,1,0,0,1,0|1,1,0]=4 1034 B10R0.15 CC(O)CSCCC(C)(C)O m_7__10953796__11686960 [0,1,0,0,1,0|0,1,0]=3 1035 B10R0.15 CC(O)CSCCC(C)(F)F m_7__22988020__10902704 [0,1,0,0,1,0|1,1,0]=4 1036 B10R0.15 C[C@H](N)CSCCC(C)(C)O m_7__20871336__11686960 [0,1,0,0,1,0|1,1,0]=4 1037 B10R0.96 CC(C)CC(=O)OCC(C)O m_1458__473118__9780094 [0,1,0,0,1,0|1,0,1]=4 1038 B10R0.96 CC(C)CC(C)NCC(C)O m_2230__22399870__9736146 [0,1,0,0,1,0|2,0,0]=4 1039 B10R0.96 CC(C)CC(C)SCC(C)O m_7__10953796__10641634 [0,1,0,0,1,0|1,1,0]=4 1040 B10R0.96 CC(C)CCN(C)CC(C)O m_2230__5729954__681192 [0,1,0,0,1,0|2,0,0]=4 1041 B10R0.96 CC(C)CN(C)CCC(C)O m_2230__2206024__12057944 [0,1,0,0,1,0|2,0,0]=4 1042 B10R0.96 CC(C)CN(C)CC[C@H](C)O m_2230__18186218__681214 [0,1,0,0,1,0|2,0,0]=4 1043 B10R0.96 CC(C)CNC(C)CC(C)O m_207__8644118__121216 [0,1,0,0,1,0|2,0,0]=4 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[0,1,0,0,1,0|1,0,1]=4 1056 B10R0.96 CC(O)COC(=O)C[C@@H](C)O m_1458__21596576__9780094 [0,1,0,0,1,0|0,0,1]=3 1057 B10R0.96 C[C@H](N)CN(C)CC[C@H](C)O m_269982__18186278__25012480 [0,1,0,0,1,0|2,0,0]=4 1058 B10R0.98 CC(C)CCNC(C)C(C)O m_269862__7192680__13817824 [0,1,0,0,1,0|2,0,0]=4 1059 B10R0.98 CC(C)CCN[C@H](C)[C@H](C)O m_2230__22400278__681192 [0,1,0,0,1,0|2,0,0]=4 1060 B10R0.98 CC(C)CCSC(C)C(C)O m_7__22987856__12202248 [0,1,0,0,1,0|1,1,0]=4 1061 B10R0.98 CC(C)CNCC(C)C(C)O m_207__17552436__121216 [0,1,0,0,1,0|2,0,0]=4 1062 B10R0.98 CC(C)CNCC(O)C(C)O m_207__12526012__121216 [0,1,0,0,1,0|2,0,0]=4 1063 B10R0.98 CC(F)CCN[C@H](C)[C@H](C)O m_2230__22400278__13165354 [0,1,0,0,1,0|2,0,0]=4 1064 B10R0.98 CC(O)CCCN(C)C(C)C m_2230__22405892__680832 [0,1,0,0,1,0|2,0,0]=4 1065 B10R0.98 CC(O)CCNC(=O)[C@@H](C)O m_22__5128424__17541882 [0,1,0,0,1,0|1,0,1]=4 1066 B10R0.98 CC(O)CCNC(C)C(C)C m_269862__7198110__7200270 [0,1,0,0,1,0|2,0,0]=4 1067 B10R0.98 CC(O)CCN[C@@H](C)C(C)C m_2230__22399838__12057944 [0,1,0,0,1,0|2,0,0]=4 1068 B10R0.98 CC(O)CCN[C@H](C)[C@H](C)O m_2230__22400278__12057944 [0,1,0,0,1,0|1,0,0]=3 1069 B10R0.98 CC(O)CCOC(=O)C(C)Br m_1458__23414716__12057942 [0,1,0,0,1,0|1,0,1]=4 1070 B10R0.98 CC(O)CCOC(=O)C(C)C m_1458__473302__12057942 [0,1,0,0,1,0|1,0,1]=4 1071 B10R0.98 CC(O)CCSC(C)C(C)C m_7__6286942__12057932 [0,1,0,0,1,0|1,1,0]=4 1072 B10R0.98 CC(O)CNCC(C)C(C)C m_273610__16787196__11516404 [0,1,0,0,1,0|2,0,0]=4 1073 B10R0.98 CC(O)CNCC(O)C(C)C m_273610__11554586__11516404 [0,1,0,0,1,0|2,0,0]=4 1074 B10R0.98 CC(O)CONC(=O)[C@@H](C)O m_22__13570648__17541882 [0,1,0,0,1,0|1,0,1]=4 1075 B10R0.98 CC(O)CSCC(C)C(C)C m_7__10953796__16618954 [0,1,0,0,1,0|1,1,0]=4 1076 B10R0.98 CC(O)CSCC(O)C(C)C m_7__10953796__11982594 [0,1,0,0,1,0|1,1,0]=4 1077 B10R0.98 C[C@@H](O)CCNC(=O)[C@@H](C)O m_22__7344840__17541882 [0,1,0,0,1,0|1,0,1]=4 1078 B10R0.98 C[C@H](O)CONC(=O)[C@@H](C)O m_22__20996034__17541882 [0,1,0,0,1,0|1,0,1]=4 1079 B12R0.42 CC(C)CCCCNC(C)C(C)O m_269862__24383728__13817824 [0,1,0,0,0,1|2,0,0]=4 1080 B12R0.42 CC(C)CCCCN[C@H](C)[C@@H](C)O m_270004__21631392__12202092 [0,1,0,0,0,1|2,0,0]=4 1081 B12R0.42 CC(C)CCCCN[C@H](C)[C@H](C)O m_2230__22400278__22384278 [0,1,0,0,0,1|2,0,0]=4 1082 B12R0.42 CC(C)CCCNCC(C)C(C)O m_207__17552436__7912414 [0,1,0,0,0,1|2,0,0]=4 1083 B12R0.42 CC(C)CCCNCC(O)C(C)O m_207__12526012__7912414 [0,1,0,0,0,1|2,0,0]=4 1084 B12R0.42 CC(C)CCCSCC(O)C(C)O m_63__8333112__13936428 [0,1,0,0,0,1|1,1,0]=4 1085 B12R0.42 CC(O)CCCNCC(O)C(C)C m_273610__11554480__17609376 [0,1,0,0,0,1|2,0,0]=4 1086 B12R0.42 CC(O)CCSCCN(C)C(C)C m_7__22987322__12057932 [0,1,0,0,0,1|1,1,0]=4 1087 B12R0.44 CC(=O)CCC(=O)OCCC(C)O m_1458__473468__12057942 [0,1,0,0,0,1|0,0,2]=4 1088 B12R0.44 CC(C)CCC(=O)CSCC(C)O m_7__10953796__7045102 [0,1,0,0,0,1|2,0,0]=4 1089 B12R0.44 CC(C)CCC(=O)NCCC(C)O m_270062__7618672__17779374 [0,1,0,0,0,1|2,0,0]=4 1090 B12R0.44 CC(C)CCC(=O)NCC[C@@H](C)O m_22__7344840__60606 [0,1,0,0,0,1|2,0,0]=4 1091 B12R0.44 CC(C)CCC(=O)OCCC(C)F m_1458__476366__13165350 [0,1,0,0,0,1|2,0,0]=4 1092 B12R0.44 CC(C)CCC(=O)OCCC(C)O m_1458__476366__12057942 [0,1,0,0,0,1|1,0,0]=3 1093 B12R0.44 CC(C)CCC(=O)OCC[C@H](C)F m_276436__17563626__14086942 [0,1,0,0,0,1|2,0,0]=4 1094 B12R0.44 CC(C)CCC(C)CNCC(C)O m_270004__8288774__24715048 [0,1,0,0,0,1|2,0,0]=4 1095 B12R0.44 CC(C)CCC(C)NCCC(C)O m_2230__22397544__12057944 [0,1,0,0,0,1|2,0,0]=4 1096 B12R0.44 CC(C)CCC(C)SCCC(C)O m_62__12057938__13655718 [0,1,0,0,0,1|1,1,0]=4 1097 B12R0.44 CC(C)CCC(O)CNCC(C)O m_273610__11554114__11516318 [0,1,0,0,0,1|2,0,0]=4 1098 B12R0.44 CC(C)CCCC(C)NCC(C)O m_2230__22411382__9736146 [0,1,0,0,0,1|2,0,0]=4 1099 B12R0.44 CC(C)CCCN(C)CCC(C)O m_2230__13824066__12057944 [0,1,0,0,0,1|2,0,0]=4 1100 B12R0.44 CC(C)CCCN(C)CC[C@H](C)O m_270004__18186228__9139706 [0,1,0,0,0,1|2,0,0]=4 1101 B12R0.44 CC(C)CCN(C)CCCC(C)O m_2230__22405892__681192 [0,1,0,0,0,1|2,0,0]=4 1102 B12R0.44 CC(C)CCOC(=O)CCC(C)C m_276436__14076546__14086942 [0,1,0,0,0,1|2,0,0]=4 1103 B12R0.44 CC(C)CCOC(=O)NCC(C)O m_282070__22205934__22151610 [0,1,0,0,0,1|1,0,1]=4 1104 B12R0.44 CC(C)OCCN(C)CC[C@H](C)O m_2230__18186218__6475682 [0,1,0,0,0,1|2,0,0]=4 1105 B12R0.44 CC(C)SCCN(C)CC[C@H](C)O m_2230__18186218__9870384 [0,1,0,0,0,1|2,0,0]=4 1106 B12R0.44 CC(N)CCC(=O)NCCC(C)O m_270006__11612584__11616034 [0,1,0,0,0,1|2,0,0]=4 1107 B12R0.44 CC(N)CCC(=O)NCC[C@@H](C)O m_240690__17697168__9360654 [0,1,0,0,0,1|2,0,0]=4 1108 B12R0.44 CC(O)CCCN(C)CCC(C)F m_2230__22405892__13165354 [0,1,0,0,0,1|2,0,0]=4 1109 B12R0.44 CC(O)CCCN(C)CCC(C)O m_2230__22405892__12057944 [0,1,0,0,0,1|1,0,0]=3 1110 B12R0.44 CC(O)CCCN(C)CC[C@@H](C)N m_269982__22517726__25012466 [0,1,0,0,0,1|2,0,0]=4 1111 B12R0.44 CC(O)CCCN(C)CC[C@H](C)O m_2230__18186218__9227836 [0,1,0,0,0,1|1,0,0]=3 1112 B12R0.44 CC(O)CCN(C)CCOC(C)C m_2230__16925336__12057944 [0,1,0,0,0,1|2,0,0]=4 1113 B12R0.44 CC(O)CCNC(C)CCC(C)Cl m_270004__8296476__24723046 [0,1,0,0,0,1|2,0,0]=4 1114 B12R0.44 CC(O)CCNC(C)COC(C)C m_270004__8296476__9820294 [0,1,0,0,0,1|2,0,0]=4 1115 B12R0.44 CC(O)CCN[C@@H](C)COC(C)C m_2230__22403246__12057944 [0,1,0,0,0,1|2,0,0]=4 1116 B12R0.44 CC(O)CCOC(=O)CCC(F)F m_1458__9580340__12057942 [0,1,0,0,0,1|2,0,0]=4 1117 B12R0.44 CC(O)CCOC(=O)COC(C)C m_1458__1944474__12057942 [0,1,0,0,0,1|1,0,1]=4 1118 B12R0.44 CC(O)CCOC(=O)CSC(C)C m_1458__548068__12057942 [0,1,0,0,0,1|1,0,1]=4 1119 B12R0.137 CC(C)CCCCNCC(C)(C)O m_270004__8296166__12202092 [0,1,0,0,0,1|2,0,0]=4 1120 B12R0.137 CC(C)CCCNCCC(C)(C)O m_207__8992650__7912414 [0,1,0,0,0,1|2,0,0]=4 1121 B12R0.137 CC(C)CCCSCCC(C)(C)O m_7__8333108__11686960 [0,1,0,0,0,1|1,1,0]=4 1122 B12R0.137 CC(C)CCNCCCC(C)(C)O m_207__13972434__134014 [0,1,0,0,0,1|2,0,0]=4 1123 B12R0.137 CC(C)CCOCCNC(C)(C)C m_2230__3081242__1160064 [0,1,0,0,0,1|2,0,0]=4 1124 B12R0.137 CC(C)COCSCCC(C)(C)O m_7__11758710__12637718 [0,1,0,0,0,1|1,1,0]=4 1125 B12R0.137 CC(C)CSCOCCC(C)(C)C m_7__27301__10548620 [0,1,0,0,0,1|2,0,0]=4 1126 B12R0.137 CC(C)CSCSCCC(C)(C)O m_7__11758710__15703842 [0,1,0,0,0,1|1,1,0]=4 1127 B12R0.137 CC(C)OCCSCCC(C)(C)O m_7__22987390__11686960 [0,1,0,0,0,1|1,1,0]=4 1128 B12R0.137 CC(C)SCCSCCC(C)(C)O m_7__11758710__9870380 [0,1,0,0,0,1|1,1,0]=4 1129 B12R0.137 CC(O)CCCNCCC(C)(C)C m_207__9448672__2989446 [0,1,0,0,0,1|2,0,0]=4 1130 B12R0.137 CC(O)CCCSCCC(C)(C)C m_7__22988126__10688172 [0,1,0,0,0,1|1,1,0]=4 1131 B12R0.137 CC(O)CCCSCCC(C)(C)O m_7__11758710__10688172 [0,1,0,0,0,1|0,1,0]=3 1132 B12R0.137 CC(O)CCCSCCC(C)(F)F m_7__22988020__10688172 [0,1,0,0,0,1|1,1,0]=4 1133 B12R0.137 CC(O)CCNCCCC(C)(C)C m_270004__8296476__17642466 [0,1,0,0,0,1|2,0,0]=4 1134 B12R0.137 CC(O)CCNCCOC(C)(C)C m_270004__8296476__24721004 [0,1,0,0,0,1|2,0,0]=4 1135 B12R0.137 CC(O)CCSCCCC(C)(C)C m_62__9106512__12057940 [0,1,0,0,0,1|1,1,0]=4 1136 B12R0.137 CC(O)CCSCCCC(C)(F)F m_62__13153472__12057940 [0,1,0,0,0,1|1,1,0]=4 1137 B12R0.137 CC(O)CCSCCOC(C)(C)C m_62__2161526__12057940 [0,1,0,0,0,1|1,1,0]=4 1138 B12R0.137 CC(O)CCSCCSC(C)(C)C m_7__9435968__12057932 [0,1,0,0,0,1|1,1,0]=4 1139 B12R0.137 CC(O)CNCCCCC(C)(C)C m_273610__11521864__11516404 [0,1,0,0,0,1|2,0,0]=4 1140 B12R0.137 CC(O)CNCCCCC(C)(F)F m_273610__17544304__11516404 [0,1,0,0,0,1|2,0,0]=4 1141 B12R0.137 CC(O)CNCCOCC(C)(C)O m_273610__15369242__11516404 [0,1,0,0,0,1|2,0,0]=4 1142 B12R0.137 CC(O)CSCCCCC(C)(C)C m_7__10953796__16922246 [0,1,0,0,0,1|2,0,0]=4 1143 B12R0.137 CC(O)CSCCCCC(C)(F)F m_7__10953796__19118300 [0,1,0,0,0,1|2,0,0]=4 1144 B12R0.137 CC(O)CSCOCCC(C)(C)C m_7__10953796__10548620 [0,1,0,0,0,1|1,0,0]=3 1145 B12R0.184 C=CC(C)NCCOCCC(C)C m_2230__22399842__1160064 [0,1,0,0,0,1|2,0,0]=4 1146 B12R0.184 CC(=O)CCOCCSC(C)CO m_7__6338928__13817868 [0,1,0,0,0,1|0,0,2]=4 1147 B12R0.184 CC(C)CCCCCNC(C)CO m_269862__21496978__15157990 [0,1,0,0,0,1|2,0,0]=4 1148 B12R0.184 CC(C)CCCCCN[C@H](C)CO m_2230__22399532__22383874 [0,1,0,0,0,1|2,0,0]=4 1149 B12R0.184 CC(C)CCCCNCC(C)CO m_270004__8291276__12202092 [0,1,0,0,0,1|2,0,0]=4 1150 B12R0.184 CC(C)CCCCNCC(O)CF m_270004__13905838__12202092 [0,1,0,0,0,1|2,0,0]=4 1151 B12R0.184 CC(C)CCCCNC[C@H](O)CF m_273610__24383694__14323916 [0,1,0,0,0,1|2,0,0]=4 1152 B12R0.184 CC(C)CCCNCCC(C)CO m_207__24471928__7912414 [0,1,0,0,0,1|2,0,0]=4 1153 B12R0.184 CC(C)CCCNCC[C@@H](O)CO m_207__14590488__7912414 [0,1,0,0,0,1|2,0,0]=4 1154 B12R0.184 CC(C)CCNCCCC(C)CO m_207__7874660__134014 [0,1,0,0,0,1|2,0,0]=4 1155 B12R0.184 CC(C)CCOCCNC(C)CCl m_2230__22399894__1160064 [0,1,0,0,0,1|2,0,0]=4 1156 B12R0.184 CC(C)CCOCCNC(C)CO m_269862__7196032__15157990 [0,1,0,0,0,1|1,0,0]=3 1157 B12R0.184 CC(C)CCOCCN[C@H](C)CF m_2230__22399906__1160064 [0,1,0,0,0,1|2,0,0]=4 1158 B12R0.184 CC(C)CCOCCN[C@H](C)CN m_269982__22505378__15357116 [0,1,0,0,0,1|2,0,0]=4 1159 B12R0.184 CC(C)CCOCCN[C@H](C)CO m_2230__22399532__1160064 [0,1,0,0,0,1|1,0,0]=3 1160 B12R0.184 CC(C)CCOCCSC(C)CO m_7__6338928__1160058 [0,1,0,0,0,1|1,0,0]=3 1161 B12R0.184 CC(C)CCOCCS[C@@H](C)CN m_7__20871330__1160058 [0,1,0,0,0,1|2,0,0]=4 1162 B12R0.184 CC(C)OCCONC[C@H](O)CF m_273610__11529470__14323916 [0,1,0,0,0,1|2,0,0]=4 1163 B12R0.184 CC(CO)NCCOCCN(C)C m_269862__9208284__15157990 [0,1,0,0,0,1|2,0,0]=4 1164 B12R0.184 CC(CO)SCCOCCN(C)C m_7__6338928__22787330 [0,1,0,0,0,1|2,0,0]=4 1165 B12R0.184 CCC(C)NCCOCCC(C)C m_269862__7196032__7200134 [0,1,0,0,0,1|2,0,0]=4 1166 B12R0.184 CCC(O)CCNCCCC(C)C m_207__7143330__7912414 [0,1,0,0,0,1|2,0,0]=4 1167 B12R0.184 CCC(O)CCSCCCC(C)C m_62__10892842__16640710 [0,1,0,0,0,1|1,1,0]=4 1168 B12R0.184 CCC(O)CCSCCOC(C)C m_62__3569224__16640710 [0,1,0,0,0,1|1,1,0]=4 1169 B12R0.184 CCC(O)CCSCCSC(C)C m_62__16640708__10158466 [0,1,0,0,0,1|1,1,0]=4 1170 B12R0.184 CCC(O)CNCCCCC(C)C m_273610__24383694__11516276 [0,1,0,0,0,1|2,0,0]=4 1171 B12R0.184 CCC(O)CNOCCOC(C)C m_273610__11529470__11516276 [0,1,0,0,0,1|2,0,0]=4 1172 B12R0.184 COC(C)CCNCCCC(C)C m_207__10742040__7912414 [0,1,0,0,0,1|2,0,0]=4 1173 B12R0.184 COC(C)CCNCCCC(C)O m_270004__9448698__24721380 [0,1,0,0,0,1|1,0,0]=3 1174 B12R0.184 COC(C)CCNCCOC(C)C m_270004__8750494__24721380 [0,1,0,0,0,1|2,0,0]=4 1175 B12R0.184 COC(C)CCNCCSC(C)C m_270004__10176234__24721380 [0,1,0,0,0,1|2,0,0]=4 1176 B12R0.184 COC(C)CCSCCCC(C)C m_7__22987798__10892836 [0,1,0,0,0,1|1,1,0]=4 1177 B12R0.184 COC(C)CCSCCCC(C)O m_7__22987798__10688172 [0,1,0,0,0,1|0,1,0]=3 1178 B12R0.184 COC(C)CCSCCOC(C)C m_7__22987798__6311 [0,1,0,0,0,1|1,1,0]=4 1179 B12R0.184 COC(C)CCSCCSC(C)C m_7__22987798__9870380 [0,1,0,0,0,1|1,1,0]=4 1180 B12R0.184 COC(C)CCSCOCC(C)C m_7__22987798__12637718 [0,1,0,0,0,1|1,1,0]=4 1181 B12R0.184 COC(C)CCSCSCC(C)C m_7__22987798__15703842 [0,1,0,0,0,1|1,1,0]=4 1182 B12R0.184 COC(C)CNCCCCC(C)C m_270004__9164178__12202092 [0,1,0,0,0,1|2,0,0]=4 1183 B12R0.184 CSC(C)CCNCCCC(C)O m_270004__9448698__24721392 [0,1,0,0,0,1|1,1,0]=4 1184 B12R0.184 C[C@H](CO)NCCOCCN(C)C m_2230__22399532__22379714 [0,1,0,0,0,1|2,0,0]=4 1185 B12R0.270 CC(C)CC(=O)NOCCC(C)O m_22__18244348__58916 [0,1,0,0,0,1|1,0,1]=4 1186 B12R0.270 CC(C)CC(=O)OCCCC(C)O m_1458__473118__9475682 [0,1,0,0,0,1|1,0,1]=4 1187 B12R0.270 CC(C)CC(=O)OCSCC(C)O m_7__10953796__12100826 [0,1,0,0,0,1|1,0,1]=4 1188 B12R0.270 CC(C)CC(C)CNCCC(C)O m_270004__8296476__9736040 [0,1,0,0,0,1|2,0,0]=4 1189 B12R0.270 CC(C)CC(C)CSCCC(C)O m_62__9746872__12057940 [0,1,0,0,0,1|1,1,0]=4 1190 B12R0.270 CC(C)CC(C)NCCCC(C)O m_2230__22399870__9227836 [0,1,0,0,0,1|2,0,0]=4 1191 B12R0.270 CC(C)CCCCN(C)CC(C)O m_2230__22405628__9736146 [0,1,0,0,0,1|2,0,0]=4 1192 B12R0.270 CC(C)CCCCN(C)C[C@@H](C)O m_270004__16620752__12202092 [0,1,0,0,0,1|2,0,0]=4 1193 B12R0.270 CC(C)CCCNC(C)CC(C)O m_207__8644118__7912414 [0,1,0,0,0,1|2,0,0]=4 1194 B12R0.270 CC(C)CCCOC(=O)C[C@@H](C)O m_1458__21596576__10892846 [0,1,0,0,0,1|1,0,1]=4 1195 B12R0.270 CC(C)CCNCC(C)CC(C)O m_207__5506508__134014 [0,1,0,0,0,1|2,0,0]=4 1196 B12R0.270 CC(C)CCONC(=O)CC(C)O m_22__13910456__16946108 [0,1,0,0,0,1|1,0,1]=4 1197 B12R0.270 CC(C)C[C@@H](N)CSCCC(C)O m_7__20871394__12057932 [0,1,0,0,0,1|1,1,0]=4 1198 B12R0.270 CC(C)OCCOC(=O)C[C@@H](C)O m_1458__21596576__484524 [0,1,0,0,0,1|1,0,1]=4 1199 B12R0.270 CC(C)SCCOC(=O)C[C@@H](C)O m_1458__21596576__10158468 [0,1,0,0,0,1|1,0,1]=4 1200 B12R0.270 CC(O)CC(C)NCCOC(C)C m_2230__22399846__6475682 [0,1,0,0,0,1|2,0,0]=4 1201 B12R0.270 CC(O)CC(C)NCCSC(C)C m_2230__22399846__9870384 [0,1,0,0,0,1|2,0,0]=4 1202 B12R0.270 CC(O)CCCNC(=O)CC(C)O m_487__9448674__23862482 [0,1,0,0,0,1|1,0,1]=4 1203 B12R0.270 CC(O)CCCN[C@H](C)C[C@@H](C)N m_269982__22505384__22488660 [0,1,0,0,0,1|2,0,0]=4 1204 B12R0.270 CC(O)CCCOC(=O)CC(C)F m_1458__17511478__9475682 [0,1,0,0,0,1|1,0,1]=4 1205 B12R0.270 CC(O)CCCOC(=O)C[C@@H](C)O m_1458__21596576__9475682 [0,1,0,0,0,1|0,0,1]=3 1206 B12R0.270 CC(O)CCONC(=O)CC(C)F m_22__18244348__17511474 [0,1,0,0,0,1|1,0,1]=4 1207 B12R0.270 CC(O)CCONC(=O)CC(C)O m_22__18244348__16946108 [0,1,0,0,0,1|0,0,1]=3 1208 B12R0.270 CC(O)CCONC(=O)C[C@@H](C)N m_240690__21576330__12625004 [0,1,0,0,0,1|1,0,1]=4 1209 B12R0.3 CC(C)CC(C)OC(=O)C[C@@H](C)O m_1458__21596576__10643632 [0,2,0,0,0,0|1,0,1]=4 1210 B12R0.3 CC(O)CC(=O)NC(C)CC(C)O m_487__8644120__23862482 [0,2,0,0,0,0|1,0,1]=4 1211 B12R0.3 CC(O)CC(=O)N[C@H](C)C[C@H](C)O m_22__22618760__16946108 [0,2,0,0,0,0|1,0,1]=4 1212 B12R0.66 CC(C)CC(=O)OCCC(C)(C)O m_1458__473118__10115556 [0,2,0,0,0,0|1,0,1]=4 1213 B12R0.66 CC(C)CC(C)NCCC(C)(C)O m_2230__22399870__6584442 [0,2,0,0,0,0|2,0,0]=4 1214 B12R0.66 CC(C)CC(C)SCCC(C)(C)O m_7__11758710__10641634 [0,2,0,0,0,0|1,1,0]=4 1215 B12R0.66 CC(F)CC(=O)OCCC(C)(C)O m_1458__17511478__10115556 [0,2,0,0,0,0|1,0,1]=4 1216 B12R0.66 CC(O)CC(=O)NCCC(C)(C)O m_487__8992654__23862482 [0,2,0,0,0,0|1,0,1]=4 1217 B12R0.66 CC(O)CC(C)NCCC(C)(C)C m_207__8644118__2989446 [0,2,0,0,0,0|2,0,0]=4 1218 B12R0.66 CC(O)CC(C)NCCC(C)(C)F m_2230__22399846__16725012 [0,2,0,0,0,0|2,0,0]=4 1219 B12R0.66 CC(O)CC(C)NCCC(C)(C)O m_2230__22399846__6584442 [0,2,0,0,0,0|1,0,0]=3 1220 B12R0.66 CC(O)CC(C)NCCC(C)(F)F m_2230__22399846__16619060 [0,2,0,0,0,0|2,0,0]=4 1221 B12R0.66 C[C@@H](O)CC(=O)OCCC(C)(C)C m_1458__21596576__495434 [0,2,0,0,0,0|1,0,1]=4 1222 B12R0.66 C[C@@H](O)CC(=O)OCCC(C)(C)F m_1458__21596576__16725010 [0,2,0,0,0,0|1,0,1]=4 1223 B12R0.66 C[C@@H](O)CC(=O)OCCC(C)(C)O m_1458__21596576__10115556 [0,2,0,0,0,0|0,0,1]=3 1224 B12R0.66 C[C@@H](O)CC(=O)OCCC(C)(F)F m_1458__21596576__16619058 [0,2,0,0,0,0|1,0,1]=4 1225 B12R0.140 CC(C)CCNC(C)CC(C)(C)O m_207__10706934__134014 [0,2,0,0,0,0|2,0,0]=4 1226 B12R0.140 CC(F)CCNC(C)CC(C)(C)O m_2230__22397014__13165354 [0,2,0,0,0,0|2,0,0]=4 1227 B12R0.140 CC(O)CCCN(C)CC(C)(C)O m_2230__22405892__7638994 [0,2,0,0,0,0|2,0,0]=4 1228 B12R0.140 CC(O)CCNC(=O)CC(C)(C)O m_527__7348178__9477926 [0,2,0,0,0,0|1,0,1]=4 1229 B12R0.140 CC(O)CCNC(C)CC(C)(C)C m_2230__22397006__12057944 [0,2,0,0,0,0|2,0,0]=4 1230 B12R0.140 CC(O)CCNC(C)CC(C)(C)O m_2230__22397014__12057944 [0,2,0,0,0,0|1,0,0]=3 1231 B12R0.140 CC(O)CCOC(=O)CC(C)(C)C m_1458__473480__12057942 [0,2,0,0,0,0|1,0,1]=4 1232 B12R0.140 CC(O)CCOC(=O)CC(C)(F)F m_1458__9320326__12057942 [0,2,0,0,0,0|1,0,1]=4 1233 B12R0.140 CC(O)CNCC(O)CC(C)(C)O m_273610__11554114__12863316 [0,2,0,0,0,0|2,0,0]=4 1234 B12R0.140 C[C@@H](O)CCNC(=O)CC(C)(C)O m_22__7344840__9477924 [0,2,0,0,0,0|1,0,1]=4 1235 B12R0.240 C=CC(C)CC(=O)OCCC(C)O m_1458__16520648__12057942 [0,2,0,0,0,0|1,0,1]=4 1236 B12R0.240 CC(O)CCCN(C)CC(C)CO m_2230__22405892__7968764 [0,2,0,0,0,0|2,0,0]=4 1237 B12R0.240 CC(O)CCCN(C)CC(O)CF m_2230__14324520__9227836 [0,2,0,0,0,0|2,0,0]=4 1238 B12R0.240 CC(O)CCCN(C)CC(O)CN m_269982__10880336__22488660 [0,2,0,0,0,0|2,0,0]=4 1239 B12R0.240 CC(O)CCCN(C)CC(O)CO m_2230__22405892__3173054 [0,2,0,0,0,0|2,0,0]=4 1240 B12R0.240 CC(O)CCCN(C)C[C@@H](O)CO m_2230__22405902__9227836 [0,2,0,0,0,0|2,0,0]=4 1241 B12R0.240 CC(O)CCCN(C)C[C@H](O)CO m_2230__22405892__679958 [0,2,0,0,0,0|2,0,0]=4 1242 B12R0.240 CC(O)CCNC(=O)CC(O)CN m_240690__7354366__12421074 [0,2,0,0,0,0|1,0,1]=4 1243 B12R0.240 CC(O)CCNC(C)CC(C)C#N m_270004__8296476__24722868 [0,2,0,0,0,0|2,0,0]=4 1244 B12R0.240 CCC(C)CC(=O)OCCC(C)O m_1458__9278280__12057942 [0,2,0,0,0,0|1,0,1]=4 1245 B12R0.240 CCC(C)CC(C)NCCC(C)O m_270004__8296476__24709378 [0,2,0,0,0,0|2,0,0]=4 1246 B12R0.240 CCC(O)CC(=O)OCCC(C)C m_1458__10643986__485572 [0,2,0,0,0,0|1,0,1]=4 1247 B12R0.240 CCC(O)CC(=O)OCCC(C)F m_1458__10643986__13165350 [0,2,0,0,0,0|1,0,1]=4 1248 B12R0.240 CCC(O)CC(=O)OCCC(C)O m_1458__10643986__12057942 [0,2,0,0,0,0|0,0,1]=3 1249 B12R0.240 CCC(O)CN(C)CCCC(C)O m_2230__15766958__9227836 [0,2,0,0,0,0|2,0,0]=4 1250 B12R0.240 CC[C@H](O)CC(=O)NCCC(C)O m_22__5128424__24596596 [0,2,0,0,0,0|1,0,1]=4 1251 B12R0.240 CC[C@H](O)CC(=O)NCC[C@@H](C)O m_22__7344840__24596596 [0,2,0,0,0,0|1,0,1]=4 1252 B12R0.240 COC(C)CC(=O)NCCC(C)O m_527__7348178__2501982 [0,2,0,0,0,0|1,0,1]=4 1253 B12R0.240 COC(C)CC(=O)NCC[C@@H](C)O m_22__7344840__2501980 [0,2,0,0,0,0|1,0,1]=4 1254 B12R0.240 COC(C)CC(=O)OCCC(C)C m_276436__14076546__14093674 [0,2,0,0,0,0|1,0,1]=4 1255 B12R0.240 COC(C)CC(=O)OCCC(C)F m_1458__2501986__13165350 [0,2,0,0,0,0|1,0,1]=4 1256 B12R0.240 COC(C)CC(=O)OCCC(C)O m_1458__2501986__12057942 [0,2,0,0,0,0|0,0,1]=3 1257 B12R0.240 COC(C)CC(=O)OCC[C@H](C)F m_276436__17563626__14093674 [0,2,0,0,0,0|1,0,1]=4 1258 B12R0.240 COC(C)CN(C)CCCC(C)O m_2230__10158424__9227836 [0,2,0,0,0,0|2,0,0]=4 1259 B12R0.240 CSC(C)CC(=O)OCCC(C)O m_1458__7841324__12057942 [0,2,0,0,0,0|0,1,1]=4 1260 B12R0.240 C[C@@H](O)CCNC(=O)CC(O)CN m_240690__17697168__12421074 [0,2,0,0,0,0|1,0,1]=4 1261 B12R0.241 CC(C)CC(C)NCCC(C)CO m_269862__24471902__7200174 [0,2,0,0,0,0|2,0,0]=4 1262 B12R0.241 CC(C)CC(C)NCC[C@@H](O)CO m_269862__14590510__7200174 [0,2,0,0,0,0|2,0,0]=4 1263 B12R0.241 CC(O)CC(=O)NCCC(C)CO m_22__24035480__16946108 [0,2,0,0,0,0|1,0,1]=4 1264 B12R0.241 CC(O)CC(=O)NCCC(O)CO m_22__24036076__16946108 [0,2,0,0,0,0|1,0,1]=4 1265 B12R0.241 CC(O)CC(=O)NCC[C@@H](O)CO m_487__14590490__23862482 [0,2,0,0,0,0|1,0,1]=4 1266 B12R0.241 CC(O)CN(C)CCCC(O)CO m_2230__22405068__9736146 [0,2,0,0,0,0|2,0,0]=4 1267 B12R0.241 CCC(C)CCOC(=O)C[C@@H](C)O m_1458__21596576__20058096 [0,2,0,0,0,0|1,0,1]=4 1268 B12R0.241 CCC(O)CCNC(=O)CC(C)O m_487__7143332__23862482 [0,2,0,0,0,0|1,0,1]=4 1269 B12R0.241 CCC(O)CCNC(C)CC(C)C m_269862__7199956__7200174 [0,2,0,0,0,0|2,0,0]=4 1270 B12R0.241 CCC(O)CCN[C@H](C)C[C@@H](C)N m_269982__22505384__22488686 [0,2,0,0,0,0|2,0,0]=4 1271 B12R0.241 CCC(O)CCOC(=O)CC(C)C m_1458__473118__16640712 [0,2,0,0,0,0|1,0,1]=4 1272 B12R0.241 CCC(O)CCOC(=O)CC(C)F m_1458__17511478__16640712 [0,2,0,0,0,0|1,0,1]=4 1273 B12R0.241 CCC(O)CCOC(=O)C[C@@H](C)O m_1458__21596576__16640712 [0,2,0,0,0,0|0,0,1]=3 1274 B12R0.241 CCC(O)CCSC(C)CC(C)C m_62__16640708__10643630 [0,2,0,0,0,0|1,1,0]=4 1275 B12R0.241 COC(C)CCNC(=O)CC(C)O m_487__10742044__23862482 [0,2,0,0,0,0|1,0,1]=4 1276 B12R0.241 COC(C)CCNC(C)CC(C)C m_269862__10742082__7200174 [0,2,0,0,0,0|2,0,0]=4 1277 B12R0.241 COC(C)CCNC(C)CC(C)O m_270004__8644134__24721380 [0,2,0,0,0,0|1,0,0]=3 1278 B12R0.241 COC(C)CCN[C@H](C)C[C@@H](C)N m_269982__22505384__22488948 [0,2,0,0,0,0|2,0,0]=4 1279 B12R0.241 COC(C)CCOC(=O)CC(C)C m_276436__14078514__14085888 [0,2,0,0,0,0|1,0,1]=4 1280 B12R0.241 COC(C)CCOC(=O)CC(C)F m_276436__14078514__17511488 [0,2,0,0,0,0|1,0,1]=4 1281 B12R0.241 COC(C)CCSC(C)CC(C)C m_7__22987798__10641634 [0,2,0,0,0,0|1,1,0]=4 1282 B12R0.241 CSC(C)CCNC(C)CC(C)O m_270004__8644134__24721392 [0,2,0,0,0,0|1,1,0]=4 1283 B12R0.258 CC(C)CC(C)N(C)CCC(C)O m_2230__2029542__12057944 [0,2,0,0,0,0|2,0,0]=4 1284 B12R0.258 CC(C)CC(C)N(C)CC[C@H](C)O m_2230__18186218__10643634 [0,2,0,0,0,0|2,0,0]=4 1285 B12R0.258 CC(O)CC(=O)N(C)CC[C@@H](C)O m_22__22619024__16946108 [0,2,0,0,0,0|1,0,1]=4 1286 B12R0.258 CC(O)CC(=O)N(C)CC[C@H](C)O m_487__18186214__23862482 [0,2,0,0,0,0|1,0,1]=4 1287 B12R0.535 C#C[C@@H](CC(C)C)NCCC(C)O m_2230__22397338__12057944 [0,2,0,0,0,0|2,0,0]=4 1288 B12R0.535 CC(C)C[C@@H](CN)NCCC(C)O m_269982__22505246__22488918 [0,2,0,0,0,0|2,0,0]=4 1289 B12R0.535 CC(C)C[C@H](CO)NCCC(C)O m_2230__22397488__12057944 [0,2,0,0,0,0|2,0,0]=4 1290 B12R0.535 CCC(CC(C)C)NCCC(C)O m_270004__8296476__24709410 [0,2,0,0,0,0|2,0,0]=4 1291 B12R0.535 CCC(CC(C)O)NCCC(C)C m_207__12643994__134014 [0,2,0,0,0,0|2,0,0]=4 1292 B12R0.535 CCN(CCCC(C)O)CC(C)O m_2230__5344536__9227836 [0,2,0,0,0,0|2,0,0]=4 1293 B12R0.535 CCN(CCCC(C)O)C[C@H](C)O m_2230__17693280__9227836 [0,2,0,0,0,0|2,0,0]=4 1294 B12R0.686 CC(O)CCNC(=O)[C@@H](N)[C@@H](C)O m_240690__7354366__14033600 [0,2,0,0,0,0|1,0,1]=4 1295 B12R0.686 CC(O)CCOC(=O)C(Br)C(C)C m_1458__21466856__12057942 [0,2,0,0,0,0|1,0,1]=4 1296 B12R0.686 CC(O)CCOC(=O)C(C)C(C)C m_1458__4840320__12057942 [0,2,0,0,0,0|1,0,1]=4 1297 B12R0.686 CC(O)CCOC(=O)C(F)C(C)C m_1458__9156248__12057942 [0,2,0,0,0,0|1,0,1]=4 1298 B12R0.686 C[C@@H](O)CCNC(=O)[C@@H](N)[C@@H](C)O m_240690__17697168__14033600 [0,2,0,0,0,0|1,0,1]=4 1299 B12R0.687 CC(C)C(C)COC(=O)C[C@@H](C)O m_1458__21596576__16618962 [0,2,0,0,0,0|1,0,1]=4 1300 B12R0.687 CC(C)C(O)COC(=O)C[C@@H](C)O m_1458__21596576__11982578 [0,2,0,0,0,0|1,0,1]=4 1301 B12R0.687 CC(C)CC(C)NCC(C)C(C)O m_270004__23847178__8157306 [0,2,0,0,0,0|2,0,0]=4 1302 B12R0.687 CC(O)CC(=O)NCC(C)C(C)O m_487__17552438__23862482 [0,2,0,0,0,0|1,0,1]=4 1303 B12R0.687 CC(O)CC(=O)NCC(O)C(C)O m_487__12526014__23862482 [0,2,0,0,0,0|1,0,1]=4 1304 B12R0.697 CC(C)CC(C)(C)NCCC(C)O m_2230__22394074__12057944 [0,2,0,0,0,0|2,0,0]=4 1305 B12R0.697 CC(O)CNCC(C)(C)CC(C)O m_273610__11524204__11516404 [0,2,0,0,0,0|2,0,0]=4 1306 B12R0.86 CC(O)CCONC(=O)C(C)CO m_22__18244348__16784146 [0,2,0,0,0,0|1,0,1]=4 1307 B12R0.86 CC(O)CCONC(=O)C(O)CF m_22__18244348__24597988 [0,2,0,0,0,0|1,0,1]=4 1308 B12R0.86 CC(O)CCONC(=O)C(O)CN m_240690__21576330__13421828 [0,2,0,0,0,0|1,0,1]=4 1309 B12R0.86 CC(O)CCONC(=O)[C@H](C)ON m_240690__21576330__15151134 [0,2,0,0,0,0|1,0,1]=4 1310 B12R0.86 CC[C@@H](O)C(=O)NOCCC(C)O m_22__18244348__14760026 [0,2,0,0,0,0|1,0,1]=4 1311 B12R0.86 COC(C)C(=NOCCC(C)O)N m_34__6483136__12057934 [0,2,0,0,0,0|1,0,1]=4 1312 B12R0.86 CO[C@@H](C)C(=O)NOCCC(C)O m_22__18244348__16232090 [0,2,0,0,0,0|1,0,1]=4 1313 B12R0.86 CO[C@@H](C)[C@H](C)NCCCC(C)O m_2230__22397856__9227836 [0,2,0,0,0,0|2,0,0]=4 1314 B12R0.139 CC(C)C(C)CN(C)CC[C@H](C)O m_2230__18186218__16618964 [0,2,0,0,0,0|2,0,0]=4 1315 B12R0.139 CC(C)C(O)CN(C)CC[C@H](C)O m_2230__18186218__17609374 [0,2,0,0,0,0|2,0,0]=4 1316 B12R0.139 CC(C)[C@@H](N)CN(C)CC[C@H](C)O m_269982__18186278__25012484 [0,2,0,0,0,0|2,0,0]=4 1317 B12R0.139 CC(O)CCN(C)CC(C)C(C)C m_2230__16925434__12057944 [0,2,0,0,0,0|2,0,0]=4 1318 B12R0.139 CC(O)CNC(=O)C[C@H](N)[C@H](C)O m_240690__17023110__24777224 [0,2,0,0,0,0|2,0,0]=4 1319 B12R0.186 CC(C)C(O)CNCC[C@@H](O)CO m_273610__14590518__17609376 [0,2,0,0,0,0|2,0,0]=4 1320 B12R0.186 CC(CO)CCNCC(O)C(C)C m_273610__24471926__17609376 [0,2,0,0,0,0|2,0,0]=4 1321 B12R0.186 CCC(O)CCNCC(O)C(C)C m_273610__11554326__17609376 [0,2,0,0,0,0|2,0,0]=4 1322 B12R0.186 CCC(O)CCSCC(C)C(C)C m_62__16618958__16640710 [0,2,0,0,0,0|1,1,0]=4 1323 B12R0.186 COC(C)CCNCC(C)C(C)C m_270004__16787178__24721380 [0,2,0,0,0,0|2,0,0]=4 1324 B12R0.186 COC(C)CCNCC(C)C(C)O m_270004__23847178__24721380 [0,2,0,0,0,0|1,0,0]=3 1325 B12R0.186 COC(C)CCNCC(O)C(C)C m_273610__11530008__17609376 [0,2,0,0,0,0|2,0,0]=4 1326 B12R0.186 COC(C)CCSCC(C)C(C)C m_7__22987798__16618954 [0,2,0,0,0,0|1,1,0]=4 1327 B12R0.186 COC(C)CCSCC(O)C(C)C m_7__22987798__11982594 [0,2,0,0,0,0|1,1,0]=4 1328 B12R0.186 CSC(C)CCNCC(C)C(C)O m_270004__23847178__24721392 [0,2,0,0,0,0|1,1,0]=4 1329 B12R0.238 CC(O)CCCN[C@@H](CO)[C@@H](C)O m_2230__22404806__9227836 [0,2,0,0,0,0|2,0,0]=4 1330 B12R0.238 CCC(CNCCC(C)O)C(C)C m_270004__8296476__17825422 [0,2,0,0,0,0|2,0,0]=4 1331 B12R0.238 COC(CNCCC(C)O)C(C)C m_270004__8296476__10542806 [0,2,0,0,0,0|2,0,0]=4 1332 B12R0.238 COC(CSCCC(C)O)C(C)C m_62__12057938__11619348 [0,2,0,0,0,0|1,1,0]=4 1333 B12R0.264 CC(C)C(C)CSCCC(C)(C)O m_7__11758710__16618954 [0,2,0,0,0,0|1,1,0]=4 1334 B12R0.264 CC(C)C(O)CNCCC(C)(C)O m_273610__11527254__17609376 [0,2,0,0,0,0|2,0,0]=4 1335 B12R0.264 CC(C)C(O)CSCCC(C)(C)O m_7__11758710__11982594 [0,2,0,0,0,0|1,1,0]=4 1336 B12R0.264 CC(O)C(C)CNCCC(C)(C)C m_207__17552436__2989446 [0,2,0,0,0,0|2,0,0]=4 1337 B12R0.264 CC(O)C(C)NCCCC(C)(C)O m_269862__13972466__13817824 [0,2,0,0,0,0|2,0,0]=4 1338 B12R0.264 CC(O)C(O)CNCCC(C)(C)C m_207__12526012__2989446 [0,2,0,0,0,0|2,0,0]=4 1339 B12R0.269 CC(C)CCNC[C@@H](F)C(C)(C)O m_207__18184876__134014 [0,2,0,0,0,0|2,0,0]=4 1340 B12R0.269 CC(O)CCCNC(C)C(C)(C)O m_269862__9448696__14430198 [0,2,0,0,0,0|2,0,0]=4 1341 B12R0.269 CC(O)CCCN[C@@H](C)C(C)(C)O m_2230__22399856__9227836 [0,2,0,0,0,0|2,0,0]=4 1342 B12R0.269 CC(O)CCNCC(C)C(C)(C)C m_270004__8296476__9864822 [0,2,0,0,0,0|2,0,0]=4 1343 B12R0.269 CC(O)CCNCC(O)C(C)(C)F m_273610__11554168__22983918 [0,2,0,0,0,0|2,0,0]=4 1344 B12R0.269 CC(O)CCONC(=O)C(C)(C)O m_22__18244348__8987436 [0,2,0,0,0,0|1,0,1]=4 1345 B12R0.269 CC(O)CCSCC(C)C(C)(C)C m_62__12057938__12549106 [0,2,0,0,0,0|1,1,0]=4 1346 B12R0.269 CC(O)CCSCC(C)C(C)(F)F m_62__12057938__16618864 [0,2,0,0,0,0|1,1,0]=4 1347 B12R0.692 CC(C)CCNCC(C)(C)C(C)O m_207__13603810__134014 [0,2,0,0,0,0|2,0,0]=4 1348 B12R0.692 CC(O)CCCNC(C)(C)C(C)O m_2230__22393694__10688176 [0,2,0,0,0,0|2,0,0]=4 1349 B12R0.692 CC(O)CCNCC(C)(C)C(C)C m_270004__8296476__17833424 [0,2,0,0,0,0|2,0,0]=4 1350 B12R0.150 CC(C)(C)CCNCC[C@@H](O)CO m_207__14590488__2989446 [0,2,0,0,0,0|2,0,0]=4 1351 B12R0.150 CC(C)(O)CCCNC[C@H](O)CF m_273610__13972482__14323916 [0,2,0,0,0,0|2,0,0]=4 1352 B12R0.150 CC(CO)CCNCCC(C)(C)C m_207__24471928__2989446 [0,2,0,0,0,0|2,0,0]=4 1353 B12R0.150 CC(CO)SCOCCC(C)(C)C m_7__6338928__10548620 [0,2,0,0,0,0|2,0,0]=4 1354 B12R0.150 CCC(C)CCSCCC(C)(C)O m_7__11758710__20058094 [0,2,0,0,0,0|1,1,0]=4 1355 B12R0.150 CCC(O)CCNCCC(C)(C)C m_207__7143330__2989446 [0,2,0,0,0,0|2,0,0]=4 1356 B12R0.150 CCC(O)CCSCCC(C)(C)C m_62__9143140__16640710 [0,2,0,0,0,0|1,1,0]=4 1357 B12R0.150 CCC(O)CCSCCC(C)(C)F m_62__16725006__16640710 [0,2,0,0,0,0|1,1,0]=4 1358 B12R0.150 CCC(O)CCSCCC(C)(C)O m_7__11758710__16640702 [0,2,0,0,0,0|0,1,0]=3 1359 B12R0.150 CCC(O)CCSCCC(C)(F)F m_62__16619054__16640710 [0,2,0,0,0,0|1,1,0]=4 1360 B12R0.150 CCC(O)CNCCCC(C)(C)O m_273610__13972482__11516276 [0,2,0,0,0,0|2,0,0]=4 1361 B12R0.150 COC(C)CCNCCC(C)(C)C m_207__10742040__2989446 [0,2,0,0,0,0|2,0,0]=4 1362 B12R0.150 COC(C)CCNCCC(C)(C)F m_270004__11987206__24721380 [0,2,0,0,0,0|2,0,0]=4 1363 B12R0.150 COC(C)CCNCCC(C)(C)O m_270004__8992694__24721380 [0,2,0,0,0,0|1,0,0]=3 1364 B12R0.150 COC(C)CCNCCC(C)(F)F m_270004__10640010__24721380 [0,2,0,0,0,0|2,0,0]=4 1365 B12R0.150 COC(C)CCSCCC(C)(C)C m_7__22987798__22787366 [0,2,0,0,0,0|1,1,0]=4 1366 B12R0.150 COC(C)CCSCCC(C)(C)F m_7__22987798__16725000 [0,2,0,0,0,0|1,1,0]=4 1367 B12R0.150 COC(C)CCSCCC(C)(C)O m_7__22987798__11686960 [0,2,0,0,0,0|0,1,0]=3 1368 B12R0.150 COC(C)CCSCCC(C)(F)F m_7__22987798__16619050 [0,2,0,0,0,0|1,1,0]=4 1369 B12R0.150 CSC(C)CCNCCC(C)(C)O m_270004__8992694__24721392 [0,2,0,0,0,0|1,1,0]=4 1370 B12R0.210 CC(C)CCNCCC(C)(C)CO m_207__17547786__134014 [0,2,0,0,0,0|2,0,0]=4 1371 B12R0.210 CC(O)CCCSCC(C)(C)CO m_7__15105602__10688172 [0,2,0,0,0,0|2,0,0]=4 1372 B12R0.210 CC(O)CCSCCC(C)(C)C#N m_62__10177344__12057940 [0,2,0,0,0,0|1,1,0]=4 1373 B12R0.210 CC(O)CNCCCC(C)(C)CO m_273610__11525242__11516404 [0,2,0,0,0,0|2,0,0]=4 1374 B12R0.210 CCC(C)(C)CCSCCC(C)O m_62__12057938__11972490 [0,2,0,0,0,0|1,1,0]=4 1375 B12R0.210 COC(C)(C)CCCNCC(C)O m_273610__21497740__11516404 [0,2,0,0,0,0|2,0,0]=4 1376 B12R0.210 COC(C)(C)CCNCCC(C)C m_207__12547666__134014 [0,2,0,0,0,0|2,0,0]=4 1377 B12R0.210 COC(C)(C)CCSCCC(C)C m_62__7021584__9196656 [0,2,0,0,0,0|1,1,0]=4 1378 B12R0.210 COC(C)(C)CCSCCC(C)F m_62__13165346__9196656 [0,2,0,0,0,0|1,1,0]=4 1379 B12R0.210 COC(C)(C)CCSCCC(C)N m_34__20871470__9196648 [0,2,0,0,0,0|1,1,0]=4 1380 B12R0.210 COC(C)(C)CCSCCC(C)O m_62__12057938__9196656 [0,2,0,0,0,0|0,1,0]=3 1381 B12R0.210 COC(C)(C)CNCCCC(C)O m_270004__9448698__13287028 [0,2,0,0,0,0|2,0,0]=4 1382 B12R0.390 CC(O)CCN(C)CCC(C)(C)C m_2230__11571332__12057944 [0,2,0,0,0,0|2,0,0]=4 1383 B12R0.390 CC(O)CNC(=O)CCC(C)(C)O m_22__564336__8957346 [0,2,0,0,0,0|2,0,0]=4 1384 B12R0.390 CC(O)CNC(C)CCC(C)(C)O m_269862__7192560__15064412 [0,2,0,0,0,0|2,0,0]=4 1385 B12R0.390 C[C@H](O)CCN(C)CCC(C)(C)C m_2230__18186218__9276538 [0,2,0,0,0,0|2,0,0]=4 1386 B12R0.390 C[C@H](O)CCN(C)CCC(C)(C)F m_2230__18186218__16725012 [0,2,0,0,0,0|2,0,0]=4 1387 B12R0.390 C[C@H](O)CCN(C)CCC(C)(C)O m_2230__18186218__6584442 [0,2,0,0,0,0|1,0,0]=3 1388 B12R0.390 C[C@H](O)CCN(C)CCC(C)(F)F m_2230__18186218__16619060 [0,2,0,0,0,0|2,0,0]=4 1389 B12R0.638 CC(C)(C)CCNCCC(C)(C)O m_207__8992650__2989446 [0,2,0,0,0,0|2,0,0]=4 1390 B12R0.638 CC(C)(C)CCSCCC(C)(C)O m_7__22988126__11686960 [0,2,0,0,0,0|1,1,0]=4 1391 B12R0.638 CC(C)(O)CCSCCC(C)(C)F m_7__11758710__16725000 [0,2,0,0,0,0|1,1,0]=4 1392 B12R0.638 CC(C)(O)CCSCCC(C)(C)O m_7__11758710__11686960 [0,2,0,0,0,0|0,1,0]=3 1393 B12R0.638 CC(C)(O)CCSCCC(C)(F)F m_7__22988020__11686960 [0,2,0,0,0,0|1,1,0]=4 1394 B12R0.189 CC(C)CCN(C)CCC(O)CO m_2230__22407568__681192 [0,2,0,0,0,0|2,0,0]=4 1395 B12R0.189 CC(F)CCN(C)CCC(O)CO m_2230__22407568__13165354 [0,2,0,0,0,0|2,0,0]=4 1396 B12R0.189 CC(O)CCN(C)CCC(O)CO m_2230__22407568__12057944 [0,2,0,0,0,0|1,0,0]=3 1397 B12R0.189 CCC(C)CCN(C)CC[C@H](C)O m_2230__18186218__20058362 [0,2,0,0,0,0|2,0,0]=4 1398 B12R0.189 CCC(O)CCN(C)CC[C@H](C)O m_2230__18186218__16640714 [0,2,0,0,0,0|1,0,0]=3 1399 B12R0.189 CC[C@H](N)CCN(C)CC[C@H](C)O m_269982__18186278__22485976 [0,2,0,0,0,0|2,0,0]=4 1400 B12R0.189 COC(C)CCC(=O)NCC(C)O m_527__564580__8635232 [0,2,0,0,0,0|2,0,0]=4 1401 B12R0.189 COC(C)CCC(=O)OCC(C)O m_1458__8635236__9780094 [0,2,0,0,0,0|2,0,0]=4 1402 B12R0.189 COC(C)CCN(C)CC[C@H](C)O m_2230__18186218__22384146 [0,2,0,0,0,0|1,0,0]=3 1403 B12R0.189 CSC(C)CCN(C)CC[C@H](C)O m_270004__18186228__24721392 [0,2,0,0,0,0|1,1,0]=4 1404 B12R0.189 C[C@@H](N)CCN(C)CCC(O)CO m_269982__22515744__25012466 [0,2,0,0,0,0|2,0,0]=4 1405 B12R0.35 CCC(CC)CCNCCC(C)O m_270004__8296476__24715064 [0,2,0,0,0,0|2,0,0]=4 1406 B12R0.35 CCC(CC)CCSCCC(C)O m_7__22987542__12057932 [0,2,0,0,0,0|1,1,0]=4 1407 B12R0.35 CCC(CSCCCC(C)O)OC m_7__22987482__10688172 [0,2,0,0,0,0|2,0,0]=4 1408 B12R0.35 COC(CCCSCC(C)O)OC m_7__10953796__17507884 [0,2,0,0,0,0|2,0,0]=4 1409 B12R0.35 COC(CCNCCC(C)C)OC m_207__22000544__134014 [0,2,0,0,0,0|2,0,0]=4 1410 B12R0.35 COC(CNCCCC(C)O)OC m_270004__9448698__24721108 [0,2,0,0,0,0|2,0,0]=4 1411 B12R0.35 COC(CSCCCC(C)O)OC m_7__14468178__10688172 [0,2,0,0,0,0|2,0,0]=4 1412 B12R0.183 C=CC(C)CCNCCC(C)OC m_270004__23842090__24721380 [0,2,0,0,0,0|2,0,0]=4 1413 B12R0.183 CC(CO)CCCNC[C@H](O)CF m_273610__11525942__14323916 [0,2,0,0,0,0|2,0,0]=4 1414 B12R0.183 CCC(C)CCNCCC(C)OC m_270004__11970592__24721380 [0,2,0,0,0,0|2,0,0]=4 1415 B12R0.183 CCC(C)CCSCCC(C)OC m_7__22987798__20058094 [0,2,0,0,0,0|1,1,0]=4 1416 B12R0.183 CCC(C)CCSCCC(O)CC m_62__20058276__16640710 [0,2,0,0,0,0|1,1,0]=4 1417 B12R0.183 CCC(O)CCNCCC(C)OC m_270004__8299014__24721380 [0,2,0,0,0,0|1,0,0]=3 1418 B12R0.183 CCC(O)CCNCCC(C)SC m_270004__8299014__24721392 [0,2,0,0,0,0|1,1,0]=4 1419 B12R0.183 CCC(O)CCSCCC(C)OC m_7__22987798__16640702 [0,2,0,0,0,0|0,1,0]=3 1420 B12R0.183 CCC(O)CCSCCC(O)CC m_62__16640708__16640710 [0,2,0,0,0,0|0,1,0]=3 1421 B12R0.183 CCC(O)CNCCCC(C)CO m_273610__11525942__11516276 [0,2,0,0,0,0|2,0,0]=4 1422 B12R0.183 COC(C)CCNCCC(C)CO m_270004__23845770__24721380 [0,2,0,0,0,0|1,0,0]=3 1423 B12R0.183 COC(C)CCNCCC(C)OC m_270004__10742084__24721380 [0,2,0,0,0,0|1,0,0]=3 1424 B12R0.183 COC(C)CCNCCC(C)SC m_270004__8293102__24721380 [0,2,0,0,0,0|1,1,0]=4 1425 B12R0.183 COC(C)CCNCCN(C)OC m_270004__12889280__24721380 [0,2,0,0,0,0|2,0,0]=4 1426 B12R0.183 CSC(C)CCNCCC(C)CO m_270004__23845770__24721392 [0,2,0,0,0,0|1,1,0]=4 1427 B12R0.277 CC(C)CCNCCC(C)CCO m_207__10641302__134014 [0,2,0,0,0,0|2,0,0]=4 1428 B12R0.277 CC(C)CCNCC[C@@H](O)CCO m_207__21538904__134014 [0,2,0,0,0,0|2,0,0]=4 1429 B12R0.277 CC(C)CCOCCN(C)CCO m_2230__679202__1160064 [0,2,0,0,0,0|2,0,0]=4 1430 B12R0.277 CCCC(C)CCNCCC(C)O m_270004__8296476__24594192 [0,2,0,0,0,0|2,0,0]=4 1431 B12R0.277 CCCC(O)CCNCCC(C)C m_207__13214980__134014 [0,2,0,0,0,0|2,0,0]=4 1432 B12R0.277 COCC(C)CCNCCC(C)C m_270004__8288586__25072176 [0,2,0,0,0,0|2,0,0]=4 1433 B12R0.277 COCC(C)CCNCCC(C)F m_270004__10546066__25072176 [0,2,0,0,0,0|2,0,0]=4 1434 B12R0.277 COCC(C)CCNCCC(C)O m_270004__8296476__25072176 [0,2,0,0,0,0|1,0,0]=3 1435 B12R0.277 COCC(C)CSCCCC(C)O m_7__20064958__10688172 [0,2,0,0,0,0|2,0,0]=4 1436 B12R0.277 COCC(O)CCNCCC(C)C m_207__7963506__134014 [0,2,0,0,0,0|2,0,0]=4 1437 B12R0.277 COC[C@H](O)CNCCCC(C)O m_273610__11554480__11516246 [0,2,0,0,0,0|2,0,0]=4 1438 B12R0.277 CSCC(O)CNCCCC(C)O m_273610__11554480__11516278 [0,2,0,0,0,0|2,0,0]=4 1439 B10R1.10 CCCC1CN(CCO1)C m_2230__7877410__2463448 [1,0,0,1,0,0|2,0,0]=4 1440 B10R1.10 CCCN1CCCC(C1)O m_2230__678744__13271112 [1,0,0,1,0,0|2,0,0]=4 1441 B10R1.10 CCNC1CCCC(C1)O m_270004__8349768__24715004 [1,0,0,1,0,0|2,0,0]=4 1442 B10R1.10 CCS[C@@H]1CCC[C@@H](C1)O m_7__17656074__5047 [1,0,0,1,0,0|2,0,0]=4 1443 B10R1.10 CN1CCOC(C1)CCO m_2230__12851746__2463448 [1,0,0,1,0,0|2,0,0]=4 1444 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[1,0,0,1,0,0|2,0,0]=4 1457 B10R1.16 CSCCC1CCC(O1)C m_62__15746376__876088 [1,0,0,1,0,0|2,0,0]=4 1458 B10R1.16 CSCCN1CC[C@@H](C1)O m_2230__3351214__681390 [1,0,0,1,0,0|2,0,0]=4 1459 B10R1.16 NCCCN1CC[C@@H](C1)O m_269982__13594114__10880302 [1,0,0,1,0,0|2,0,0]=4 1460 B10R1.16 N[C@@H]1CCN(C1)CCCO m_269982__7368756__22497532 [1,0,0,1,0,0|2,0,0]=4 1461 B10R1.16 OCCCN1CC[C@@H](C1)F m_2230__10719192__680950 [1,0,0,1,0,0|2,0,0]=4 1462 B10R1.16 OCCCN1CC[C@@H](C1)O m_2230__3351214__680950 [1,0,0,1,0,0|1,0,0]=3 1463 B10R1.16 OCCCN1CC[C@H](C1)F m_2230__10719368__680950 [1,0,0,1,0,0|2,0,0]=4 1464 B10R1.16 OCCSC1CCC(C1)O m_7__17795750__6166114 [1,0,0,1,0,0|2,0,0]=4 1465 B10R1.16 O[C@H]1CCN(C1)CCCF m_2230__3351214__16896936 [1,0,0,1,0,0|2,0,0]=4 1466 B10R1.18 CC(O)CN1CCCCC1 m_2230__679042__9736146 [1,0,0,1,0,0|2,0,0]=4 1467 B10R1.18 CN(C)CC1CCCCO1 m_2230__1182344__2463448 [1,0,0,1,0,0|2,0,0]=4 1468 B10R1.24 CC1CC(C1)NCCCO m_269862__7192678__8852816 [1,0,0,1,0,0|2,0,0]=4 1469 B10R1.24 CCC=NOC1CC(C1)O m_34__17309904__17696138 [1,0,0,1,0,0|1,0,1]=4 1470 B10R1.24 CCCCNC1CC(C1)C m_269862__7192636__8852816 [1,0,0,1,0,0|2,0,0]=4 1471 B10R1.24 CCNCCC1CC(C1)O m_270004__9330360__24715004 [1,0,0,1,0,0|2,0,0]=4 1472 B10R1.24 CCNCC[C@H]1C[C@@H](C1)O m_270004__23845852__24715004 [1,0,0,1,0,0|2,0,0]=4 1473 B10R1.24 CNCCSC1CC(C1)O m_7__22986920__10953812 [1,0,0,1,0,0|1,1,0]=4 1474 B10R1.24 COCCSC1CC(C1)O m_7__6362310__10953812 [1,0,0,1,0,0|1,1,0]=4 1475 B10R1.24 NCCCSC1CC(C1)O m_7__20871288__10953812 [1,0,0,1,0,0|1,1,0]=4 1476 B10R1.24 OCCCSC1CC(C1)O m_7__10972294__10953812 [1,0,0,1,0,0|0,1,0]=3 1477 B10R1.38 CN[C@H]1CCCC[C@]1(C)O m_2230__22403060__2463448 [1,0,0,1,0,0|2,0,0]=4 1478 B10R1.39 CCN1CCC[C@@H]1C(C)O m_270004__24176662__24715004 [1,0,0,1,0,0|2,0,0]=4 1479 B10R1.56 CC1CC1CNCCCO m_270004__8288584__9139722 [1,0,0,1,0,0|2,0,0]=4 1480 B10R1.56 CC1CC1CSCCCO m_7__10972294__12216586 [1,0,0,1,0,0|1,1,0]=4 1481 B10R1.56 CCCCNCC1CC1C m_270004__8289202__9139722 [1,0,0,1,0,0|2,0,0]=4 1482 B10R1.56 CCCCNCC1CC1Cl m_270004__8289202__15344010 [1,0,0,1,0,0|2,0,0]=4 1483 B10R1.56 CCCCSCC1CC1C m_62__12216592__7021588 [1,0,0,1,0,0|1,1,0]=4 1484 B10R1.56 CCCCSC[C@@H]1C[C@H]1C m_62__875776__23861442 [1,0,0,1,0,0|1,1,0]=4 1485 B10R1.56 C[C@H]1C[C@@H]1CSCCCO m_7__10972294__23861434 [1,0,0,1,0,0|1,1,0]=4 1486 B10R1.56 OCCCNCC1CC1Cl m_270004__8288584__15344010 [1,0,0,1,0,0|2,0,0]=4 1487 B10R1.56 OCCCSCC1CC1Br m_7__10972294__15765428 [1,0,0,1,0,0|1,1,0]=4 1488 B10R1.61 CC(C)[C@H]1COCCN1C m_2230__22409466__2463448 [1,0,0,1,0,0|2,0,0]=4 1489 B10R1.61 CC(O)C1CCCCN1C m_2230__3936852__2463448 [1,0,0,1,0,0|2,0,0]=4 1490 B10R1.61 CC(O)C1COCCN1C m_2230__22408828__2463448 [1,0,0,1,0,0|1,0,0]=3 1491 B10R1.64 CC(O)CC1CCCN1C m_2230__7692774__2463448 [1,0,0,1,0,0|2,0,0]=4 1492 B10R1.64 CC(O)CN1CCCC1C m_2230__6338494__9736146 [1,0,0,1,0,0|2,0,0]=4 1493 B10R1.66 CC(C)CCN1CCCC1 m_2230__678722__681192 [1,0,0,1,0,0|2,0,0]=4 1494 B10R1.66 CC(F)CCN1CCCC1 m_2230__678722__13165354 [1,0,0,1,0,0|2,0,0]=4 1495 B10R1.66 CC(O)CCN1CCCC1 m_2230__678722__12057944 [1,0,0,1,0,0|1,0,0]=3 1496 B10R1.66 CC(O)CNC1CCCC1 m_207__109407__121596 [1,0,0,1,0,0|2,0,0]=4 1497 B10R1.66 CC(O)CSC1CCCC1 m_7__10953796__2560312 [1,0,0,1,0,0|2,0,0]=4 1498 B10R1.66 C[C@@H](N)CCN1CCCC1 m_269982__7368900__25012466 [1,0,0,1,0,0|2,0,0]=4 1499 B10R1.73 CC(C)CCNC1CC1C m_207__3377454__134014 [1,0,0,1,0,0|2,0,0]=4 1500 B10R1.73 CC(C)CCN[C@@H]1C[C@H]1C m_207__12364696__134014 [1,0,0,1,0,0|2,0,0]=4 1501 B10R1.73 CC(C)CCN[C@@H]1C[C@H]1O m_207__23835494__134014 [1,0,0,1,0,0|2,0,0]=4 1502 B10R1.73 CC(O)CNC[C@@H]1C[C@H]1C m_273610__16491734__11516404 [1,0,0,1,0,0|2,0,0]=4 1503 B10R1.73 CC(O)CSC[C@@H]1C[C@H]1C m_7__10953796__23861434 [1,0,0,1,0,0|2,0,0]=4 1504 B10R1.117 CC(O)CN[C@H]1CC[C@H]1O m_273610__20353362__11516404 [1,0,0,1,0,0|2,0,0]=4 1505 B10R1.126 CC(C)CCNCC1CC1 m_207__109476__2989440 [1,0,0,1,0,0|2,0,0]=4 1506 B10R1.126 CC(C)CCSCC1CC1 m_62__7021584__7141822 [1,0,0,1,0,0|1,1,0]=4 1507 B10R1.126 CC(F)CCNCC1CC1 m_207__10546022__2989440 [1,0,0,1,0,0|2,0,0]=4 1508 B10R1.126 CC(F)CCSCC1CC1 m_62__13165346__7141822 [1,0,0,1,0,0|1,1,0]=4 1509 B10R1.126 CC(N)CCSCC1CC1 m_34__20871470__7141814 [1,0,0,1,0,0|1,1,0]=4 1510 B10R1.126 CC(O)CCCSC1CC1 m_7__22987858__10688172 [1,0,0,1,0,0|2,0,0]=4 1511 B10R1.126 CC(O)CCNCC1CC1 m_207__4933440__2989440 [1,0,0,1,0,0|1,0,0]=3 1512 B10R1.126 CC(O)CCSCC1CC1 m_62__12057938__7141822 [1,0,0,1,0,0|0,1,0]=3 1513 B10R1.126 CC(O)CNCCC1CC1 m_273610__11523986__11516404 [1,0,0,1,0,0|2,0,0]=4 1514 B10R1.126 CC(O)CNOCC1CC1 m_273610__24431922__11516404 [1,0,0,1,0,0|1,0,0]=3 1515 B10R1.126 CC(O)CSCCC1CC1 m_7__10953796__9143154 [1,0,0,1,0,0|2,0,0]=4 1516 B10R1.126 CN(C)CCOCC1CC1 m_2230__6957866__2463448 [1,0,0,1,0,0|2,0,0]=4 1517 B10R1.127 CC(C)CCSC1CCC1 m_7__10684076__102951 [1,0,0,1,0,0|1,1,0]=4 1518 B10R1.127 CC(F)CCSC1CCC1 m_7__10684076__13165340 [1,0,0,1,0,0|1,1,0]=4 1519 B10R1.127 CC(N)CCSC1CCC1 m_34__20871470__9422448 [1,0,0,1,0,0|1,1,0]=4 1520 B10R1.127 CC(O)CCNC1COC1 m_269862__7198110__7931470 [1,0,0,1,0,0|2,0,0]=4 1521 B10R1.127 CC(O)CCSC1CCC1 m_7__10684076__12057932 [1,0,0,1,0,0|0,1,0]=3 1522 B10R1.127 CC(O)CCSC1CNC1 m_7__22987816__12057932 [1,0,0,1,0,0|1,1,0]=4 1523 B10R1.127 CC(O)CCSC1COC1 m_7__13420946__12057932 [1,0,0,1,0,0|1,1,0]=4 1524 B10R1.127 CC(O)CCSC1CSC1 m_7__20064714__12057932 [1,0,0,1,0,0|1,1,0]=4 1525 B10R1.127 CC(O)CNCC1CCC1 m_273610__11518082__11516404 [1,0,0,1,0,0|2,0,0]=4 1526 B10R1.127 CC(O)CNOC1CCC1 m_273610__11529916__11516404 [1,0,0,1,0,0|1,0,0]=3 1527 B10R1.127 CC(O)CSCC1CCC1 m_7__10953796__6078530 [1,0,0,1,0,0|2,0,0]=4 1528 B10R1.127 CC(O)CSC[C@H]1CCO1 m_7__10953796__17058812 [1,0,0,1,0,0|2,0,0]=4 1529 B10R1.133 CCNC1CCCC1(C)O m_2230__13973604__22383854 [1,0,0,1,0,0|2,0,0]=4 1530 B10R1.156 CC[C@H]1C[C@@H]1NCC(C)O m_273610__18982302__11516404 [1,0,0,1,0,0|2,0,0]=4 1531 B10R1.162 CCC1COCCN(C1)C m_2230__15112464__2463448 [1,0,0,1,0,0|2,0,0]=4 1532 B10R1.162 CN1CCOCC(C1)CO m_2230__15145916__2463448 [1,0,0,1,0,0|2,0,0]=4 1533 B10R1.173 CC(O)CN1CCC1CO m_63__13428538__10903854 [1,0,0,1,0,0|2,0,0]=4 1534 B10R1.173 CCC1CCN1CC(C)O m_63__10464280__10903854 [1,0,0,1,0,0|2,0,0]=4 1535 B10R1.177 CCCCNCCC1CC1 m_270004__8289202__13455800 [1,0,0,1,0,0|2,0,0]=4 1536 B10R1.177 CCCCOCSC1CC1 m_7__22987858__17643698 [1,0,0,1,0,0|2,0,0]=4 1537 B10R1.177 CCCCSCCC1CC1 m_7__18798568__770176 [1,0,0,1,0,0|1,1,0]=4 1538 B10R1.177 CSCCOCCC1CC1 m_62__875850__17606298 [1,0,0,1,0,0|2,0,0]=4 1539 B10R1.177 OCCCNCCC1CC1 m_270004__8288584__13455800 [1,0,0,1,0,0|2,0,0]=4 1540 B10R1.177 OCCCSCCC1CC1 m_7__18798568__6354 [1,0,0,1,0,0|1,1,0]=4 1541 B10R1.300 CN1CCOCCC1(C)C m_2230__17521794__2463448 [1,0,0,1,0,0|2,0,0]=4 1542 B10R1.54 CC(C)CN1CC[C@@H](C1)O m_2230__3351214__681214 [0,0,0,1,1,0|2,0,0]=4 1543 B10R1.54 CC(C)N[C@@H]1CC[C@@H](C1)O m_269862__11714048__7204804 [0,0,0,1,1,0|2,0,0]=4 1544 B10R1.54 CC(C)N[C@H]1CC[C@H](C1)O m_269862__21695426__7204804 [0,0,0,1,1,0|2,0,0]=4 1545 B10R1.54 CC(C)SC1CCC(C1)O m_7__17795750__5048 [0,0,0,1,1,0|2,0,0]=4 1546 B10R1.54 CC(F)CN1CC[C@@H](C1)O m_2230__3351214__16970752 [0,0,0,1,1,0|2,0,0]=4 1547 B10R1.54 CC(O)CN1CCC(C1)C m_2230__6813990__9736146 [0,0,0,1,1,0|2,0,0]=4 1548 B10R1.54 CC(O)CN1CC[C@@H](C1)F m_2230__10719192__10638028 [0,0,0,1,1,0|2,0,0]=4 1549 B10R1.54 CC(O)CN1CC[C@@H](C1)O m_2230__3351214__9736146 [0,0,0,1,1,0|1,0,0]=3 1550 B10R1.54 CC(O)CN1CC[C@H](C1)F m_2230__10719368__9736146 [0,0,0,1,1,0|2,0,0]=4 1551 B10R1.54 CC(O)CN1CC[C@H](C1)N m_269982__7368756__13193380 [0,0,0,1,1,0|2,0,0]=4 1552 B10R1.54 C[C@H](N)CN1CC[C@@H](C1)O m_269982__13594114__25012480 [0,0,0,1,1,0|2,0,0]=4 1553 B10R1.82 CC(C)CNC1CC(C1)O m_270004__20075652__8127718 [0,0,0,1,1,0|2,0,0]=4 1554 B10R1.82 CC(C)CSC1CC(C1)O m_7__27301__10953812 [0,0,0,1,1,0|1,1,0]=4 1555 B10R1.82 CC(C)NCC1CC(C1)O m_269862__12309056__7204804 [0,0,0,1,1,0|2,0,0]=4 1556 B10R1.82 CC(O)CCN1CC(C1)F m_2230__15542798__12057944 [0,0,0,1,1,0|2,0,0]=4 1557 B10R1.82 CC(O)CNC1CC(C1)C m_269862__7192560__8852816 [0,0,0,1,1,0|2,0,0]=4 1558 B10R1.82 CC(O)CNC1CC(C1)F m_273610__13811224__11516404 [0,0,0,1,1,0|2,0,0]=4 1559 B10R1.82 CC(O)CNC1CC(C1)O m_273610__20075658__11516404 [0,0,0,1,1,0|1,0,0]=3 1560 B10R1.82 CC(O)CN[C@H]1C[C@@H](C1)C m_273610__22435082__11516404 [0,0,0,1,1,0|2,0,0]=4 1561 B10R1.82 CC(O)CSC1CC(C1)O m_7__10953796__10953812 [0,0,0,1,1,0|0,1,0]=3 1562 B10R1.82 C[C@H](N)CSC1CC(C1)O m_7__20871336__10953812 [0,0,0,1,1,0|1,1,0]=4 1563 B10R1.113 CC(C)N1CCCC(C1)O m_2230__678744__680832 [0,0,0,1,1,0|2,0,0]=4 1564 B10R1.113 CC(O)C1CCCN(C1)C m_2230__7638982__2463448 [0,0,0,1,1,0|2,0,0]=4 1565 B10R1.113 CC(O)C1CN(CCO1)C m_2230__10975536__2463448 [0,0,0,1,1,0|2,0,0]=4 1566 B10R1.113 CN(C)C1CCCC(C1)O m_2230__22408406__2463448 [0,0,0,1,1,0|2,0,0]=4 1567 B10R1.276 CN1CCOCC(C1)(C)O m_2230__22406348__2463448 [0,0,0,1,1,0|2,0,0]=4 1568 B10R1.351 CC(O)CN1CCC1(C)C m_63__8755106__10903854 [0,0,0,1,1,0|2,0,0]=4 1569 B10R1.352 CC(O)CNC1CC1(C)C m_273610__11519424__11516404 [0,0,0,1,1,0|2,0,0]=4 1570 B10R1.368 CC(C)N[C@H]1C[C@@H]1C(C)O m_269862__17314826__7204804 [0,0,0,1,1,0|2,0,0]=4 1571 B12R1.105 CC(C)CCCN1CC[C@@H](C1)O m_270004__8131000__9139706 [0,0,0,1,0,1|2,0,0]=4 1572 B12R1.105 CC(C)CCN[C@@H]1CC[C@@H](C1)O m_207__11714036__134014 [0,0,0,1,0,1|2,0,0]=4 1573 B12R1.105 CC(C)CCN[C@H]1CC[C@H](C1)O m_207__21695440__134014 [0,0,0,1,0,1|2,0,0]=4 1574 B12R1.105 CC(C)CCSC1CCC(C1)O m_7__17795750__102951 [0,0,0,1,0,1|1,1,0]=4 1575 B12R1.105 CC(C)CNCC1CCC(C1)O m_207__9226038__121216 [0,0,0,1,0,1|2,0,0]=4 1576 B12R1.105 CC(C)CSCC1CCC(O1)C m_7__27301__9228968 [0,0,0,1,0,1|2,0,0]=4 1577 B12R1.105 CC(C)CSC[C@@H]1CC[C@@H](O1)C m_7__27301__18325814 [0,0,0,1,0,1|2,0,0]=4 1578 B12R1.105 CC(C)NCCC1CCC(O1)C m_269862__15720062__7204804 [0,0,0,1,0,1|2,0,0]=4 1579 B12R1.105 CC(C)NCCN1CC[C@@H](C1)O m_269862__12346814__7204804 [0,0,0,1,0,1|2,0,0]=4 1580 B12R1.105 CC(C)OCCN1CC[C@@H](C1)O m_2230__3351214__6475682 [0,0,0,1,0,1|2,0,0]=4 1581 B12R1.105 CC(C)SCCN1CC[C@@H](C1)O m_2230__3351214__9870384 [0,0,0,1,0,1|2,0,0]=4 1582 B12R1.105 CC(O)CCCN1CCC(C1)C m_2230__6813990__9227836 [0,0,0,1,0,1|2,0,0]=4 1583 B12R1.105 CC(O)CCCN1CC[C@@H](C1)F m_2230__10719192__10688176 [0,0,0,1,0,1|2,0,0]=4 1584 B12R1.105 CC(O)CCCN1CC[C@@H](C1)O m_2230__3351214__9227836 [0,0,0,1,0,1|1,0,0]=3 1585 B12R1.105 CC(O)CCCN1CC[C@H](C1)F m_2230__10719368__9227836 [0,0,0,1,0,1|2,0,0]=4 1586 B12R1.105 CC(O)CCCN1CC[C@H](C1)N m_269982__7368756__22488660 [0,0,0,1,0,1|2,0,0]=4 1587 B12R1.105 CC(O)CNCC1CCC(C1)C m_273610__24424210__11516404 [0,0,0,1,0,1|2,0,0]=4 1588 B12R1.105 CC(O)CSC[C@@H]1CC[C@@H](O1)C m_7__10953796__18325814 [0,0,0,1,0,1|1,0,0]=3 1589 B12R1.105 CC1CCC(O1)CCSC(C)C m_62__2390328__15746378 [0,0,0,1,0,1|2,0,0]=4 1590 B12R1.105 C[C@H](N)CSC[C@@H]1CC[C@@H](O1)C m_7__20871336__18325814 [0,0,0,1,0,1|2,0,0]=4 1591 B12R1.143 CC(C)CCCNC[C@@H]1C[C@H]1O m_270004__25073046__9139706 [0,0,0,1,0,1|2,0,0]=4 1592 B12R1.143 CC(O)CNCCC[C@@H]1C[C@H]1C m_273610__17517146__11516404 [0,0,0,1,0,1|2,0,0]=4 1593 B12R1.143 CC(O)CNCCC[C@H]1C[C@H]1C m_270004__8288774__24714994 [0,0,0,1,0,1|2,0,0]=4 1594 B12R1.220 CC(C)CCCNC1CC(C1)O m_207__20075630__7912414 [0,0,0,1,0,1|2,0,0]=4 1595 B12R1.220 CC(C)CCCSC1CC(C1)O m_7__8333108__10953812 [0,0,0,1,0,1|1,1,0]=4 1596 B12R1.220 CC(C)CCNCC1CC(C1)O m_207__12309036__134014 [0,0,0,1,0,1|2,0,0]=4 1597 B12R1.220 CC(C)CNCCC1CC(C1)O m_270004__9330360__8127718 [0,0,0,1,0,1|2,0,0]=4 1598 B12R1.220 CC(C)CNCC[C@H]1C[C@@H](C1)O m_270004__23845852__8127718 [0,0,0,1,0,1|2,0,0]=4 1599 B12R1.220 CC(C)OCCSC1CC(C1)O m_7__22987390__10953812 [0,0,0,1,0,1|1,1,0]=4 1600 B12R1.220 CC(O)CCCNC1CC(C1)C m_269862__9448696__8852816 [0,0,0,1,0,1|2,0,0]=4 1601 B12R1.220 CC(O)CCSCC1CC(C1)C m_62__12057938__13451112 [0,0,0,1,0,1|1,1,0]=4 1602 B12R1.220 CC(O)CCSCC1CC(C1)F m_62__12057938__13773720 [0,0,0,1,0,1|1,1,0]=4 1603 B12R1.220 CC(O)CCSCC1CC(C1)N m_34__20871486__12057934 [0,0,0,1,0,1|1,1,0]=4 1604 B12R1.220 CC(O)CNCCC1CC(C1)O m_273610__11555054__11516404 [0,0,0,1,0,1|1,0,0]=3 1605 B12R1.220 CC(O)CNCC[C@H]1C[C@@H](C1)F m_273610__14412308__11516404 [0,0,0,1,0,1|2,0,0]=4 1606 B12R1.220 CC(O)CSCCC1CC(C1)F m_7__22988106__10902704 [0,0,0,1,0,1|2,0,0]=4 1607 B12R1.220 CC(O)CSCCC1CC(C1)N m_7__21392882__10902704 [0,0,0,1,0,1|2,0,0]=4 1608 B12R1.226 CC(=O)NC[C@@H]1C[C@@H](CCO1)O m_270062__14419664__15585492 [0,0,0,1,0,1|0,0,2]=4 1609 B12R1.226 CC(C)CCN1CCCC(C1)O m_2230__678744__681192 [0,0,0,1,0,1|2,0,0]=4 1610 B12R1.226 CC(C)CNC1CCCC(C1)O m_207__1299170__121216 [0,0,0,1,0,1|2,0,0]=4 1611 B12R1.226 CC(C)CS[C@@H]1CCC[C@@H](C1)O m_7__17656074__1010132 [0,0,0,1,0,1|2,0,0]=4 1612 B12R1.226 CC(C)NCC1CCCC(C1)O m_269862__7198634__7204804 [0,0,0,1,0,1|2,0,0]=4 1613 B12R1.226 CC(C)NCC1CCCC(O1)C m_269862__12055120__7204804 [0,0,0,1,0,1|2,0,0]=4 1614 B12R1.226 CC(C)NC[C@@H]1CCC[C@@H](C1)O m_269862__17599968__7204804 [0,0,0,1,0,1|2,0,0]=4 1615 B12R1.226 CC(C)NC[C@@H]1C[C@@H](CCO1)O m_269862__14419660__7204804 [0,0,0,1,0,1|1,0,0]=3 1616 B12R1.226 CC(C)SCC1CCCC(C1)O m_62__2390328__10435480 [0,0,0,1,0,1|2,0,0]=4 1617 B12R1.226 CC(F)CCN1CCCC(C1)O m_2230__678744__13165354 [0,0,0,1,0,1|2,0,0]=4 1618 B12R1.226 CC(F)CS[C@@H]1CCC[C@@H](C1)O m_7__17656074__16970746 [0,0,0,1,0,1|2,0,0]=4 1619 B12R1.226 CC(O)CCN1CC=CC(C1)O m_2230__22405908__12057944 [0,0,0,1,0,1|1,0,1]=4 1620 B12R1.226 CC(O)CCN1CCCC(C1)C m_2230__678730__12057944 [0,0,0,1,0,1|2,0,0]=4 1621 B12R1.226 CC(O)CCN1CCCC(C1)F m_2230__13466020__12057944 [0,0,0,1,0,1|2,0,0]=4 1622 B12R1.226 CC(O)CCN1CCCC(C1)O m_2230__678744__12057944 [0,0,0,1,0,1|1,0,0]=3 1623 B12R1.226 CC(O)CCN1CCC[C@@H](C1)N m_269982__13151830__22488918 [0,0,0,1,0,1|2,0,0]=4 1624 B12R1.226 CC(O)CCN1CCN[C@@H](C1)C m_269982__10880298__22488918 [0,0,0,1,0,1|2,0,0]=4 1625 B12R1.226 CC(O)CCN1CCO[C@H](C1)C m_2230__17693332__12057944 [0,0,0,1,0,1|2,0,0]=4 1626 B12R1.226 CC(O)CCN1CCSC(C1)C m_2230__19177976__12057944 [0,0,0,1,0,1|2,0,0]=4 1627 B12R1.226 CC(O)CS[C@@H]1CCC[C@@H](C1)O m_7__17656074__10902704 [0,0,0,1,0,1|1,0,0]=3 1628 B12R1.226 C[C@@H](N)CCN1CCCC(C1)O m_269982__11723266__25012466 [0,0,0,1,0,1|2,0,0]=4 1629 B12R1.261 CC(=O)N1CCOCC1C(C)O m_270062__21864548__15585492 [0,0,0,1,0,1|0,0,2]=4 1630 B12R1.390 CC(C)CCOCCSC1CC1 m_7__22987858__1160058 [0,0,0,1,0,1|2,0,0]=4 1631 B12R1.390 CC(C)NCCOCCC1CC1 m_269862__16493536__7204804 [0,0,0,1,0,1|2,0,0]=4 1632 B12R1.390 CC(C)SCCOCCC1CC1 m_62__2390328__17606298 [0,0,0,1,0,1|2,0,0]=4 1633 B12R1.390 CC(O)CCCNCCC1CC1 m_270004__9448698__13455800 [0,0,0,1,0,1|2,0,0]=4 1634 B12R1.390 CC(O)CCCSCCC1CC1 m_7__18798568__10688172 [0,0,0,1,0,1|1,1,0]=4 1635 B12R1.390 CC(O)CCSCCCC1CC1 m_62__12057938__12641598 [0,0,0,1,0,1|1,1,0]=4 1636 B12R1.390 CC(O)CCSCCOC1CC1 m_62__12057938__13445166 [0,0,0,1,0,1|1,1,0]=4 1637 B12R1.390 CC(O)CNCCCCC1CC1 m_273610__12627796__11516404 [0,0,0,1,0,1|2,0,0]=4 1638 B12R1.390 CC(O)CSCCCCC1CC1 m_7__10953796__13763124 [0,0,0,1,0,1|2,0,0]=4 1639 B12R1.391 CC(C)N[C@H]1CCCC[C@]1(C)O m_2230__22403060__680832 [0,0,0,1,0,1|2,0,0]=4 1640 B12R1.391 CC(O)CN1CCCCC1(C)C m_2230__14596350__9736146 [0,0,0,1,0,1|2,0,0]=4 1641 B12R1.392 CC(C)CN1CCC[C@@H]1C(C)O m_270004__24176662__8127718 [0,0,0,1,0,1|2,0,0]=4 1642 B12R1.392 CC(F)CN1CCC[C@@H]1C(C)O m_2230__12057664__16970752 [0,0,0,1,0,1|2,0,0]=4 1643 B12R1.392 CC(O)CN1CCCC1C(C)C m_2230__5826484__9736146 [0,0,0,1,0,1|2,0,0]=4 1644 B12R1.392 CC(O)CN1CCC[C@@H]1C(C)O m_2230__12057664__9736146 [0,0,0,1,0,1|1,0,0]=3 1645 B12R1.874 CC(O)CN1CCCCC(C1)C m_2230__8964262__9736146 [0,0,0,1,0,1|2,0,0]=4 1646 B12R1.874 CC(O)CN1CCCCC(C1)N m_269982__15734008__13193380 [0,0,0,1,0,1|2,0,0]=4 1647 B12R1.874 CC(O)CN1CCNCC(C1)O m_269982__13586758__13193380 [0,0,0,1,0,1|2,0,0]=4 1648 B12R1.874 CC(O)CN1CCOCC(C1)O m_2230__14795914__9736146 [0,0,0,1,0,1|2,0,0]=4 1649 B12R1.874 C[C@H](N)CN1CCCCC(C1)O m_269982__22516904__25012480 [0,0,0,1,0,1|2,0,0]=4 1650 B12R1.924 CC(C)CNC1CCCC1(C)O m_2230__13973604__681214 [0,0,0,1,0,1|2,0,0]=4 1651 B12R1.924 CC(C)NCC1OCCC1(C)C m_269862__14327154__7204804 [0,0,0,1,0,1|2,0,0]=4 1652 B12R1.924 CC(O)CCN1CCCC1(C)C m_2230__5789082__12057944 [0,0,0,1,0,1|2,0,0]=4 1653 B12R1.924 CC(O)CNC1CCCC1(C)C m_2230__9099634__9736146 [0,0,0,1,0,1|2,0,0]=4 1654 B12R1.1339 CC(C)CC1CCN1CC(C)O m_63__13781074__10903854 [0,0,0,1,0,1|2,0,0]=4 1655 B12R1.1341 CC(C)C[C@H]1C[C@@H]1NCC(C)O m_273610__11530322__11516404 [0,0,0,1,0,1|2,0,0]=4 1656 B12R1.1347 CC(O)CSCCC1CC1(C)C m_7__10953796__14939738 [0,0,0,1,0,1|2,0,0]=4 1657 B12R1.1370 CC(O)CCNC1CCC1(C)C m_269862__7198110__9984674 [0,0,0,1,0,1|2,0,0]=4 1658 B12R1.1370 CC(O)CCNC1CNC1(C)C m_269982__22505228__22488918 [0,0,0,1,0,1|2,0,0]=4 1659 B12R1.1370 CC(O)CCNC1CSC1(C)C m_2230__22400322__12057944 [0,0,0,1,0,1|2,0,0]=4 1660 B12R1.1807 CC(C)CCN[C@H]1C[C@@H]1C(C)O m_207__17314814__134014 [0,0,0,1,0,1|2,0,0]=4 1661 B12R1.1807 CC(O)CNC[C@H]1C[C@@H]1C(C)C m_273610__11530068__11516404 [0,0,0,1,0,1|2,0,0]=4 1662 B12R1.101 CC(O)CN1C[C@@H](C[C@@H](C1)O)C m_2230__10970472__9736146 [0,1,0,1,0,0|2,0,0]=4 1663 B12R1.101 CC(O)CN1C[C@@H](C[C@H](C1)F)O m_2230__18800216__9736146 [0,1,0,1,0,0|2,0,0]=4 1664 B12R1.101 CC(O)CN1C[C@H](C[C@@H](C1)O)O m_2230__22406936__9736146 [0,1,0,1,0,0|2,0,0]=4 1665 B12R1.103 CC(C)CC(C)N1CC[C@@H](C1)O m_2230__3351214__10643634 [0,1,0,1,0,0|2,0,0]=4 1666 B12R1.103 CC(O)CC(=O)N1CCC(C1)O m_22__24035790__16946108 [0,1,0,1,0,0|1,0,1]=4 1667 B12R1.103 CC(O)CC(=O)N1CC[C@@H](C1)O m_22__6483502__16946108 [0,1,0,1,0,0|1,0,1]=4 1668 B12R1.142 CC(C)CC(C)NC[C@@H]1C[C@H]1O m_270004__25073046__8157306 [0,1,0,1,0,0|2,0,0]=4 1669 B12R1.142 CC(O)CC(=O)NC[C@@H]1C[C@H]1O m_22__25075080__16946108 [0,1,0,1,0,0|1,0,1]=4 1670 B12R1.142 CC(O)CC(C)NC[C@@H]1C[C@H]1C m_2230__22399846__23861446 [0,1,0,1,0,0|2,0,0]=4 1671 B12R1.142 C[C@@H](O)CC(=O)OC[C@@H]1C[C@H]1C m_1458__21596576__23861444 [0,1,0,1,0,0|1,0,1]=4 1672 B12R1.861 CC(C)CCN1CC(CC1C)O m_2230__9209358__681192 [0,1,0,1,0,0|2,0,0]=4 1673 B12R1.861 CC(O)CCN1C[C@H](C[C@H]1C)F m_2230__22545816__12057944 [0,1,0,1,0,0|2,0,0]=4 1674 B12R1.861 CC(O)CN[C@H]1C[C@@H](C[C@@H]1O)O m_273610__22451346__11516404 [0,1,0,1,0,0|2,0,0]=4 1675 B12R1.1020 CC(O)CN1CCCC(CC1)O m_2230__10565428__9736146 [0,1,0,1,0,0|2,0,0]=4 1676 B12R1.1054 CC(C)CCNC1(CC(C1)O)C m_2230__17520648__681192 [0,1,0,1,0,0|2,0,0]=4 1677 B12R1.1054 CC(F)CCNC1(CC(C1)O)C m_2230__17520648__13165354 [0,1,0,1,0,0|2,0,0]=4 1678 B12R1.1054 CC(O)CCNC1(CC(C1)C)C m_2230__22403224__12057944 [0,1,0,1,0,0|2,0,0]=4 1679 B12R1.1054 CC(O)CCNC1(CC(C1)F)C m_2230__22399454__12057944 [0,1,0,1,0,0|2,0,0]=4 1680 B12R1.1054 CC(O)CCNC1(CC(C1)O)C m_2230__17520648__12057944 [0,1,0,1,0,0|1,0,0]=3 1681 B12R1.1054 CC(O)CCN[C@@]1(C[C@@H](C1)N)C m_269982__22505452__22488918 [0,1,0,1,0,0|2,0,0]=4 1682 B12R1.1054 CC(O)CNC[C@@]1(C[C@H](C1)O)O m_273610__22492904__11516404 [0,1,0,1,0,0|2,0,0]=4 1683 B12R1.1060 CC(O)CCN1C(CC1(C)C)C m_2230__7912814__12057944 [0,1,0,1,0,0|2,0,0]=4 1684 B12R1.1061 CC(C)CC(C)NC1CC(C1)O m_270004__20075652__8157306 [0,1,0,1,0,0|2,0,0]=4 1685 B12R1.1061 CC(O)CC(=O)NC1CC(C1)O m_487__20075632__23862482 [0,1,0,1,0,0|1,0,1]=4 1686 B12R1.1061 CC(O)CN(C)CC1CC(C1)O m_2230__5729954__22993558 [0,1,0,1,0,0|2,0,0]=4 1687 B12R1.1061 CC(O)CN(C)C[C@H]1C[C@H](C1)O m_2230__12312132__9736146 [0,1,0,1,0,0|2,0,0]=4 1688 B12R1.1238 CC(O)CCOC(=O)[C@H]1C[C@H]1C m_1458__16716552__12057942 [0,1,0,1,0,0|1,0,1]=4 1689 B12R1.1238 CC(O)CCOC(=O)[C@H]1C[C@H]1F m_1458__16891536__12057942 [0,1,0,1,0,0|1,0,1]=4 1690 B12R1.1359 CC(O)CCNC(C)CC1CC1 m_2230__22397024__12057944 [0,1,0,1,0,0|2,0,0]=4 1691 B12R1.1359 CC(O)CCOC(=O)CC1CC1 m_1458__592962__12057942 [0,1,0,1,0,0|1,0,1]=4 1692 B12R1.1377 CC(O)CC(C)NCCC1CC1 m_2230__22399846__6109134 [0,1,0,1,0,0|2,0,0]=4 1693 B12R1.1377 C[C@@H](O)CC(=O)OCCC1CC1 m_1458__21596576__6109132 [0,1,0,1,0,0|1,0,1]=4 1694 B12R1.1810 CC(C)CCN[C@H]1C[C@@](C1)(C)O m_207__11245588__134014 [0,1,0,1,0,0|2,0,0]=4 1695 B12R1.1810 CC(O)CCCN1CC(C1)(C)O m_2230__7555612__9227836 [0,1,0,1,0,0|2,0,0]=4 1696 B12R1.1810 CC(O)CCNC1CC(C1)(C)C m_269862__7198110__9451944 [0,1,0,1,0,0|2,0,0]=4 1697 B12R1.1810 CC(O)CCSC1CC(C1)(C)C m_7__22987564__12057932 [0,1,0,1,0,0|1,1,0]=4 1698 B12R1.1810 CC(O)CNC[C@H]1C[C@@](C1)(C)O m_273610__21675912__11516404 [0,1,0,1,0,0|2,0,0]=4 1699 B12R1.1821 CC(O)CN1CCCC(C1)(C)O m_2230__7968508__9736146 [0,1,0,1,0,0|2,0,0]=4 1700 B12R1.3583 CC(O)CCNC1(CC1(C)C)C m_2230__22397686__12057944 [0,1,0,1,0,0|2,0,0]=4 1701 B12R1.19 CC(O)CN1CC[C@@H]([C@@H](C1)O)C m_2230__14471782__9736146 [0,1,0,1,0,0|2,0,0]=4 1702 B12R1.19 CC(O)CN1CC[C@@H]([C@@H](C1)O)O m_2230__12632864__9736146 [0,1,0,1,0,0|2,0,0]=4 1703 B12R1.19 CC(O)CN1CC[C@H]([C@@H](C1)O)F m_2230__13944416__9736146 [0,1,0,1,0,0|2,0,0]=4 1704 B12R1.104 CC(C)C(C)CN1CC[C@@H](C1)O m_2230__3351214__16618964 [0,1,0,1,0,0|2,0,0]=4 1705 B12R1.104 CC(C)C(O)CN1CC[C@@H](C1)O m_2230__3351214__17609374 [0,1,0,1,0,0|2,0,0]=4 1706 B12R1.104 CC(C)[C@@H](N)CN1CC[C@@H](C1)O m_269982__13594114__25012484 [0,1,0,1,0,0|2,0,0]=4 1707 B12R1.110 CC(C)CCN1C[C@@H]([C@H](C1)F)O m_2230__13811400__681192 [0,1,0,1,0,0|2,0,0]=4 1708 B12R1.110 CC(C)CCN1C[C@@H]([C@H](C1)F)O m_2230__22407102__681192 [0,1,0,1,0,0|2,0,0]=4 1709 B12R1.110 CC(C)CCN1C[C@@H]([C@H](C1)O)C m_2230__13613406__681192 [0,1,0,1,0,0|2,0,0]=4 1710 B12R1.110 CC(C)CCN1C[C@H]([C@@H](C1)O)C m_2230__15264148__681192 [0,1,0,1,0,0|2,0,0]=4 1711 B12R1.110 CC(C)CCN1C[C@H]([C@@H](C1)O)O m_2230__15140100__681192 [0,1,0,1,0,0|2,0,0]=4 1712 B12R1.110 CC(F)CCN1C[C@@H]([C@H](C1)F)O m_2230__13811400__13165354 [0,1,0,1,0,0|2,0,0]=4 1713 B12R1.110 CC(F)CCN1C[C@@H]([C@H](C1)F)O m_2230__22407102__13165354 [0,1,0,1,0,0|2,0,0]=4 1714 B12R1.110 CC(F)CCN1C[C@@H]([C@H](C1)O)C m_2230__13613406__13165354 [0,1,0,1,0,0|2,0,0]=4 1715 B12R1.110 CC(F)CCN1C[C@H]([C@@H](C1)O)C m_2230__15264148__13165354 [0,1,0,1,0,0|2,0,0]=4 1716 B12R1.110 CC(F)CCN1C[C@H]([C@@H](C1)O)O m_2230__15140100__13165354 [0,1,0,1,0,0|2,0,0]=4 1717 B12R1.110 CC(O)CCN1C[C@@H]([C@@H](C1)F)C m_2230__14321310__12057944 [0,1,0,1,0,0|2,0,0]=4 1718 B12R1.110 CC(O)CCN1C[C@@H]([C@H](C1)C)C m_2230__23835036__12057944 [0,1,0,1,0,0|2,0,0]=4 1719 B12R1.110 CC(O)CCN1C[C@@H]([C@H](C1)F)F m_2230__22406828__12057944 [0,1,0,1,0,0|2,0,0]=4 1720 B12R1.110 CC(O)CCN1C[C@@H]([C@H](C1)F)O m_2230__13811400__12057944 [0,1,0,1,0,0|1,0,0]=3 1721 B12R1.110 CC(O)CCN1C[C@@H]([C@H](C1)F)O m_2230__22407102__12057944 [0,1,0,1,0,0|1,0,0]=3 1722 B12R1.110 CC(O)CCN1C[C@@H]([C@H](C1)N)C m_269982__13223216__22488918 [0,1,0,1,0,0|2,0,0]=4 1723 B12R1.110 CC(O)CCN1C[C@@H]([C@H](C1)O)C m_2230__13613406__12057944 [0,1,0,1,0,0|1,0,0]=3 1724 B12R1.110 CC(O)CCN1C[C@H]([C@@H](C1)O)C m_2230__15264148__12057944 [0,1,0,1,0,0|1,0,0]=3 1725 B12R1.110 CC(O)CCN1C[C@H]([C@@H](C1)O)O m_2230__15140100__12057944 [0,1,0,1,0,0|1,0,0]=3 1726 B12R1.110 CC(O)CNC1C[C@H]([C@H](C1)O)O m_273610__13026850__11516404 [0,1,0,1,0,0|2,0,0]=4 1727 B12R1.110 C[C@@H](N)CCN1C[C@@H]([C@H](C1)F)O m_269982__13811428__25012466 [0,1,0,1,0,0|2,0,0]=4 1728 B12R1.110 C[C@@H](N)CCN1C[C@@H]([C@H](C1)F)O m_269982__22515672__25012466 [0,1,0,1,0,0|2,0,0]=4 1729 B12R1.110 C[C@@H](N)CCN1C[C@@H]([C@H](C1)O)C m_269982__13613432__25012466 [0,1,0,1,0,0|2,0,0]=4 1730 B12R1.110 C[C@@H](N)CCN1C[C@H]([C@H](C1)O)O m_269982__22517722__25012466 [0,1,0,1,0,0|2,0,0]=4 1731 B12R1.110 C[C@@H]1CN(C[C@H]1O)CC[C@@H](C)N m_269982__15264176__25012466 [0,1,0,1,0,0|2,0,0]=4 1732 B12R1.214 CC(O)C(C)CNCC1CC1C m_270004__23847178__9139722 [0,1,0,1,0,0|2,0,0]=4 1733 B12R1.214 CC(O)C(C)CNCC1CC1Cl m_270004__23847178__15344010 [0,1,0,1,0,0|2,0,0]=4 1734 B12R1.225 C[C@@H](O)C(=O)N1CC(CCO1)O m_22__23377874__17541882 [0,1,0,1,0,0|1,0,1]=4 1735 B12R1.229 CC(C)CCNC[C@@H]1CC[C@H]1O m_207__21537042__134014 [0,1,0,1,0,0|2,0,0]=4 1736 B12R1.229 CC(C)CCSC[C@@H]1CC[C@H]1O m_62__7021584__23862058 [0,1,0,1,0,0|1,1,0]=4 1737 B12R1.229 CC(F)CCSC[C@@H]1CC[C@H]1O m_62__13165346__23862058 [0,1,0,1,0,0|1,1,0]=4 1738 B12R1.229 CC(N)CCSC[C@@H]1CC[C@H]1O m_34__20871470__23862052 [0,1,0,1,0,0|1,1,0]=4 1739 B12R1.229 CC(O)CCSC[C@@H]1CC[C@H]1O m_62__12057938__23862058 [0,1,0,1,0,0|0,1,0]=3 1740 B12R1.229 CC(O)CCSC[C@H]1CC[C@H]1C m_62__12057938__21674492 [0,1,0,1,0,0|1,1,0]=4 1741 B12R1.1039 CC(C)C(O)CNC1CC(C1)O m_273610__20075658__17609376 [0,1,0,1,0,0|2,0,0]=4 1742 B12R1.1039 CC1CC(C1)NCC(C)C(C)O m_270004__23847178__8852818 [0,1,0,1,0,0|2,0,0]=4 1743 B12R1.1039 C[C@H](O)[C@@H](C)NCC1CC(C1)O m_2230__22400278__22993558 [0,1,0,1,0,0|2,0,0]=4 1744 B12R1.1056 CC(O)CCN1CC(C1(C)C)C m_2230__23093850__12057944 [0,1,0,1,0,0|2,0,0]=4 1745 B12R1.1356 CC(O)CCNCC(C)C1CC1 m_270004__8296476__16464038 [0,1,0,1,0,0|2,0,0]=4 1746 B12R1.1356 CC(O)CCNCC(O)C1CC1 m_273610__11554168__11516390 [0,1,0,1,0,0|2,0,0]=4 1747 B12R1.1356 CC(O)CCSCC(C)C1CC1 m_62__15746286__12057940 [0,1,0,1,0,0|1,1,0]=4 1748 B12R1.1397 CC(O)C(C)CNCCC1CC1 m_270004__23847178__13455800 [0,1,0,1,0,0|2,0,0]=4 1749 B12R1.2198 CC(O)C(O)CN1CCC1(C)C m_63__8755106__13936428 [0,1,0,1,0,0|2,0,0]=4 1750 B12R1.119 CC(C)(O)CN1CCCC(C1)O m_2230__678744__7638994 [0,1,0,1,0,0|2,0,0]=4 1751 B12R1.146 CC(C)(C)CCNC[C@@H]1C[C@H]1O m_270004__25073046__8957132 [0,1,0,1,0,0|2,0,0]=4 1752 B12R1.146 CC(C)(O)CCNCC1CC1Cl m_270004__8992694__15344010 [0,1,0,1,0,0|2,0,0]=4 1753 B12R1.146 CC(C)(O)CCSCC1CC1Br m_7__11758710__15765428 [0,1,0,1,0,0|1,1,0]=4 1754 B12R1.146 CC1CC1CNCCC(C)(C)O m_270004__8992694__9139722 [0,1,0,1,0,0|2,0,0]=4 1755 B12R1.146 CC1CC1CSCCC(C)(C)O m_7__11758710__12216586 [0,1,0,1,0,0|1,1,0]=4 1756 B12R1.146 C[C@H]1C[C@@H]1CSCCC(C)(C)O m_7__11758710__23861434 [0,1,0,1,0,0|1,1,0]=4 1757 B12R1.219 CC(C)(C)CCNC1CC(C1)O m_270004__20075652__8957132 [0,1,0,1,0,0|2,0,0]=4 1758 B12R1.219 CC(C)(C)CCSC1CC(C1)O m_7__22988126__10953812 [0,1,0,1,0,0|1,1,0]=4 1759 B12R1.219 CC(C)(O)CCSC1CC(C1)O m_7__11758710__10953812 [0,1,0,1,0,0|0,1,0]=3 1760 B12R1.219 CC(F)(F)CCSC1CC(C1)O m_7__22988020__10953812 [0,1,0,1,0,0|1,1,0]=4 1761 B12R1.219 CC1CC(C1)NCCC(C)(C)O m_269862__8992692__8852816 [0,1,0,1,0,0|2,0,0]=4 1762 B12R1.547 CC(C)(O)CCNCCC1CC1 m_270004__8992694__13455800 [0,1,0,1,0,0|2,0,0]=4 1763 B12R1.547 CC(C)(O)CCSCCC1CC1 m_7__11758710__9143154 [0,1,0,1,0,0|1,1,0]=4 1764 B12R1.836 CC(C)(C)CCN1CC[C@@H](C1)O m_2230__3351214__9276538 [0,1,0,1,0,0|2,0,0]=4 1765 B12R1.836 CC(C)(F)CCN1CC[C@@H](C1)O m_2230__3351214__16725012 [0,1,0,1,0,0|2,0,0]=4 1766 B12R1.836 CC(C)(O)CCN1CC[C@@H](C1)F m_2230__10719192__11686966 [0,1,0,1,0,0|2,0,0]=4 1767 B12R1.836 CC(C)(O)CCN1CC[C@@H](C1)O m_2230__3351214__6584442 [0,1,0,1,0,0|1,0,0]=3 1768 B12R1.836 CC(C)(O)CCN1CC[C@H](C1)F m_2230__10719368__6584442 [0,1,0,1,0,0|2,0,0]=4 1769 B12R1.836 CC(C)(O)CSC1CCC(C1)O m_7__17795750__8331390 [0,1,0,1,0,0|2,0,0]=4 1770 B12R1.836 CC(F)(F)CCN1CC[C@@H](C1)O m_2230__3351214__16619060 [0,1,0,1,0,0|2,0,0]=4 1771 B12R1.836 CC1CCN(C1)CCC(C)(C)O m_2230__6813990__6584442 [0,1,0,1,0,0|2,0,0]=4 1772 B12R1.1340 CC(O)CN1CCC1C(C)(C)O m_63__17828770__10903854 [0,1,0,1,0,0|2,0,0]=4 1773 B12R1.1361 CC(C)CCNCCC1(CC1)O m_207__21536846__134014 [0,1,0,1,0,0|2,0,0]=4 1774 B12R1.1361 CC(C)CCSCCC1(CC1)O m_62__7021584__9162882 [0,1,0,1,0,0|1,1,0]=4 1775 B12R1.1361 CC(F)CCSCCC1(CC1)O m_62__13165346__9162882 [0,1,0,1,0,0|1,1,0]=4 1776 B12R1.1361 CC(N)CCSCCC1(CC1)O m_34__20871470__9162876 [0,1,0,1,0,0|1,1,0]=4 1777 B12R1.1361 CC(O)CCNCCC1(CC1)C m_270004__8296476__24715088 [0,1,0,1,0,0|2,0,0]=4 1778 B12R1.1361 CC(O)CCSCCC1(CC1)C m_62__12057938__13763164 [0,1,0,1,0,0|1,1,0]=4 1779 B12R1.1361 CC(O)CCSCCC1(CC1)O m_62__12057938__9162882 [0,1,0,1,0,0|0,1,0]=3 1780 B12R1.1361 CC(O)CNCCCC1(CC1)O m_273610__21501470__11516404 [0,1,0,1,0,0|2,0,0]=4 1781 B12R1.1806 CC(C)CCN1CCC(C1)(C)O m_2230__6508746__681192 [0,1,0,1,0,0|2,0,0]=4 1782 B12R1.1806 CC(F)CCN1CCC(C1)(C)O m_2230__6508746__13165354 [0,1,0,1,0,0|2,0,0]=4 1783 B12R1.1806 CC(O)CCN1CCC(C1)(C)C m_2230__6202980__12057944 [0,1,0,1,0,0|2,0,0]=4 1784 B12R1.1806 CC(O)CCN1CCC(C1)(C)F m_2230__7969044__12057944 [0,1,0,1,0,0|2,0,0]=4 1785 B12R1.1806 CC(O)CCN1CCC(C1)(C)O m_2230__6508746__12057944 [0,1,0,1,0,0|1,0,0]=3 1786 B12R1.1806 CC(O)CCN1CC[C@@](C1)(C)N m_269982__20607252__22488918 [0,1,0,1,0,0|2,0,0]=4 1787 B12R1.1806 C[C@@H](N)CCN1CCC(C1)(C)O m_269982__17669604__25012466 [0,1,0,1,0,0|2,0,0]=4 1788 B12R1.21 CC(C)CCN1CCC(CC1)O m_2230__679016__681192 [0,1,0,1,0,0|2,0,0]=4 1789 B12R1.21 CC(F)CCN1CCC(CC1)O m_2230__679016__13165354 [0,1,0,1,0,0|2,0,0]=4 1790 B12R1.21 CC(O)CCN1CCC(CC1)C m_2230__678746__12057944 [0,1,0,1,0,0|2,0,0]=4 1791 B12R1.21 CC(O)CCN1CCC(CC1)F m_2230__12896702__12057944 [0,1,0,1,0,0|2,0,0]=4 1792 B12R1.21 CC(O)CCN1CCC(CC1)N m_269982__7368762__22488918 [0,1,0,1,0,0|2,0,0]=4 1793 B12R1.21 CC(O)CCN1CCC(CC1)O m_2230__679016__12057944 [0,1,0,1,0,0|1,0,0]=3 1794 B12R1.21 CC(O)CNC1CCC(CC1)O m_269862__7192560__9315688 [0,1,0,1,0,0|2,0,0]=4 1795 B12R1.21 CC(O)CN[C@H]1CC[C@@H](CC1)O m_273610__11554358__11516404 [0,1,0,1,0,0|2,0,0]=4 1796 B12R1.21 C[C@@H](N)CCN1CCC(CC1)O m_269982__10880284__25012466 [0,1,0,1,0,0|2,0,0]=4 1797 B12R1.127 CC(O)CN1C[C@@H](CC[C@H]1C)O m_2230__11621032__9736146 [0,1,0,1,0,0|2,0,0]=4 1798 B12R1.127 CC(O)CN1C[C@@H](CC[C@H]1C)O m_2230__9581864__9736146 [0,1,0,1,0,0|2,0,0]=4 1799 B12R1.147 C[C@H](O)CCN(C)C[C@@H]1C[C@H]1C m_2230__18186218__23861446 [0,1,0,1,0,0|2,0,0]=4 1800 B12R1.221 CC(C)CCN(C)C1CC(C1)O m_2230__8759546__681192 [0,1,0,1,0,0|2,0,0]=4 1801 B12R1.221 CC(F)CCN(C)C1CC(C1)O m_2230__8759546__13165354 [0,1,0,1,0,0|2,0,0]=4 1802 B12R1.221 CC(O)CCN(C)C1CC(C1)O m_2230__8759546__12057944 [0,1,0,1,0,0|1,0,0]=3 1803 B12R1.221 CC(O)CNC(=O)[C@H]1C[C@H](C1)O m_527__564580__12102492 [0,1,0,1,0,0|2,0,0]=4 1804 B12R1.221 C[C@H](O)CCN(C)C1CC(C1)O m_2230__18186218__10954060 [0,1,0,1,0,0|1,0,0]=3 1805 B12R1.552 CC(O)CCN(C)CCC1CC1 m_2230__7633868__12057944 [0,1,0,1,0,0|2,0,0]=4 1806 B12R1.552 C[C@H](O)CCN(C)CCC1CC1 m_2230__18186218__6109134 [0,1,0,1,0,0|2,0,0]=4 1807 B12R1.2242 CC(O)CCN(C)C1CC1(C)C m_2230__9438402__12057944 [0,1,0,1,0,0|2,0,0]=4 1808 B12R1.26 CC(CO)SC[C@@H]1CC[C@@H](O1)C m_7__6338928__18325814 [0,1,0,1,0,0|2,0,0]=4 1809 B12R1.26 CCC(C)CCN1CC[C@@H](C1)O m_2230__3351214__20058362 [0,1,0,1,0,0|2,0,0]=4 1810 B12R1.26 CCC(O)CCN1CCC(C1)C m_2230__6813990__16640714 [0,1,0,1,0,0|2,0,0]=4 1811 B12R1.26 CCC(O)CCN1CC[C@@H](C1)F m_2230__10719192__16640714 [0,1,0,1,0,0|2,0,0]=4 1812 B12R1.26 CCC(O)CCN1CC[C@@H](C1)O m_2230__3351214__16640714 [0,1,0,1,0,0|1,0,0]=3 1813 B12R1.26 CCC(O)CCN1CC[C@H](C1)F m_2230__10719368__16640714 [0,1,0,1,0,0|2,0,0]=4 1814 B12R1.26 CCC(O)CCN1CC[C@H](C1)N m_269982__7368756__22488686 [0,1,0,1,0,0|2,0,0]=4 1815 B12R1.26 CC[C@H](N)CCN1CC[C@@H](C1)O m_269982__13594114__22485976 [0,1,0,1,0,0|2,0,0]=4 1816 B12R1.26 COC(C)CCN1CCC(C1)C m_2230__6813990__22384146 [0,1,0,1,0,0|2,0,0]=4 1817 B12R1.26 COC(C)CCN1CC[C@@H](C1)F m_2230__10719192__22384146 [0,1,0,1,0,0|2,0,0]=4 1818 B12R1.26 COC(C)CCN1CC[C@@H](C1)O m_2230__3351214__22384146 [0,1,0,1,0,0|1,0,0]=3 1819 B12R1.26 COC(C)CCN1CC[C@H](C1)F m_2230__10719368__22384146 [0,1,0,1,0,0|2,0,0]=4 1820 B12R1.26 COC(C)CCN1CC[C@H](C1)N m_269982__7368756__22488948 [0,1,0,1,0,0|2,0,0]=4 1821 B12R1.26 CON(C)CCC1CCC(O1)C m_2230__679026__15746382 [0,1,0,1,0,0|2,0,0]=4 1822 B12R1.26 CSC(C)CCN1CC[C@@H](C1)O m_270004__8131000__24721392 [0,1,0,1,0,0|1,1,0]=4 1823 B12R1.26 C[C@H](CO)NC[C@@H]1CC[C@@H](O1)C m_2230__22399532__18325820 [0,1,0,1,0,0|2,0,0]=4 1824 B12R1.50 CC(CO)CN1CCCC(C1)O m_2230__678744__7968764 [0,1,0,1,0,0|2,0,0]=4 1825 B12R1.50 CC(CO)S[C@@H]1CCC[C@@H](C1)O m_7__17656074__17610454 [0,1,0,1,0,0|2,0,0]=4 1826 B12R1.50 CCC(O)CN1CCCC(C1)O m_2230__678744__3849034 [0,1,0,1,0,0|2,0,0]=4 1827 B12R1.50 COC(C)CN1CCCC(C1)O m_2230__678744__8635204 [0,1,0,1,0,0|2,0,0]=4 1828 B12R1.50 CON(C)CC1CCCC(O1)C m_2230__679026__22994108 [0,1,0,1,0,0|2,0,0]=4 1829 B12R1.50 OC(CF)CN1CCCC(C1)O m_2230__678744__22376420 [0,1,0,1,0,0|2,0,0]=4 1830 B12R1.50 OCC(O)CN1CCCC(C1)O m_2230__678744__3173054 [0,1,0,1,0,0|2,0,0]=4 1831 B12R1.50 OC[C@@H](O)CN1CCCC(C1)O m_2230__678744__679958 [0,1,0,1,0,0|2,0,0]=4 1832 B12R1.59 C#CC1CCN(C1)CCC(C)O m_2230__19973224__12057944 [0,1,0,1,0,0|2,0,0]=4 1833 B12R1.59 C=CC1CCN(C1)CCC(C)O m_2230__22405906__12057944 [0,1,0,1,0,0|2,0,0]=4 1834 B12R1.59 CC(C)CCN1CC[C@H](C1)CO m_2230__17547532__681192 [0,1,0,1,0,0|2,0,0]=4 1835 B12R1.59 CC(F)CCN1CC[C@H](C1)CO m_2230__17547532__13165354 [0,1,0,1,0,0|2,0,0]=4 1836 B12R1.59 CC(O)CCN1CCC(C1)C#N m_2230__12106406__12057944 [0,1,0,1,0,0|2,0,0]=4 1837 B12R1.59 CC(O)CCN1CCC(C1)CF m_2230__12898946__12057944 [0,1,0,1,0,0|2,0,0]=4 1838 B12R1.59 CC(O)CCN1CCC(C1)CN m_269982__7368796__22488918 [0,1,0,1,0,0|2,0,0]=4 1839 B12R1.59 CC(O)CCN1CC[C@H](C1)CO m_2230__17547532__12057944 [0,1,0,1,0,0|1,0,0]=3 1840 B12R1.59 CC(O)CNC1CCC(C1)CO m_270004__8288774__24722568 [0,1,0,1,0,0|2,0,0]=4 1841 B12R1.59 CC(O)CN[C@@H]1CC[C@@H](C1)CO m_273610__24475148__11516404 [0,1,0,1,0,0|2,0,0]=4 1842 B12R1.59 CCC1CCN(C1)CCC(C)O m_2230__6954978__12057944 [0,1,0,1,0,0|2,0,0]=4 1843 B12R1.59 CNC1CCN(C1)CCC(C)O m_269982__7368758__22488918 [0,1,0,1,0,0|2,0,0]=4 1844 B12R1.59 CO[C@@H]1CC[C@@H](C1)NCC(C)O m_273610__21998186__11516404 [0,1,0,1,0,0|2,0,0]=4 1845 B12R1.59 CO[C@H]1CCN(C1)CCC(C)C m_2230__6546976__681192 [0,1,0,1,0,0|2,0,0]=4 1846 B12R1.59 CO[C@H]1CCN(C1)CCC(C)F m_2230__6546976__13165354 [0,1,0,1,0,0|2,0,0]=4 1847 B12R1.59 CO[C@H]1CCN(C1)CCC(C)O m_2230__6546976__12057944 [0,1,0,1,0,0|1,0,0]=3 1848 B12R1.59 CO[C@H]1CCN(C1)CC[C@@H](C)N m_269982__7373230__25012466 [0,1,0,1,0,0|2,0,0]=4 1849 B12R1.59 CSC1CCN(C1)CCC(C)O m_2230__10690848__12057944 [0,1,0,1,0,0|1,1,0]=4 1850 B12R1.59 C[C@@H](N)CCN1CC[C@H](C1)CO m_269982__17547584__25012466 [0,1,0,1,0,0|2,0,0]=4 1851 B12R1.224 CC(O)CN1CCC[C@@H]([C@@H]1C)O m_2230__13038652__9736146 [0,1,0,1,0,0|2,0,0]=4 1852 B12R1.257 CC(C)CCSCCC1CCO1 m_7__22987856__22866650 [0,1,0,1,0,0|1,1,0]=4 1853 B12R1.257 CC(C)CCSCCC1COC1 m_7__22987856__16711750 [0,1,0,1,0,0|1,1,0]=4 1854 B12R1.257 CC(N)CCSCCC1CCO1 m_34__20871470__22866652 [0,1,0,1,0,0|1,1,0]=4 1855 B12R1.257 CC(N)CCSCCC1COC1 m_7__20871360__16711750 [0,1,0,1,0,0|1,1,0]=4 1856 B12R1.257 CC(O)CCCNCC1COC1 m_207__9448672__22332602 [0,1,0,1,0,0|2,0,0]=4 1857 B12R1.257 CC(O)CCCSCC1COC1 m_7__22987642__10688172 [0,1,0,1,0,0|2,0,0]=4 1858 B12R1.257 CC(O)CCSCCC1CCC1 m_62__12057938__12121634 [0,1,0,1,0,0|1,1,0]=4 1859 B12R1.355 CC(CO)CCNCC1CC1C m_270004__23845770__9139722 [0,1,0,1,0,0|2,0,0]=4 1860 B12R1.355 CC(CO)CCNCC1CC1Cl m_270004__23845770__15344010 [0,1,0,1,0,0|2,0,0]=4 1861 B12R1.355 CCC(O)CCSC[C@@H]1C[C@H]1C m_62__16640708__23861442 [0,1,0,1,0,0|1,1,0]=4 1862 B12R1.355 COC(C)CCNCC1CC1C m_270004__8290112__24721380 [0,1,0,1,0,0|2,0,0]=4 1863 B12R1.355 COC(C)CCNCC1CC1Cl m_270004__18333456__24721380 [0,1,0,1,0,0|2,0,0]=4 1864 B12R1.355 COC(C)CCNC[C@@H]1C[C@H]1Br m_270004__23833090__24721380 [0,1,0,1,0,0|2,0,0]=4 1865 B12R1.355 COC(C)CCNC[C@@H]1C[C@H]1C m_270004__16491714__24721380 [0,1,0,1,0,0|2,0,0]=4 1866 B12R1.355 COC(C)CCNC[C@@H]1C[C@H]1F m_270004__23817766__24721380 [0,1,0,1,0,0|2,0,0]=4 1867 B12R1.355 COC(C)CCNC[C@@H]1C[C@H]1O m_270004__25073046__24721380 [0,1,0,1,0,0|1,0,0]=3 1868 B12R1.355 COC(C)CCSC[C@@H]1C[C@H]1C m_7__22987798__23861434 [0,1,0,1,0,0|1,1,0]=4 1869 B12R1.355 CSC(C)CCNC[C@@H]1C[C@H]1O m_270004__25073046__24721392 [0,1,0,1,0,0|1,1,0]=4 1870 B12R1.360 CC(CO)CCNCCC1CC1 m_270004__23845770__13455800 [0,1,0,1,0,0|2,0,0]=4 1871 B12R1.360 CCC(O)CCNCCC1CC1 m_270004__8299014__13455800 [0,1,0,1,0,0|2,0,0]=4 1872 B12R1.360 CCC(O)CCSCCC1CC1 m_62__16640708__9143162 [0,1,0,1,0,0|1,1,0]=4 1873 B12R1.360 COC(C)CCNCCC1CC1 m_270004__10742084__13455800 [0,1,0,1,0,0|2,0,0]=4 1874 B12R1.360 COC(C)CCSCCC1CC1 m_7__22987798__9143154 [0,1,0,1,0,0|1,1,0]=4 1875 B12R1.360 CON(C)CCOCCC1CC1 m_2230__679026__17606302 [0,1,0,1,0,0|2,0,0]=4 1876 B12R1.394 CC(CO)CCNC1CC(C1)C m_269862__24471902__8852816 [0,1,0,1,0,0|2,0,0]=4 1877 B12R1.394 CC(CO)NCCC1CC(C1)O m_269862__9330358__15157990 [0,1,0,1,0,0|2,0,0]=4 1878 B12R1.394 CC(CO)NCC[C@H]1C[C@H](C1)O m_269862__17837642__15157990 [0,1,0,1,0,0|2,0,0]=4 1879 B12R1.394 CC1CC(C1)NCC[C@@H](O)CO m_269862__14590510__8852816 [0,1,0,1,0,0|2,0,0]=4 1880 B12R1.394 CCC(O)CCNC1CC(C1)C m_269862__7199956__8852816 [0,1,0,1,0,0|2,0,0]=4 1881 B12R1.394 CCC(O)CNCC1CC(C1)O m_273610__12309062__11516276 [0,1,0,1,0,0|2,0,0]=4 1882 B12R1.394 COC(C)CCNC1CC(C1)C m_269862__10742082__8852816 [0,1,0,1,0,0|2,0,0]=4 1883 B12R1.394 COC(C)CCNC1CC(C1)O m_270004__20075652__24721380 [0,1,0,1,0,0|1,0,0]=3 1884 B12R1.394 COC(C)CCN[C@H]1C[C@@H](C1)C m_270004__23846548__24721380 [0,1,0,1,0,0|2,0,0]=4 1885 B12R1.394 COC(C)CCN[C@H]1C[C@H](C1)F m_270004__23846822__24721380 [0,1,0,1,0,0|2,0,0]=4 1886 B12R1.394 COC(C)CCSC1CC(C1)O m_7__22987798__10953812 [0,1,0,1,0,0|0,1,0]=3 1887 B12R1.394 CSC(C)CCNC1CC(C1)O m_270004__20075652__24721392 [0,1,0,1,0,0|1,1,0]=4 1888 B12R1.394 C[C@H](CO)NCCC1CC(C1)O m_2230__22399532__22383896 [0,1,0,1,0,0|2,0,0]=4 1889 B12R1.394 OC1CC(C1)CNC[C@H](O)CF m_273610__12309062__14323916 [0,1,0,1,0,0|2,0,0]=4 1890 B12R1.395 CC(C)CCNC[C@H]1C[C@H]1CO m_207__16790512__134014 [0,1,0,1,0,0|2,0,0]=4 1891 B12R1.395 CC[C@H]1C[C@@H]1CNCCC(C)O m_270004__8296476__18897550 [0,1,0,1,0,0|2,0,0]=4 1892 B12R1.395 CC[C@H]1C[C@@H]1CSCCC(C)O m_62__12057938__13155124 [0,1,0,1,0,0|1,1,0]=4 1893 B12R1.430 C#CC1CC(C1)NCCC(C)O m_269862__7198110__22435172 [0,1,0,1,0,0|2,0,0]=4 1894 B12R1.430 C=CC1CC(C1)NCCC(C)O m_269862__7198110__14468066 [0,1,0,1,0,0|2,0,0]=4 1895 B12R1.430 CC(C)CCN[C@H]1C[C@@H](C1)CO m_207__13270480__134014 [0,1,0,1,0,0|2,0,0]=4 1896 B12R1.430 CC(C)CCSC1CC(C1)CO m_7__22987856__15703886 [0,1,0,1,0,0|1,1,0]=4 1897 B12R1.430 CC(N)CCSC1CC(C1)CO m_7__20871360__15703886 [0,1,0,1,0,0|1,1,0]=4 1898 B12R1.430 CC(O)CCNC1CC(C1)C#N m_269862__7198110__13939218 [0,1,0,1,0,0|2,0,0]=4 1899 B12R1.430 CC(O)CCNC1CC(C1)CCl m_270004__8296476__24722536 [0,1,0,1,0,0|2,0,0]=4 1900 B12R1.430 CC(O)CCNC1CC(C1)CF m_269862__7198110__16771544 [0,1,0,1,0,0|2,0,0]=4 1901 B12R1.430 CC(O)CCSC1CC(C1)CF m_7__22987852__12057932 [0,1,0,1,0,0|1,1,0]=4 1902 B12R1.430 CC(O)CNC[C@H]1C[C@@H](C1)CO m_273610__21808580__11516404 [0,1,0,1,0,0|2,0,0]=4 1903 B12R1.430 CCC1CC(C1)NCCC(C)O m_270004__8296476__9984736 [0,1,0,1,0,0|2,0,0]=4 1904 B12R1.430 COC1CC(C1)CNCC(C)O m_270004__8288774__12889332 [0,1,0,1,0,0|2,0,0]=4 1905 B12R1.430 COC1CC(C1)CSCC(C)O m_7__10953796__12310004 [0,1,0,1,0,0|2,0,0]=4 1906 B12R1.430 COC1CC(C1)NCCC(C)C m_270004__8288586__8901002 [0,1,0,1,0,0|2,0,0]=4 1907 B12R1.430 COC1CC(C1)NCCC(C)F m_270004__10546066__8901002 [0,1,0,1,0,0|2,0,0]=4 1908 B12R1.430 COC1CC(C1)NCCC(C)O m_270004__8296476__8901002 [0,1,0,1,0,0|1,0,0]=3 1909 B12R1.430 COC1CC(C1)SCCC(C)C m_7__22987856__9422502 [0,1,0,1,0,0|1,1,0]=4 1910 B12R1.430 COC1CC(C1)SCCC(C)N m_34__20871470__17694666 [0,1,0,1,0,0|1,1,0]=4 1911 B12R1.430 CO[C@H]1C[C@H](C1)CNCC(C)O m_273610__12345300__11516404 [0,1,0,1,0,0|2,0,0]=4 1912 B12R1.430 CO[C@H]1C[C@H](C1)NCCC(C)C m_207__9984038__134014 [0,1,0,1,0,0|2,0,0]=4 1913 B12R1.430 CSC1CC(C1)NCCC(C)O m_269862__7198110__12420008 [0,1,0,1,0,0|1,1,0]=4 1914 B12R1.438 CC(O)CN1CCCC(C1)CO m_2230__678750__9736146 [0,1,0,1,0,0|2,0,0]=4 1915 B12R1.438 COC1CCCN(C1)CC(C)O m_2230__7974910__9736146 [0,1,0,1,0,0|2,0,0]=4 1916 B12R1.534 CON(C)CC1OCCC1(C)C m_2230__679026__14058654 [0,1,0,1,0,0|2,0,0]=4 1917 B12R1.675 CCC1(CCN1CCC(C)O)C m_2230__22407902__12057944 [0,1,0,1,0,0|2,0,0]=4 1918 B12R1.679 CC(O)CN1CCC[C@@]1(C)CO m_2230__16807304__9736146 [0,1,0,1,0,0|2,0,0]=4 1919 B12R1.870 CC(C)CCN1CC[C@@H]([C@@H]1C)O m_2230__14788854__681192 [0,1,0,1,0,0|2,0,0]=4 1920 B12R1.870 CC(C)CCN1CC[C@@H]([C@H]1C)O m_2230__10747766__681192 [0,1,0,1,0,0|2,0,0]=4 1921 B12R1.870 CC(F)CCN1CC[C@@H]([C@@H]1C)O m_2230__14788854__13165354 [0,1,0,1,0,0|2,0,0]=4 1922 B12R1.870 CC(F)CCN1CC[C@@H]([C@H]1C)O m_2230__10747766__13165354 [0,1,0,1,0,0|2,0,0]=4 1923 B12R1.870 CC(O)CCN1CC[C@@H]([C@@H]1C)O m_2230__14788854__12057944 [0,1,0,1,0,0|1,0,0]=3 1924 B12R1.870 CC(O)CCN1CC[C@@H]([C@H]1C)O m_2230__10747766__12057944 [0,1,0,1,0,0|1,0,0]=3 1925 B12R1.2741 CC(O)CCNCC1[C@@H]([C@H]1C)C m_270004__8296476__17825432 [0,1,0,1,0,0|2,0,0]=4 1926 B12R1.2741 CC(O)CCSCC1[C@@H]([C@H]1C)C m_62__12057938__17665546 [0,1,0,1,0,0|1,1,0]=4 1927 B12R1.3852 CO[C@]1(C[C@H]1NCCC(C)C)C m_207__12111250__134014 [0,1,0,1,0,0|2,0,0]=4 1928 B12R2.76 CC1CCN(C1)C2CC(C2)O m_2230__6813990__10954060 [0,0,0,2,0,0|2,0,0]=4 1929 B12R2.76 OC1CC(C1)N2CC[C@@H](C2)F m_2230__10719192__10954060 [0,0,0,2,0,0|2,0,0]=4 1930 B12R2.76 OC1CC(C1)N2CC[C@@H](C2)O m_2230__3351214__10954060 [0,0,0,2,0,0|1,0,0]=3 1931 B12R2.76 OC1CC(C1)N2CC[C@H](C2)F m_2230__10719368__10954060 [0,0,0,2,0,0|2,0,0]=4 1932 B12R2.78 C[C@H]1C[C@@H]1CN2CC[C@@H](C2)O m_2230__3351214__23861446 [0,0,0,2,0,0|2,0,0]=4 1933 B12R2.1372 CC(O)CCN1CC2CC1C2 m_2230__14057288__12057944 [0,0,0,2,0,0|2,0,0]=4 1934 B12R2.1381 CC(O)CCN1CC2CC2C1 m_2230__13022236__12057944 [0,0,0,2,0,0|2,0,0]=4 1935 B12R2.2298 O[C@H]1CCN(C1)CCC2CC2 m_2230__3351214__6109134 [0,0,0,2,0,0|2,0,0]=4 1936 B12R2.5266 CC(O)CCN1CCC2C1C2 m_2230__7912980__12057944 [0,0,0,2,0,0|2,0,0]=4 1937 B12R2.113 CC1CC1CNC[C@@H]2C[C@H]2O m_270004__25073046__9139722 [0,0,0,2,0,0|2,0,0]=4 1938 B12R2.113 O[C@H]1C[C@@H]1CNCC2CC2Cl m_270004__25073046__15344010 [0,0,0,2,0,0|2,0,0]=4 1939 B12R2.236 CC1CC(C1)NC[C@@H]2C[C@H]2O m_270004__25073046__8852818 [0,0,0,2,0,0|2,0,0]=4 1940 B12R2.423 O[C@H]1C[C@@H]1CNCCC2CC2 m_270004__25073046__13455800 [0,0,0,2,0,0|2,0,0]=4 1941 B12R2.202 CN1CCO[C@H]2[C@@H]1C[C@H](C2)O m_2230__19980522__2463448 [0,0,0,2,0,0|2,0,0]=4 1942 B12R2.667 OC1CC(C1)NCCC2CC2 m_270004__20075652__13455800 [0,0,0,2,0,0|2,0,0]=4 1943 B12R2.667 OC1CC(C1)SCCC2CC2 m_7__18798568__10953812 [0,0,0,2,0,0|1,1,0]=4 1944 B12R2.1662 CC(O)CN1CC2CC(C1)O2 m_2230__13163476__9736146 [0,0,0,2,0,0|2,0,0]=4 1945 B8R0.28 CC(=O)OCCC(C)O m_1458__473186__12057942 [0,0,0,0,2,0|0,0,2]=4 1946 B8R0.28 CC(C)CNCC(C)O m_273610__13857024__11516404 [0,0,0,0,2,0|2,0,0]=4 1947 B8R0.28 CC(C)CSCC(C)O m_7__27301__10902704 [0,0,0,0,2,0|1,1,0]=4 1948 B8R0.28 CC(O)CCCN(C)C m_2230__22405892__2463448 [0,0,0,0,2,0|2,0,0]=4 1949 B8R0.28 CC(O)CCNC(C)C m_269862__7198110__7204804 [0,0,0,0,2,0|2,0,0]=4 1950 B8R0.28 CC(O)CCSC(C)C m_62__12057938__2390352 [0,0,0,0,2,0|1,1,0]=4 1951 B8R0.28 CC(O)CNCC(C)F m_273610__13857892__11516404 [0,0,0,0,2,0|2,0,0]=4 1952 B8R0.28 CC(O)CNCC(C)O m_273610__11554114__11516404 [0,0,0,0,2,0|1,0,0]=3 1953 B8R0.28 CC(O)CSCC(C)F m_7__10953796__16970746 [0,0,0,0,2,0|1,1,0]=4 1954 B8R0.28 CC(O)CSCC(C)O m_7__10953796__10902704 [0,0,0,0,2,0|0,1,0]=3 1955 B8R0.28 CC(O)CSC[C@H](C)N m_7__20871336__10902704 [0,0,0,0,2,0|1,1,0]=4 1956 B12R0.268 CC(=O)CCOCCSCC(C)O m_7__10953796__13817868 [0,0,0,0,0,2|0,0,2]=4 1957 B12R0.268 CC(C)CCCCCNCC(C)O m_273610__21496986__11516404 [0,0,0,0,0,2|2,0,0]=4 1958 B12R0.268 CC(C)CCCCNCCC(C)O m_270004__8296476__12202092 [0,0,0,0,0,2|2,0,0]=4 1959 B12R0.268 CC(C)CCCNCCCC(C)O m_207__9448672__7912414 [0,0,0,0,0,2|2,0,0]=4 1960 B12R0.268 CC(C)CCCSCCCC(C)O m_7__8333108__10688172 [0,0,0,0,0,2|1,1,0]=4 1961 B12R0.268 CC(C)CCOCCCNC(C)C m_269862__14244420__7204804 [0,0,0,0,0,2|2,0,0]=4 1962 B12R0.268 CC(C)CCOCCNCC(C)C m_207__2163318__121216 [0,0,0,0,0,2|2,0,0]=4 1963 B12R0.268 CC(C)CCOCCNCC(C)O m_273610__11520646__11516404 [0,0,0,0,0,2|1,0,0]=3 1964 B12R0.268 CC(C)CCOCCSCC(C)C m_62__15357102__2558630 [0,0,0,0,0,2|2,0,0]=4 1965 B12R0.268 CC(C)CCOCCSCC(C)F m_62__15357102__16913488 [0,0,0,0,0,2|2,0,0]=4 1966 B12R0.268 CC(C)CCOCCSCC(C)O m_7__10953796__1160058 [0,0,0,0,0,2|1,0,0]=3 1967 B12R0.268 CC(C)CCOCCSC[C@H](C)N m_7__20871336__1160058 [0,0,0,0,0,2|2,0,0]=4 1968 B12R0.268 CC(C)COCCCNCC(C)O m_273610__11516966__11516404 [0,0,0,0,0,2|2,0,0]=4 1969 B12R0.268 CC(C)COCCSCCC(C)O m_62__9820342__12057940 [0,0,0,0,0,2|1,1,0]=4 1970 B12R0.268 CC(C)CSCCCNCC(C)O m_273610__11525882__11516404 [0,0,0,0,0,2|2,0,0]=4 1971 B12R0.268 CC(C)CSCCCSCC(C)O m_7__10953796__7692380 [0,0,0,0,0,2|2,0,0]=4 1972 B12R0.268 CC(C)CSCCSCCC(C)O m_62__12057938__8268574 [0,0,0,0,0,2|1,1,0]=4 1973 B12R0.268 CC(O)CCCSCCOC(C)C m_7__22987390__10688172 [0,0,0,0,0,2|1,1,0]=4 1974 B12R0.268 CC(O)CCSCCCOC(C)C m_62__12057938__9273986 [0,0,0,0,0,2|1,1,0]=4 1975 B12R0.268 CC(O)CNCCCCOC(C)C m_273610__11526758__11516404 [0,0,0,0,0,2|2,0,0]=4 1976 B12R0.268 CC(O)CNCCOCCN(C)C m_273610__11526500__11516404 [0,0,0,0,0,2|2,0,0]=4 1977 B12R0.268 CC(O)CSCCOCCN(C)C m_7__10953796__22787330 [0,0,0,0,0,2|2,0,0]=4