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CCCNCCCCOCC m_270004__8288780__24710482 [1,0,0,0,0,0|2,0,1]=4 303 B10R0.71 CCCOCCSC/C=C\Br m_7__22544354__15503586 [1,0,0,0,0,0|3,0,0]=4 304 B10R0.71 CCCOCCSCC=CCl m_7__22987516__5103 [1,0,0,0,0,0|3,0,0]=4 305 B10R0.71 CCCOCCSCCCO m_7__22987516__6354 [1,0,0,0,0,0|2,0,1]=4 306 B10R0.71 CCCOCSCCCCO m_7__22849690__12361582 [1,0,0,0,0,0|2,0,1]=4 307 B10R0.71 CCCSCCCCCCO m_7__22986886__6673274 [1,0,0,0,0,0|1,0,1]=3 308 B10R0.71 CCCSCCCCCOC m_62__875778__9273984 [1,0,0,0,0,0|2,0,1]=4 309 B10R0.71 CCCSCCCCOCC m_7__22987402__14390332 [1,0,0,0,0,0|2,0,1]=4 310 B10R0.71 CCNCCCCCCCO m_270004__13810922__24715004 [1,0,0,0,0,0|1,0,1]=3 311 B10R0.71 CCNCCCCCCOC m_270004__21497418__24715004 [1,0,0,0,0,0|2,0,1]=4 312 B10R0.71 CCNCCCCCCSC m_270004__8686158__24715004 [1,0,0,0,0,0|2,0,1]=4 313 B10R0.71 CCNCCCCSCCO m_270004__23843874__24715004 [1,0,0,0,0,0|2,0,1]=4 314 B10R0.71 CCNCCCOCCCO m_270004__16500774__24715004 [1,0,0,0,0,0|2,0,1]=4 315 B10R0.71 CCNCCSCC=CCO m_7__22986872__16809272 [1,0,0,0,0,0|2,0,0]=3 316 B10R0.71 CCNCCSCCCCO m_7__22986872__3191338 [1,0,0,0,0,0|2,0,1]=4 317 B10R0.71 CCOCCCCNCCO m_270004__8349608__24710482 [1,0,0,0,0,0|2,0,1]=4 318 B10R0.71 CCOCCCCSCCO m_7__22987402__102708 [1,0,0,0,0,0|2,0,1]=4 319 B10R0.71 CCOCCCSC/C=C\Br m_7__22544354__5730872 [1,0,0,0,0,0|3,0,0]=4 320 B10R0.71 CCOCCCSCC=CCl m_7__22987520__5103 [1,0,0,0,0,0|3,0,0]=4 321 B10R0.71 CCOCCCSCCCO m_7__22987520__6354 [1,0,0,0,0,0|2,0,1]=4 322 B10R0.71 CCOCCSCCCCO m_7__22849690__5044 [1,0,0,0,0,0|2,0,1]=4 323 B10R0.71 CCSCCCCCCCO m_7__22987770__6174984 [1,0,0,0,0,0|1,0,1]=3 324 B10R0.71 CCSCCCCCCOC m_7__22987398__5047 [1,0,0,0,0,0|2,0,1]=4 325 B10R0.71 CCSCCCOCCCO m_7__22987770__22787260 [1,0,0,0,0,0|2,0,1]=4 326 B10R0.71 CCSCCCSC/C=C\Br m_7__22544354__6078538 [1,0,0,0,0,0|3,0,0]=4 327 B10R0.71 CCSCCCSCCCO m_7__10972294__6078538 [1,0,0,0,0,0|2,0,1]=4 328 B10R0.71 CCSCCNCCC=CBr m_270004__16490042__8765926 [1,0,0,0,0,0|3,0,0]=4 329 B10R0.71 CCSCCNCCCCO m_270004__9433178__8765926 [1,0,0,0,0,0|2,0,1]=4 330 B10R0.71 CCSCCSCC=CCO m_7__8765656__16809272 [1,0,0,0,0,0|2,0,0]=3 331 B10R0.71 CCSCCSCCCCO m_7__8765656__3191338 [1,0,0,0,0,0|2,0,1]=4 332 B10R0.71 CNCCSCCCCCO m_7__22986920__6079158 [1,0,0,0,0,0|2,0,1]=4 333 B10R0.71 COCCCCCNCCO m_270004__8349608__24721444 [1,0,0,0,0,0|2,0,1]=4 334 B10R0.71 COCCCCCSCCO m_7__22987588__102708 [1,0,0,0,0,0|2,0,1]=4 335 B10R0.71 COCCCCSC/C=C\Br m_7__22544354__4903360 [1,0,0,0,0,0|3,0,0]=4 336 B10R0.71 COCCCCSCC=CCl m_7__22986808__5103 [1,0,0,0,0,0|3,0,0]=4 337 B10R0.71 COCCCCSCCCO m_7__22986808__6354 [1,0,0,0,0,0|2,0,1]=4 338 B10R0.71 COCCCNCCC=CBr m_270004__16490042__24710510 [1,0,0,0,0,0|3,0,0]=4 339 B10R0.71 COCCCNCCCCO m_270004__9433178__24710510 [1,0,0,0,0,0|2,0,1]=4 340 B10R0.71 COCCCSCC=CCO m_7__17626136__16809272 [1,0,0,0,0,0|2,0,0]=3 341 B10R0.71 COCCCSCCCCO m_7__17626136__3191338 [1,0,0,0,0,0|2,0,1]=4 342 B10R0.71 COCCSCCCCCO m_7__6362310__6079158 [1,0,0,0,0,0|2,0,1]=4 343 B10R0.71 CSCCCSCC=CCO m_7__10890048__16809272 [1,0,0,0,0,0|2,0,0]=3 344 B10R0.71 CSCCCSCCCCO m_7__10890048__3191338 [1,0,0,0,0,0|2,0,1]=4 345 B10R0.71 ClCCCCNCCC=CBr m_270004__16490042__24721168 [1,0,0,0,0,0|3,0,0]=4 346 B10R0.71 FCCCCCSC/C=C\Br m_7__22544354__9984626 [1,0,0,0,0,0|3,0,0]=4 347 B10R0.71 FCCCCCSCC=CCl m_7__22986778__5103 [1,0,0,0,0,0|3,0,0]=4 348 B10R0.71 NCCCCCSCC=CCl m_7__20871376__5103 [1,0,0,0,0,0|3,0,0]=4 349 B10R0.71 NCCCCCSCCCO m_34__20871474__7931512 [1,0,0,0,0,0|2,0,1]=4 350 B10R0.71 NCCCCSCC=CCO m_7__20871294__16809272 [1,0,0,0,0,0|2,0,0]=3 351 B10R0.71 NCCCCSCCCCO m_7__20871294__3191338 [1,0,0,0,0,0|2,0,1]=4 352 B10R0.71 NCCCSCCCCCO m_7__20871288__6079158 [1,0,0,0,0,0|2,0,1]=4 353 B10R0.71 NCCSCCCCCCO m_7__20871276__6673274 [1,0,0,0,0,0|2,0,1]=4 354 B10R0.71 NOCCCSCC=CCO m_7__22987730__16809272 [1,0,0,0,0,0|3,0,0]=4 355 B10R0.71 OCC=CCSCCCCO m_7__22849690__16809272 [1,0,0,0,0,0|2,0,0]=3 356 B10R0.71 OCCCCCCSCCO m_7__128807__6673274 [1,0,0,0,0,0|2,0,1]=4 357 B10R0.71 OCCCCCSC/C=C\Br m_7__22544354__6079158 [1,0,0,0,0,0|3,0,0]=4 358 B10R0.71 OCCCCCSCCCO m_7__10972294__6079158 [1,0,0,0,0,0|2,0,1]=4 359 B10R0.71 OCCCCNCCCCCl m_270004__9433178__24721168 [1,0,0,0,0,0|2,0,1]=4 360 B10R0.71 OCCCCSCCCCF m_7__22849690__10157908 [1,0,0,0,0,0|2,0,1]=4 361 B10R0.71 OCCCCSCCCCO m_7__22849690__3191338 [1,0,0,0,0,0|2,0,1]=4 362 B10R0.71 OCCCNCCCCCCl m_270004__8288584__24721510 [1,0,0,0,0,0|2,0,1]=4 363 B10R0.71 OCCCSCCCCCF m_7__22986778__6354 [1,0,0,0,0,0|2,0,1]=4 364 B10R0.71 OCCNCCCCCCCl m_270004__8349608__24721042 [1,0,0,0,0,0|2,0,1]=4 365 B10R0.71 OCCNCCCCCCF m_270004__8349608__16464048 [1,0,0,0,0,0|2,0,1]=4 366 B12R0.1 C/C=C/C(=O)NCCCCCCC m_11__12209926__22136110 [0,1,0,0,0,0|2,0,1]=4 367 B12R0.1 C=CC=CCCNCC(C)CCC m_270004__12896186__8300564 [0,1,0,0,0,0|2,0,1]=4 368 B12R0.1 CC#CCSCCCC(=CCO)C m_7__22987458__22787184 [0,1,0,0,0,0|1,0,2]=4 369 B12R0.1 CC(=CCO)CCCSCCC#N m_7__10953802__22787184 [0,1,0,0,0,0|2,0,1]=4 370 B12R0.1 CC(=CCO)CCCSCCCN m_7__20871288__22787184 [0,1,0,0,0,0|2,0,0]=3 371 B12R0.1 CC(=CCO)CCCSCCCO m_7__10972294__22787184 [0,1,0,0,0,0|2,0,0]=3 372 B12R0.1 CC(=CCO)CSCCCCCF m_7__22986778__20765532 [0,1,0,0,0,0|2,0,0]=3 373 B12R0.1 CC(=CCO)CSCCCCCN m_7__20871376__20765532 [0,1,0,0,0,0|2,0,0]=3 374 B12R0.1 CC(=CCO)CSCCNCCN m_7__20871306__20765532 [0,1,0,0,0,0|3,0,0]=4 375 B12R0.1 CC(=CCO)CSCCOCCF m_7__22988070__20765532 [0,1,0,0,0,0|3,0,0]=4 376 B12R0.1 CC(=CCO)CSCCOCCN m_7__20871382__20765532 [0,1,0,0,0,0|3,0,0]=4 377 B12R0.1 CC/C=C\CCCNC(C)CCC m_270004__8290534__24594278 [0,1,0,0,0,0|2,0,0]=3 378 B12R0.1 CC/C=C\CCCNC(C)CCO m_270004__8296818__24594278 [0,1,0,0,0,0|3,0,0]=4 379 B12R0.1 CC/C=C\CCCN[C@@H](C)CCO m_270004__13469994__24594278 [0,1,0,0,0,0|3,0,0]=4 380 B12R0.1 CC/C=C\CCCN[C@@H](C)CSC m_270004__23847226__24594278 [0,1,0,0,0,0|3,0,0]=4 381 B12R0.1 CC/C=C\CCCN[C@H](C)CCF m_270004__23850742__24594278 [0,1,0,0,0,0|3,0,0]=4 382 B12R0.1 CC/C=C\CCCN[C@H](C)COC m_270004__8299624__24594278 [0,1,0,0,0,0|3,0,0]=4 383 B12R0.1 CC/C=C\CCCOC(=O)CCC m_276436__20064276__14088342 [0,1,0,0,0,0|2,0,1]=4 384 B12R0.1 CC=CC(=O)NCCCCCCC m_273270__13687270__15281756 [0,1,0,0,0,0|2,0,1]=4 385 B12R0.1 CCC=CCCSCC(C)COC m_7__20064958__8859716 [0,1,0,0,0,0|3,0,0]=4 386 B12R0.1 CCC=NOCCCC(C)CCC m_34__17309904__12216602 [0,1,0,0,0,0|3,0,0]=4 387 B12R0.1 CCCC(C)CCCSCCCO m_7__10972294__12216600 [0,1,0,0,0,0|1,0,2]=4 388 B12R0.1 CCCC(C)CCNCCCCO m_270004__9433178__24594192 [0,1,0,0,0,0|1,0,2]=4 389 B12R0.1 CCCC(C)CNCCC#CCO m_270004__21537562__8300564 [0,1,0,0,0,0|1,0,2]=4 390 B12R0.1 CCCC(C)CNCCCCCO m_270004__9456968__8300564 [0,1,0,0,0,0|1,0,2]=4 391 B12R0.1 CCCC(C)CNCCOCCO m_270004__8288648__8300564 [0,1,0,0,0,0|2,0,1]=4 392 B12R0.1 CCCC(C)CNCCSCCO m_270004__21508858__8300564 [0,1,0,0,0,0|2,0,1]=4 393 B12R0.1 CCCC(C)NCCCCCCO m_2230__22397382__13038782 [0,1,0,0,0,0|1,0,2]=4 394 B12R0.1 CCCC(C)NCCCOCCO m_269862__8602158__7200560 [0,1,0,0,0,0|2,0,1]=4 395 B12R0.1 CCCC(C)SCCCCCCO m_7__14428530__6673274 [0,1,0,0,0,0|1,0,2]=4 396 B12R0.1 CCCCCCCCC(=O)NCC m_22__57815__335740 [0,1,0,0,0,0|2,0,0]=3 397 B12R0.1 CCCCCCCCC(=O)NNC m_240690__21584010__7404582 [0,1,0,0,0,0|3,0,0]=4 398 B12R0.1 CCCCCCCCC(=O)NOC m_22__461212__335740 [0,1,0,0,0,0|3,0,0]=4 399 B12R0.1 CCCCCCCCC(=O)OCC m_1458__803704__1327610 [0,1,0,0,0,0|2,0,0]=3 400 B12R0.1 CCCCCCCCC(C)NCC m_270004__8160850__24709372 [0,1,0,0,0,0|2,0,1]=4 401 B12R0.1 CCCCCCCCN(C)CCC m_2230__2261920__9282126 [0,1,0,0,0,0|2,0,1]=4 402 B12R0.1 CCCCCCCCN(C)CCF m_2230__18340798__22320836 [0,1,0,0,0,0|2,0,1]=4 403 B12R0.1 CCCCCCCCN(C)CCN m_269982__18340862__14439794 [0,1,0,0,0,0|2,0,1]=4 404 B12R0.1 CCCCCCCCN(C)CCO m_2230__18340798__6165700 [0,1,0,0,0,0|1,0,1]=3 405 B12R0.1 CCCCCCCNC(=O)CCBr m_270062__12209966__20844442 [0,1,0,0,0,0|2,0,1]=4 406 B12R0.1 CCCCCCCNC(=O)CCC m_270062__12209966__17814498 [0,1,0,0,0,0|2,0,1]=4 407 B12R0.1 CCCCCCCNC(=O)CCN m_240690__12226084__3025680 [0,1,0,0,0,0|2,0,1]=4 408 B12R0.1 CCCCCCCNC(=O)CCO m_487__12209942__12879784 [0,1,0,0,0,0|1,0,1]=3 409 B12R0.1 CCCCCCCNC(=O)NCC m_2554__12209954__951600 [0,1,0,0,0,0|3,0,0]=4 410 B12R0.1 CCCCCCCNC(=O)OCC m_282070__22230938__22150950 [0,1,0,0,0,0|3,0,0]=4 411 B12R0.1 CCCCCCCNC(=S)NCC m_8__12209924__83696 [0,1,0,0,0,0|3,0,0]=4 412 B12R0.1 CCCCCCCNC(C)CCO m_2230__22400640__7284644 [0,1,0,0,0,0|1,0,2]=4 413 B12R0.1 CCCCCCCN[C@@H](C)CCO m_270004__13469994__24715022 [0,1,0,0,0,0|1,0,2]=4 414 B12R0.1 CCCCCCCOC(=O)CCC m_276436__14076620__14088342 [0,1,0,0,0,0|2,0,1]=4 415 B12R0.1 CCCCCCCOC(=O)CCF m_276436__14076620__14107760 [0,1,0,0,0,0|2,0,1]=4 416 B12R0.1 CCCCCCCSC(C)CCO m_7__5819074__7284628 [0,1,0,0,0,0|1,0,2]=4 417 B12R0.1 CCCCCCNCC(=O)NCC m_270004__11974938__24715030 [0,1,0,0,0,0|3,0,0]=4 418 B12R0.1 CCCCCCNCC(=O)OCC m_270004__8288590__8957134 [0,1,0,0,0,0|3,0,0]=4 419 B12R0.1 CCCCCCNCC(C)CCO m_270004__8297522__24715030 [0,1,0,0,0,0|1,0,2]=4 420 B12R0.1 CCCCCCON=C(N)CCO m_34__8845210__9139750 [0,1,0,0,0,0|2,0,1]=4 421 B12R0.1 CCCCCCSCC(=O)NCC m_62__8854732__81303 [0,1,0,0,0,0|3,0,0]=4 422 B12R0.1 CCCCCCSCC(=O)OCC m_7__27132__846538 [0,1,0,0,0,0|3,0,0]=4 423 B12R0.1 CCCCCCSCC(O)CCO m_63__18991476__16726650 [0,1,0,0,0,0|1,0,2]=4 424 B12R0.1 CCCCCSCCC(=O)NCC m_7__8271838__22787600 [0,1,0,0,0,0|3,0,0]=4 425 B12R0.1 CCCCCSCCC(=O)OCC m_7__8271838__8331412 [0,1,0,0,0,0|3,0,0]=4 426 B12R0.1 CCCCCSCCN(C)CCO m_2230__679202__15748368 [0,1,0,0,0,0|2,0,1]=4 427 B12R0.1 CCCCOCCNC(=O)CCO m_487__2163362__12879784 [0,1,0,0,0,0|2,0,1]=4 428 B12R0.1 CCCCSCCCC(=O)OCC m_7__22987394__770176 [0,1,0,0,0,0|3,0,0]=4 429 B12R0.1 CCCN(C)CCCCCCCO m_2230__2261920__6174988 [0,1,0,0,0,0|1,0,2]=4 430 B12R0.1 CCCNCCCCC(=O)OCC m_270004__8288780__24721568 [0,1,0,0,0,0|3,0,0]=4 431 B12R0.1 CCCOCCSCC(=CCO)C m_7__22987516__20765532 [0,1,0,0,0,0|2,0,0]=3 432 B12R0.1 CCCSCCCCC(=O)OCC m_7__22986886__16907524 [0,1,0,0,0,0|3,0,0]=4 433 B12R0.1 CCNC(=O)CCCCCCCN m_240690__7350950__18318972 [0,1,0,0,0,0|3,0,0]=4 434 B12R0.1 CCNC(=O)CCCCCCSC m_22__57815__12298720 [0,1,0,0,0,0|3,0,0]=4 435 B12R0.1 CCNC(=O)CCCCCOCC m_22__57815__12623512 [0,1,0,0,0,0|3,0,0]=4 436 B12R0.1 CCNCCCCCC(=O)OCC m_270004__21497858__24715004 [0,1,0,0,0,0|3,0,0]=4 437 B12R0.1 CCOC(=O)CCCCCCSC m_1458__12298724__1327610 [0,1,0,0,0,0|3,0,0]=4 438 B12R0.1 CCOC(=O)CCCCCSCC m_62__5063378__6469026 [0,1,0,0,0,0|3,0,0]=4 439 B12R0.1 CCOC(=O)CCSCC=CCO m_7__12427120__16809272 [0,1,0,0,0,0|2,0,1]=4 440 B12R0.1 CCOCCCCCC(=O)OCC m_1458__12623516__1327610 [0,1,0,0,0,0|3,0,0]=4 441 B12R0.1 CCOCCCCNC(=O)CCO m_487__1000098__12879784 [0,1,0,0,0,0|2,0,1]=4 442 B12R0.1 CCOCCCSCC(=CCO)C m_7__22987520__20765532 [0,1,0,0,0,0|2,0,0]=3 443 B12R0.1 CN(CCO)CCCCCCCN m_269982__22515300__10880334 [0,1,0,0,0,0|2,0,1]=4 444 B12R0.1 CN(CCO)CCCCCCCO m_2230__679202__6174988 [0,1,0,0,0,0|2,0,1]=4 445 B12R0.1 CNCCSCCCC(=CCO)C m_7__22986920__22787184 [0,1,0,0,0,0|2,0,0]=3 446 B12R0.1 COCCCCCCN(C)CCO m_2230__679202__22383768 [0,1,0,0,0,0|2,0,1]=4 447 B12R0.1 COCCCCCNC(=O)CCO m_487__2303904__12879784 [0,1,0,0,0,0|2,0,1]=4 448 B12R0.1 COCCCCSCC(=CCO)C m_7__22986808__20765532 [0,1,0,0,0,0|2,0,0]=3 449 B12R0.1 COCCSCCCC(=CCO)C m_7__6362310__22787184 [0,1,0,0,0,0|2,0,0]=3 450 B12R0.1 CSCCCCCNC(=O)CCO m_487__8992118__12879784 [0,1,0,0,0,0|2,0,1]=4 451 B12R0.1 O=C(CCO)NCCCCCCO m_487__8283000__12879784 [0,1,0,0,0,0|2,0,1]=4 452 B12R0.5 C#CCCCCSCCC=CCC m_62__8859720__17318686 [0,1,0,0,0,0|1,0,2]=4 453 B12R0.5 C#CCCCNCCC/C=C\CC m_270004__9228486__24594278 [0,1,0,0,0,0|1,0,2]=4 454 B12R0.5 C#CCCSCCCCCCCC m_62__18060672__9282118 [0,1,0,0,0,0|2,0,1]=4 455 B12R0.5 C/C=C/CCNCCC/C=C\CC m_270004__23849830__24594278 [0,1,0,0,0,0|1,0,2]=4 456 B12R0.5 C/C=C/CCNCCCCCCC m_270004__23849830__24715022 [0,1,0,0,0,0|1,0,2]=4 457 B12R0.5 C/C=C/CCSCCCCCCC m_62__23858414__7284636 [0,1,0,0,0,0|1,0,2]=4 458 B12R0.5 C=C=CCCNCCCCCCC m_270004__16969572__24715022 [0,1,0,0,0,0|1,0,2]=4 459 B12R0.5 C=CC=CCCNCCCCCC m_270004__12896186__24715030 [0,1,0,0,0,0|1,0,1]=3 460 B12R0.5 C=CC=CCCNCCCCCCl m_270004__12896186__24721510 [0,1,0,0,0,0|2,0,1]=4 461 B12R0.5 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COCCCCCNCCCCO m_270004__9433178__24721444 [0,1,0,0,0,0|1,0,2]=4 623 B12R0.5 COCCCCCSCC#CCO m_62__5002782__15141012 [0,1,0,0,0,0|1,0,2]=4 624 B12R0.5 COCCCCCSCC=CC#N m_7__22987588__7140602 [0,1,0,0,0,0|2,0,1]=4 625 B12R0.5 COCCCCCSCC=CCO m_7__22987588__16809272 [0,1,0,0,0,0|1,0,0]=2 626 B12R0.5 COCCCCCSCCCCO m_7__22987588__3191338 [0,1,0,0,0,0|1,0,2]=4 627 B12R0.5 COCCCCSCCCCCO m_7__22986808__6079158 [0,1,0,0,0,0|1,0,2]=4 628 B12R0.5 COCCCCSCCOCCO m_62__10159084__8799516 [0,1,0,0,0,0|2,0,1]=4 629 B12R0.5 COCCCNCCCCCCO m_270004__8300498__24710510 [0,1,0,0,0,0|1,0,2]=4 630 B12R0.5 COCCCNCCCOCCO m_270004__8602160__24710510 [0,1,0,0,0,0|2,0,1]=4 631 B12R0.5 COCCCNCCCSCCO m_270004__23851182__24710510 [0,1,0,0,0,0|2,0,1]=4 632 B12R0.5 COCCCSCCCCCCO m_7__17626136__6673274 [0,1,0,0,0,0|1,0,2]=4 633 B12R0.5 COCCOCCSCC=CCO m_7__13607890__16809272 [0,1,0,0,0,0|2,0,0]=3 634 B12R0.5 COCCSCCCCCCCO m_7__6362310__6174984 [0,1,0,0,0,0|1,0,2]=4 635 B12R0.5 CSCCCSCCCCCCO m_7__10890048__6673274 [0,1,0,0,0,0|1,0,2]=4 636 B12R0.5 NCCCCCSCCCCCO m_7__20871376__6079158 [0,1,0,0,0,0|1,0,2]=4 637 B12R0.5 NCCCCCSCCOCCO m_34__20871474__11974694 [0,1,0,0,0,0|2,0,1]=4 638 B12R0.5 NCCCCSCCCCCCO m_34__20871448__7207104 [0,1,0,0,0,0|1,0,2]=4 639 B12R0.5 NCCCNCCSCC=CCO m_7__20871384__16809272 [0,1,0,0,0,0|2,0,0]=3 640 B12R0.5 NCCCSCCCCCCCO m_7__20871288__6174984 [0,1,0,0,0,0|1,0,2]=4 641 B12R0.5 NCCSCCCCCCCCO m_7__20871276__22787460 [0,1,0,0,0,0|1,0,2]=4 642 B12R0.5 OCC#CCCNCCCCCCl m_270004__21537562__24721510 [0,1,0,0,0,0|1,0,2]=4 643 B12R0.5 OCCCCCCCCSCCO m_7__128807__22787460 [0,1,0,0,0,0|1,0,1]=3 644 B12R0.5 OCCCCCCCSCCCO m_7__10972294__6174984 [0,1,0,0,0,0|1,0,2]=4 645 B12R0.5 OCCCCCCNCCCCCl m_270004__8300498__24721168 [0,1,0,0,0,0|1,0,2]=4 646 B12R0.5 OCCCCCCSCCCCO m_7__22849690__6673274 [0,1,0,0,0,0|1,0,2]=4 647 B12R0.5 OCCCCCNCCCCCCl m_270004__9456968__24721510 [0,1,0,0,0,0|1,0,2]=4 648 B12R0.5 OCCCCCSCCCCCF m_7__22986778__6079158 [0,1,0,0,0,0|1,0,2]=4 649 B12R0.5 OCCCCNCCCCCCCl m_270004__9433178__24721042 [0,1,0,0,0,0|1,0,2]=4 650 B12R0.5 OCCCCNCCCCCCF m_270004__9433178__16464048 [0,1,0,0,0,0|1,0,2]=4 651 B12R0.5 OCCOCCCNCCCCCl m_270004__8602160__24721168 [0,1,0,0,0,0|2,0,1]=4 652 B12R0.5 OCCOCCNCCCCCCl m_270004__8288648__24721510 [0,1,0,0,0,0|2,0,1]=4 653 B12R0.5 OCCOCCSCCCCCF m_62__9984632__8799516 [0,1,0,0,0,0|2,0,1]=4 654 B12R0.5 OCCSCCCNCCCCCl m_270004__23851182__24721168 [0,1,0,0,0,0|2,0,1]=4 655 B12R0.5 OCCSCCNCCCCCCl m_270004__21508858__24721510 [0,1,0,0,0,0|2,0,1]=4 656 B12R0.47 C#CCCCC(C)NCC=CCO m_270004__11971554__24722748 [0,1,0,0,0,0|1,0,2]=4 657 B12R0.47 C=CC=CCCN(C)CCCCC m_2230__22407254__12907972 [0,1,0,0,0,0|2,0,1]=4 658 B12R0.47 C=CCCCC(C)NCC=CCO m_2230__22404646__16809276 [0,1,0,0,0,0|1,0,2]=4 659 B12R0.47 C=CCCCCN(C)CC=CCO m_2230__13469790__16809276 [0,1,0,0,0,0|1,0,2]=4 660 B12R0.47 CC(CCCCCl)NCC=CCO m_270004__11971554__24722576 [0,1,0,0,0,0|2,0,0]=3 661 B12R0.47 CC(CCCCN)NC/C=C/CN m_269982__22505242__22485940 [0,1,0,0,0,0|3,0,0]=4 662 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m_2230__2067964__8859726 [0,1,0,0,0,0|3,0,0]=4 675 B12R0.47 CCC=CCCN(C)CCCSC m_2230__9749472__8859726 [0,1,0,0,0,0|3,0,0]=4 676 B12R0.47 CCC=CCCN(C)CCOCC m_2230__8253658__8859726 [0,1,0,0,0,0|3,0,0]=4 677 B12R0.47 CCC=CCNC(=O)CCCCC m_527__17312556__336054 [0,1,0,0,0,0|2,0,1]=4 678 B12R0.47 CCC=CCNC(C)CCCCC m_269862__17312576__7200472 [0,1,0,0,0,0|2,0,0]=3 679 B12R0.47 CCC=CCNC(C)CCCOC m_269862__17312576__7201632 [0,1,0,0,0,0|3,0,0]=4 680 B12R0.47 CCC=CCNC(C)CSCCC m_269862__17312576__13438920 [0,1,0,0,0,0|3,0,0]=4 681 B12R0.47 CCC=CCOC(=O)CCCCC m_276436__14083704__14085900 [0,1,0,0,0,0|2,0,1]=4 682 B12R0.47 CCCCCC(=O)NC/C=C\CN m_240690__21478158__7404698 [0,1,0,0,0,0|2,0,1]=4 683 B12R0.47 CCCCCC(=O)NCC=CCO m_527__11971536__336054 [0,1,0,0,0,0|1,0,1]=3 684 B12R0.47 CCCCCC(=O)OCC=CCO m_1458__473132__16809274 [0,1,0,0,0,0|1,0,1]=3 685 B12R0.47 CCCCCC(C)NC/C=C\CN m_272690__21478164__11346240 [0,1,0,0,0,0|2,0,0]=3 686 B12R0.47 CCCCCC(C)NCC=CCO m_270004__11971554__8844946 [0,1,0,0,0,0|1,0,0]=2 687 B12R0.47 CCCCCC(C)NCCCCO m_269862__9433176__7200472 [0,1,0,0,0,0|1,0,2]=4 688 B12R0.47 CCCCCCC(=O)CSCCO m_7__128807__9155818 [0,1,0,0,0,0|1,0,2]=4 689 B12R0.47 CCCCCCC(C)NCCCO m_269862__7192678__7200330 [0,1,0,0,0,0|1,0,2]=4 690 B12R0.47 CCCCCCC(O)CNCCC m_273610__13857032__11516296 [0,1,0,0,0,0|2,0,1]=4 691 B12R0.47 CCCCCCC(O)CNCCF m_273610__13857118__11516296 [0,1,0,0,0,0|2,0,1]=4 692 B12R0.47 CCCCCCC(O)CNCCO m_273610__11554104__11516296 [0,1,0,0,0,0|1,0,1]=3 693 B12R0.47 CCCCCCC(O)CNOCC m_273610__11517342__11516296 [0,1,0,0,0,0|3,0,0]=4 694 B12R0.47 CCCCCCN(C)C/C=C/CN m_269982__22513698__22485940 [0,1,0,0,0,0|2,0,0]=3 695 B12R0.47 CCCCCCN(C)CC#CCO m_2230__22406770__15141016 [0,1,0,0,0,0|1,0,2]=4 696 B12R0.47 CCCCCCN(C)CC=CC#N m_2230__22406770__16945818 [0,1,0,0,0,0|2,0,1]=4 697 B12R0.47 CCCCCCN(C)CC=CCO m_2230__22406770__16809276 [0,1,0,0,0,0|1,0,0]=2 698 B12R0.47 CCCCCCN(C)CCCCO m_2230__22406770__3191342 [0,1,0,0,0,0|1,0,2]=4 699 B12R0.47 CCCCCN(C)CCCCCO m_2230__22407254__6079162 [0,1,0,0,0,0|1,0,2]=4 700 B12R0.47 CCCCCN(C)CCOCCO m_2230__22407254__11974698 [0,1,0,0,0,0|2,0,1]=4 701 B12R0.47 CCCCCNC(=O)C/C=C/CN m_240690__7350748__21394364 [0,1,0,0,0,0|2,0,1]=4 702 B12R0.47 CCCCCNC(C)CCCCO m_2230__22399050__5063396 [0,1,0,0,0,0|1,0,2]=4 703 B12R0.47 CCCCNC(=O)NCC=CCO m_68__23305620__85377 [0,1,0,0,0,0|2,0,1]=4 704 B12R0.47 CCCCNC(=S)NCC=CCO m_8__11971524__83695 [0,1,0,0,0,0|2,0,1]=4 705 B12R0.47 CCCCNC(C)CCCCCO m_2230__22404642__22993830 [0,1,0,0,0,0|1,0,2]=4 706 B12R0.47 CCCCOC(=O)NCC=CCO m_282070__22229464__22312810 [0,1,0,0,0,0|2,0,1]=4 707 B12R0.47 CCCCOCC(O)CNCCO m_273610__11554104__11516310 [0,1,0,0,0,0|2,0,1]=4 708 B12R0.47 CCCNCC(=O)NCC=CCO m_240690__11979432__21393044 [0,1,0,0,0,0|2,0,1]=4 709 B12R0.47 CCCOCC(=O)NCC=CCO m_527__11971536__2009698 [0,1,0,0,0,0|2,0,1]=4 710 B12R0.47 CCCOCC(=O)OCC=CCO m_1458__2009702__16809274 [0,1,0,0,0,0|2,0,1]=4 711 B12R0.47 CCCSCC(=O)NCC=CCO m_527__11971536__1055144 [0,1,0,0,0,0|2,0,1]=4 712 B12R0.47 CCCSCC(=O)OCC=CCO m_1458__9435366__16809274 [0,1,0,0,0,0|2,0,1]=4 713 B12R0.47 CCCSCC(C)NCC=CCO m_270004__11971554__13438922 [0,1,0,0,0,0|2,0,0]=3 714 B12R0.47 CCNCCC(=O)NCC=CCO m_240690__11979432__15160658 [0,1,0,0,0,0|2,0,1]=4 715 B12R0.47 CCOCCC(=O)NCC=CCO m_527__11971536__3124142 [0,1,0,0,0,0|2,0,1]=4 716 B12R0.47 CCOCCC(=O)OCC=CCO m_1458__3124146__16809274 [0,1,0,0,0,0|2,0,1]=4 717 B12R0.47 CCOCCCN(C)C/C=C/CN m_269982__22515342__22485940 [0,1,0,0,0,0|3,0,0]=4 718 B12R0.47 CCOCCCN(C)CC=CCO m_2230__22406790__16809276 [0,1,0,0,0,0|2,0,0]=3 719 B12R0.47 CCSCCC(=O)NCC=CCO m_527__11971536__950492 [0,1,0,0,0,0|2,0,1]=4 720 B12R0.47 CCSCCC(=O)OCC=CCO m_1458__5128708__16809274 [0,1,0,0,0,0|2,0,1]=4 721 B12R0.47 CCSCCC(C)NCC=CCO m_2230__22399618__16809276 [0,1,0,0,0,0|2,0,0]=3 722 B12R0.47 CN(C/C=C/CN)CCCCCN m_269982__17757614__22485940 [0,1,0,0,0,0|3,0,0]=4 723 B12R0.47 CN(C/C=C/CN)CCCCCO m_269982__22513738__22485940 [0,1,0,0,0,0|3,0,0]=4 724 B12R0.47 CN(CC=CCO)CCCCCN m_269982__17757614__16809282 [0,1,0,0,0,0|2,0,0]=3 725 B12R0.47 CN(CC=CCO)CCCCCO m_2230__9449864__16809276 [0,1,0,0,0,0|2,0,0]=3 726 B12R0.47 CN(CC=CCO)CCOCCN m_269982__12306202__16809282 [0,1,0,0,0,0|3,0,0]=4 727 B12R0.47 CN(CC=CCO)CCOCCO m_2230__9824938__16809276 [0,1,0,0,0,0|3,0,0]=4 728 B12R0.47 CNCCCC(=O)NCC=CCO m_240690__11979432__7368600 [0,1,0,0,0,0|2,0,1]=4 729 B12R0.47 CNCCCCN(C)C/C=C/CN m_269982__13951086__22485940 [0,1,0,0,0,0|3,0,0]=4 730 B12R0.47 CNCCCCN(C)CC=CCO m_269982__13951086__16809282 [0,1,0,0,0,0|2,0,0]=3 731 B12R0.47 COCCCC(=O)NCC=CCO m_527__11971536__872482 [0,1,0,0,0,0|2,0,1]=4 732 B12R0.47 COCCCC(=O)OCC=CCO m_1458__872488__16809274 [0,1,0,0,0,0|2,0,1]=4 733 B12R0.47 COCCCC(C)NC/C=C\CN m_272690__21478164__11347138 [0,1,0,0,0,0|3,0,0]=4 734 B12R0.47 COCCCC(C)NCC=CCO m_270004__11971554__24709838 [0,1,0,0,0,0|2,0,0]=3 735 B12R0.47 COCCCCN(C)C/C=C/CN m_269982__22516754__22485940 [0,1,0,0,0,0|3,0,0]=4 736 B12R0.47 COCCCCN(C)CC=CCO m_2230__11246776__16809276 [0,1,0,0,0,0|2,0,0]=3 737 B12R0.47 CSCCCC(=O)NCC=CCO m_527__11971536__5135672 [0,1,0,0,0,0|2,0,1]=4 738 B12R0.47 NCCCCC(=O)NCC=CCO m_240690__11979432__8629370 [0,1,0,0,0,0|2,0,1]=4 739 B12R0.47 O=C(CCCCCl)NCC=CCO m_22__11971526__7592952 [0,1,0,0,0,0|2,0,1]=4 740 B12R0.47 O=C(CCCCF)NCC=CCO m_22__11971526__15414764 [0,1,0,0,0,0|2,0,1]=4 741 B12R0.206 C=CC=CCCNC(C)CCCC m_2230__22399858__12907972 [0,1,0,0,0,0|2,0,1]=4 742 B12R0.206 CC/C=C\CCCN(C)CCCC m_270004__8127976__24594278 [0,1,0,0,0,0|2,0,0]=3 743 B12R0.206 CC/C=C\CCCN(C)CCCF m_270004__13040480__24594278 [0,1,0,0,0,0|3,0,0]=4 744 B12R0.206 CC/C=C\CCCN(C)CCCO m_270004__9787826__24594278 [0,1,0,0,0,0|3,0,0]=4 745 B12R0.206 CC/C=C\CCCN(C)CCOC m_270004__8129546__24594278 [0,1,0,0,0,0|3,0,0]=4 746 B12R0.206 CC/C=C\CCCN(C)CCSC m_270004__8138582__24594278 [0,1,0,0,0,0|3,0,0]=4 747 B12R0.206 CCC=CC(=O)NCCCCCC m_22__303720__12103034 [0,1,0,0,0,0|2,0,1]=4 748 B12R0.206 CCC=CC(=O)OCCCCCC m_276436__14076618__14096172 [0,1,0,0,0,0|2,0,1]=4 749 B12R0.206 CCC=CCCNC(C)CCCC m_2230__22399858__8859726 [0,1,0,0,0,0|2,0,0]=3 750 B12R0.206 CCC=CCCNC(C)CCCO m_2230__22399382__8859726 [0,1,0,0,0,0|3,0,0]=4 751 B12R0.206 CCC=CCCNC(C)CCOC m_2230__22398948__8859726 [0,1,0,0,0,0|3,0,0]=4 752 B12R0.206 CCC=CCCNC(C)CCSC m_2230__22399620__8859726 [0,1,0,0,0,0|3,0,0]=4 753 B12R0.206 CCC=CCCNC(C)COCC m_2230__22397432__8859726 [0,1,0,0,0,0|3,0,0]=4 754 B12R0.206 CCC=CCCOC(=O)CCCC m_276436__14083774__14088340 [0,1,0,0,0,0|2,0,1]=4 755 B12R0.206 CCC=CCCSC(C)CCCO m_7__22988038__8859716 [0,1,0,0,0,0|3,0,0]=4 756 B12R0.206 CCC=CCCSC(C)CCOC m_62__8859720__6956440 [0,1,0,0,0,0|3,0,0]=4 757 B12R0.206 CCC=CCCSC(Cl)CCCBr m_62__23915478__8859722 [0,1,0,0,0,0|3,0,0]=4 758 B12R0.206 CCC=CCNCC(O)CCOC m_273610__17312600__12549026 [0,1,0,0,0,0|3,0,0]=4 759 B12R0.206 CCC=CCNCC(O)COCC m_273610__17312600__11516306 [0,1,0,0,0,0|3,0,0]=4 760 B12R0.206 CCCCC(C)CNCCCCO m_270004__9433178__24715008 [0,1,0,0,0,0|1,0,2]=4 761 B12R0.206 CCCCC(C)NCCC#CCO m_269862__21537560__7200136 [0,1,0,0,0,0|1,0,2]=4 762 B12R0.206 CCCCC(C)NCCCCCO m_2230__22399858__6079162 [0,1,0,0,0,0|1,0,2]=4 763 B12R0.206 CCCCC(C)NCCOCCO m_2230__22399858__11974698 [0,1,0,0,0,0|2,0,1]=4 764 B12R0.206 CCCCC(C)NCCSCCO m_269862__21508856__7200136 [0,1,0,0,0,0|2,0,1]=4 765 B12R0.206 CCCCC(O)CSCCCCO m_7__22849690__15431214 [0,1,0,0,0,0|1,0,2]=4 766 B12R0.206 CCCCCCCC(=O)NCCO m_527__154483__336050 [0,1,0,0,0,0|1,0,2]=4 767 B12R0.206 CCCCCCCC(=O)OCCO m_1458__803706__485506 [0,1,0,0,0,0|1,0,2]=4 768 B12R0.206 CCCCCCCC(C)CNCC m_270004__8290976__24715004 [0,1,0,0,0,0|2,0,1]=4 769 B12R0.206 CCCCCCCC(C)NCCC m_270004__8288780__8844930 [0,1,0,0,0,0|2,0,1]=4 770 B12R0.206 CCCCCCCC(C)NCCO m_270004__8349608__8844930 [0,1,0,0,0,0|1,0,1]=3 771 B12R0.206 CCCCCCCN(C)CCCO m_2230__22407266__680950 [0,1,0,0,0,0|1,0,2]=4 772 B12R0.206 CCCCCCNC(=O)/C=C/CF m_11__51507__22137828 [0,1,0,0,0,0|2,0,1]=4 773 B12R0.206 CCCCCCNC(=O)/C=C/CN m_240690__7350946__16887350 [0,1,0,0,0,0|2,0,1]=4 774 B12R0.206 CCCCCCNC(=O)C=CCO m_22__303720__13570734 [0,1,0,0,0,0|1,0,1]=3 775 B12R0.206 CCCCCCNC(C)CCCO m_2230__22399382__5530588 [0,1,0,0,0,0|1,0,2]=4 776 B12R0.206 CCCCCCSC(C)CCCO m_7__22988038__846538 [0,1,0,0,0,0|1,0,2]=4 777 B12R0.206 CCCCCONC(=O)C=CCO m_22__23378550__13570734 [0,1,0,0,0,0|2,0,1]=4 778 B12R0.206 CCCCN(C)CCCCCCO m_2230__665312__13038782 [0,1,0,0,0,0|1,0,2]=4 779 B12R0.206 CCCNCCNC(=O)C=CCO m_240690__7788628__17667664 [0,1,0,0,0,0|2,0,1]=4 780 B12R0.206 CCCOCCNC(=O)C=CCO m_22__22618332__13570734 [0,1,0,0,0,0|2,0,1]=4 781 B12R0.206 CCNCCCNC(=O)C=CCO m_240690__7347390__17667664 [0,1,0,0,0,0|2,0,1]=4 782 B12R0.206 CCOCC(O)CNCC=CCO m_273610__13857830__11516306 [0,1,0,0,0,0|2,0,0]=3 783 B12R0.206 CCOCCCNC(=O)C=CCO m_22__58025__13570734 [0,1,0,0,0,0|2,0,1]=4 784 B12R0.206 CCSCCCNC(=O)C=CCO m_22__9819210__13570734 [0,1,0,0,0,0|2,0,1]=4 785 B12R0.206 CNCCCCNC(=O)C=CCO m_240690__21477368__17667664 [0,1,0,0,0,0|2,0,1]=4 786 B12R0.206 COCCC(O)CNCC=CCO m_273610__13857830__12549026 [0,1,0,0,0,0|2,0,0]=3 787 B12R0.206 COCCCCNC(=O)C=CCO m_22__773274__13570734 [0,1,0,0,0,0|2,0,1]=4 788 B12R0.206 CSCCCCNC(=O)C=CCO m_22__5136656__13570734 [0,1,0,0,0,0|2,0,1]=4 789 B12R0.206 NCCCCCNC(=O)C=CCO m_240690__21476792__17667664 [0,1,0,0,0,0|2,0,1]=4 790 B12R0.206 O=C(C=CCO)NCCCCCF m_22__15773382__13570734 [0,1,0,0,0,0|2,0,1]=4 791 B12R0.206 O=C(C=CCO)NCCCCCO m_22__9456936__13570734 [0,1,0,0,0,0|2,0,1]=4 792 B12R0.234 C=C(C)CCCSCCC=CCC m_62__13608160__8859722 [0,1,0,0,0,0|2,0,1]=4 793 B12R0.234 C=C(C)CCNCCC/C=C\CC m_270004__10740086__24594278 [0,1,0,0,0,0|2,0,1]=4 794 B12R0.234 C=CC=CCCNCCCC(C)C m_207__12896152__7912414 [0,1,0,0,0,0|2,0,1]=4 795 B12R0.234 C=CC=CCCSCCCC(C)C m_62__10892842__12907968 [0,1,0,0,0,0|2,0,1]=4 796 B12R0.234 CC(C)CCCCNCCCCO m_270004__9433178__12202092 [0,1,0,0,0,0|1,0,2]=4 797 B12R0.234 CC(C)CCCNCCC#CCO m_207__21537544__7912414 [0,1,0,0,0,0|1,0,2]=4 798 B12R0.234 CC(C)CCCNCCCCCO m_207__9456940__7912414 [0,1,0,0,0,0|1,0,2]=4 799 B12R0.234 CC(C)CCCNCCOCCO m_207__109688__7912414 [0,1,0,0,0,0|2,0,1]=4 800 B12R0.234 CC(C)CCCNCCSCCO m_207__21508840__7912414 [0,1,0,0,0,0|2,0,1]=4 801 B12R0.234 CC(C)CCCSCCCCCO m_7__8333108__6079158 [0,1,0,0,0,0|1,0,2]=4 802 B12R0.234 CC(C)CCCSCCOCCO m_62__10892842__8799516 [0,1,0,0,0,0|2,0,1]=4 803 B12R0.234 CC(C)CCNCCCCCCO m_207__8282998__134014 [0,1,0,0,0,0|1,0,2]=4 804 B12R0.234 CC(C)CCNCCCOCCO m_207__8602132__134014 [0,1,0,0,0,0|2,0,1]=4 805 B12R0.234 CC(C)CCSCCCCCCO m_7__22987856__6673274 [0,1,0,0,0,0|1,0,2]=4 806 B12R0.234 CC(C)CNCCCCCCCO m_207__13810894__121216 [0,1,0,0,0,0|1,0,2]=4 807 B12R0.234 CC(C)CNCCCCSCCO m_270004__23843874__8127718 [0,1,0,0,0,0|2,0,1]=4 808 B12R0.234 CC(C)COCCSCC=CCO m_7__22987970__16809272 [0,1,0,0,0,0|2,0,0]=3 809 B12R0.234 CC(C)CSCCCCCCCO m_7__27301__6174984 [0,1,0,0,0,0|1,0,2]=4 810 B12R0.234 CC(C)NCCCCCCCCO m_269862__21500832__7204804 [0,1,0,0,0,0|1,0,2]=4 811 B12R0.234 CC(N)CCSCCCCCCO m_34__20871470__7207104 [0,1,0,0,0,0|1,0,2]=4 812 B12R0.234 CC(O)CNCCCCCCCO m_273610__13810926__11516404 [0,1,0,0,0,0|1,0,2]=4 813 B12R0.234 CC(O)CSCCCCCCCO m_7__10953796__6174984 [0,1,0,0,0,0|1,0,2]=4 814 B12R0.234 CC/C=C\CCCCCNC(C)C m_270004__23845338__24594274 [0,1,0,0,0,0|2,0,0]=3 815 B12R0.234 CC/C=C\CCCNCCC(C)C m_270004__8288586__24594278 [0,1,0,0,0,0|2,0,0]=3 816 B12R0.234 CC/C=C\CCCNCCC(C)F m_270004__10546066__24594278 [0,1,0,0,0,0|2,0,0]=3 817 B12R0.234 CC/C=C\CCCNCCC(C)O m_270004__8296476__24594278 [0,1,0,0,0,0|2,0,0]=3 818 B12R0.234 CC/C=C\CCCNCCC(Cl)Cl m_270004__23845876__24594278 [0,1,0,0,0,0|3,0,0]=4 819 B12R0.234 CC/C=C\CCCNCCC(F)F m_270004__13943058__24594278 [0,1,0,0,0,0|3,0,0]=4 820 B12R0.234 CC/C=C\CCCNCCN(C)C m_270004__9143630__24594278 [0,1,0,0,0,0|3,0,0]=4 821 B12R0.234 CC/C=C\CCCNCCS(=O)C m_270004__8296826__24594278 [0,1,0,0,0,0|3,0,0]=4 822 B12R0.234 CCC=CCCSCCCC(C)C m_62__10892842__8859722 [0,1,0,0,0,0|2,0,0]=3 823 B12R0.234 CCC=CCCSCCCC(Cl)Cl m_62__8859720__23915480 [0,1,0,0,0,0|3,0,0]=4 824 B12R0.234 CCC=CCCSCCCC(F)F m_62__8859720__18239798 [0,1,0,0,0,0|3,0,0]=4 825 B12R0.234 CCC=CCCSCCCN(C)C m_7__15765946__8859716 [0,1,0,0,0,0|3,0,0]=4 826 B12R0.234 CCC=CCCSCCOC(C)C m_62__3569224__8859722 [0,1,0,0,0,0|3,0,0]=4 827 B12R0.234 CCC=CCCSCCSC(C)C m_62__8859720__10158466 [0,1,0,0,0,0|3,0,0]=4 828 B12R0.234 CCCCCCCCCNC(C)C m_270004__23845338__24715050 [0,1,0,0,0,0|2,0,1]=4 829 B12R0.234 CCCCCCCCCSC(C)C m_62__2390328__9282134 [0,1,0,0,0,0|2,0,1]=4 830 B12R0.234 CCCCCCCCNCC(C)C m_207__121544__121216 [0,1,0,0,0,0|2,0,1]=4 831 B12R0.234 CCCCCCCCNCC(C)O m_273610__11525810__11516404 [0,1,0,0,0,0|1,0,1]=3 832 B12R0.234 CCCCCCCCSCC(=O)O m_7__26823__9282116 [0,1,0,0,0,0|1,0,2]=4 833 B12R0.234 CCCCCCCCSCC(C)C m_62__1010136__9282118 [0,1,0,0,0,0|2,0,1]=4 834 B12R0.234 CCCCCCCCSCC(C)O m_7__10953796__9282116 [0,1,0,0,0,0|1,0,1]=3 835 B12R0.234 CCCCCCCCSCC(F)F m_7__22987700__9282116 [0,1,0,0,0,0|2,0,1]=4 836 B12R0.234 CCCCCCCCSC[C@H](C)N m_7__20871336__9282116 [0,1,0,0,0,0|2,0,1]=4 837 B12R0.234 CCCCCCCNCCC(C)O m_270004__8296476__24715022 [0,1,0,0,0,0|1,0,2]=4 838 B12R0.234 CCCCCCCON=CC(C)C m_34__19446766__7284630 [0,1,0,0,0,0|3,0,0]=4 839 B12R0.234 CCCCCCCSCCC(C)O m_62__12057938__7284636 [0,1,0,0,0,0|1,0,2]=4 840 B12R0.234 CCCCCCNCCCC(C)O m_270004__9448698__24715030 [0,1,0,0,0,0|1,0,2]=4 841 B12R0.234 CCCCCSCCSCC(C)O m_7__10953796__15748360 [0,1,0,0,0,0|2,0,1]=4 842 B12R0.234 CCCCOCCCNCC(C)O m_273610__11516522__11516404 [0,1,0,0,0,0|2,0,1]=4 843 B12R0.234 COCCCCCCNCC(C)O m_273610__21497424__11516404 [0,1,0,0,0,0|2,0,1]=4 844 B12R0.234 COCCCCCCSCC(C)O m_7__22987398__10902704 [0,1,0,0,0,0|2,0,1]=4 845 B12R0.234 CSCCCCCCNCC(C)O m_273610__11526772__11516404 [0,1,0,0,0,0|2,0,1]=4 846 B12R0.234 C[C@H](N)CSCCCCCCCO m_7__20871336__6174984 [0,1,0,0,0,0|1,0,2]=4 847 B12R0.234 NC(=O)C=CCCCCCCCO m_22__58357__14316676 [0,1,0,0,0,0|1,0,2]=4 848 B12R0.234 O=C(O)CCCCNCC=CCO m_273456__11977376__23171790 [0,1,0,0,0,0|2,0,1]=4 849 B12R0.234 OCC=CCSCCOCC(F)F m_7__15747626__16809272 [0,1,0,0,0,0|3,0,0]=4 850 B12R0.248 C#CCCCCCCNC(=O)CO m_22__20612888__7941800 [0,1,0,0,0,0|1,0,2]=4 851 B12R0.248 C=C(CC)CSCCCCCCC m_62__8265146__7284636 [0,1,0,0,0,0|2,0,1]=4 852 B12R0.248 C=C(CO)CCNCCCCCC m_270004__17763614__24715030 [0,1,0,0,0,0|1,0,1]=3 853 B12R0.248 C=C(CO)CCNCCCCCCl m_270004__17763614__24721510 [0,1,0,0,0,0|2,0,1]=4 854 B12R0.248 C=C(CO)CSCCCCCOC m_7__22987588__15422654 [0,1,0,0,0,0|2,0,1]=4 855 B12R0.248 C=C(CO)CSCCCCOCC m_7__22987402__15422654 [0,1,0,0,0,0|2,0,1]=4 856 B12R0.248 C=C(CO)CSCCOCCCC m_7__22987848__15422654 [0,1,0,0,0,0|2,0,1]=4 857 B12R0.248 C=CC=CCCSCCC(C)CC m_62__20058276__12907968 [0,1,0,0,0,0|2,0,1]=4 858 B12R0.248 C=CC=CCCSCCC(O)CC m_62__16640708__12907968 [0,1,0,0,0,0|2,0,1]=4 859 B12R0.248 C=CCCCCCCNC(=O)CO m_22__10176040__7941800 [0,1,0,0,0,0|1,0,2]=4 860 B12R0.248 CC(CO)NCCCCCCCO m_269862__13810920__15157990 [0,1,0,0,0,0|2,0,1]=4 861 B12R0.248 CC(CO)SCCCCCCCO m_7__6338928__6174984 [0,1,0,0,0,0|2,0,1]=4 862 B12R0.248 CC/C=C\CCCNCC(C)CC 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950 B12R0.248 O=C(CO)NCCCOCCCO m_22__16500748__7941800 [0,1,0,0,0,0|3,0,0]=4 951 B12R0.248 O=C(CO)NCCNCCCCCl m_270004__24793754__24721168 [0,1,0,0,0,0|3,0,0]=4 952 B12R1.8 C=CC=CCCN1CCCCC1 m_2230__679042__12907972 [0,0,0,1,0,0|2,0,1]=4 953 B12R1.8 CCC=CCCN1CCCCC1 m_2230__679042__8859726 [0,0,0,1,0,0|2,0,0]=3 954 B12R1.8 CCC=CCCN1CCOCC1 m_2230__665308__8859726 [0,0,0,1,0,0|3,0,0]=4 955 B12R1.8 CCC=CCCN1CCSCC1 m_2230__848268__8859726 [0,0,0,1,0,0|3,0,0]=4 956 B12R1.8 CCC=CCNC1CCCCC1 m_207__17312546__121598 [0,0,0,1,0,0|2,0,0]=3 957 B12R1.8 CCC=CCNC1CCCSC1 m_207__17312546__9295358 [0,0,0,1,0,0|3,0,0]=4 958 B12R1.8 CCC=CCNC1CCOCC1 m_207__17312546__5624874 [0,0,0,1,0,0|3,0,0]=4 959 B12R1.8 CCC=CCNC1CCSCC1 m_207__17312546__121623 [0,0,0,1,0,0|3,0,0]=4 960 B12R1.8 CCC=NOCC1CCCCC1 m_34__17309904__8627264 [0,0,0,1,0,0|3,0,0]=4 961 B12R1.8 CCCCCCC1CNCCN1 m_269982__23917336__7393364 [0,0,0,1,0,0|2,0,1]=4 962 B12R1.8 CCCCCCN1CC=CCC1 m_2230__8375936__5530588 [0,0,0,1,0,0|2,0,0]=3 963 B12R1.8 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m_270004__8160850__9315710 [0,0,0,1,0,0|2,0,1]=4 977 B12R1.8 CCNCCCC1CCCCO1 m_270004__8767300__24715004 [0,0,0,1,0,0|1,0,2]=4 978 B12R1.8 CCOCCCN1CC=CCC1 m_2230__8375936__5730886 [0,0,0,1,0,0|3,0,0]=4 979 B12R1.8 CCSCCCC1CCCCC1 m_62__875846__13430106 [0,0,0,1,0,0|2,0,1]=4 980 B12R1.8 CCSCCCN1CC=CCC1 m_2230__8375936__6165712 [0,0,0,1,0,0|3,0,0]=4 981 B12R1.8 CCSCCNC1CC=CCC1 m_270004__8296840__8765926 [0,0,0,1,0,0|3,0,0]=4 982 B12R1.8 CNCCSC[C@@H]1CC=CCC1 m_7__22986920__23045116 [0,0,0,1,0,0|3,0,0]=4 983 B12R1.8 COCCCCN1CC=CCC1 m_2230__8375936__5062388 [0,0,0,1,0,0|3,0,0]=4 984 B12R1.8 COCCCNC1CC=CCC1 m_270004__8296840__24710510 [0,0,0,1,0,0|3,0,0]=4 985 B12R1.8 COCCNCC1CC=CCC1 m_207__109486__121213 [0,0,0,1,0,0|3,0,0]=4 986 B12R1.8 COCCSC[C@@H]1CC=CCC1 m_62__524272__23045122 [0,0,0,1,0,0|3,0,0]=4 987 B12R1.8 CON=CCCC1CCCCC1 m_4__461206__9316218 [0,0,0,1,0,0|3,0,0]=4 988 B12R1.8 CSCCNCC1CC=CCC1 m_207__11946676__121213 [0,0,0,1,0,0|3,0,0]=4 989 B12R1.8 CSCCSC[C@@H]1CC=CCC1 m_62__23045120__8268572 [0,0,0,1,0,0|3,0,0]=4 990 B12R1.8 ClCCCCCN1CC=CCC1 m_270004__8375948__24721510 [0,0,0,1,0,0|3,0,0]=4 991 B12R1.8 ClCCCCNC1CC=CCC1 m_270004__8296840__24721168 [0,0,0,1,0,0|3,0,0]=4 992 B12R1.8 FCCCCCN1CC=CCC1 m_2230__8375936__9984638 [0,0,0,1,0,0|3,0,0]=4 993 B12R1.8 FCCCNCC1CC=CCC1 m_207__17065564__121213 [0,0,0,1,0,0|3,0,0]=4 994 B12R1.8 FCCSCCC1CCCCC1 m_7__17644380__22320828 [0,0,0,1,0,0|2,0,1]=4 995 B12R1.8 N#CC=CCSC1CCCCC1 m_7__27197__7140602 [0,0,0,1,0,0|2,0,1]=4 996 B12R1.8 N#CCCNCC1CC=CCO1 m_273610__14050690__11515974 [0,0,0,1,0,0|2,0,1]=4 997 B12R1.8 NC/C=C/CCC1CNCCN1 m_269982__23917336__22485940 [0,0,0,1,0,0|3,0,0]=4 998 B12R1.8 NC/C=C\CNC1CCCCC1 m_272690__21478164__11345972 [0,0,0,1,0,0|2,0,0]=3 999 B12R1.8 NC/C=C\CNC1CCCSC1 m_272690__21478164__11347636 [0,0,0,1,0,0|3,0,0]=4 1000 B12R1.8 NC/C=C\CNC1CCSCC1 m_272690__21478164__11346338 [0,0,0,1,0,0|3,0,0]=4 1001 B12R1.8 NCCCCCN1CC=CCC1 m_269982__22517040__22485950 [0,0,0,1,0,0|3,0,0]=4 1002 B12R1.8 NCCCSC[C@@H]1CC=CCC1 m_7__20871288__23045116 [0,0,0,1,0,0|3,0,0]=4 1003 B12R1.8 NCCSCCC1CCCCC1 m_7__20871276__21208850 [0,0,0,1,0,0|2,0,1]=4 1004 B12R1.8 OCC#CCSC1CCCCC1 m_7__27197__15141006 [0,0,0,1,0,0|1,0,2]=4 1005 B12R1.8 OCC=CCCC1CNCCN1 m_269982__23917336__16809282 [0,0,0,1,0,0|2,0,0]=3 1006 B12R1.8 OCC=CCNC1CCCCC1 m_270004__11971554__8157310 [0,0,0,1,0,0|1,0,0]=2 1007 B12R1.8 OCC=CCNC1CCCOC1 m_270004__11971554__8157396 [0,0,0,1,0,0|2,0,0]=3 1008 B12R1.8 OCC=CCNC1CCCSC1 m_270004__11971554__8157390 [0,0,0,1,0,0|2,0,0]=3 1009 B12R1.8 OCC=CCNC1CCOCC1 m_270004__11971554__7676532 [0,0,0,1,0,0|2,0,0]=3 1010 B12R1.8 OCC=CCNC1CCSCC1 m_270004__11971554__8157340 [0,0,0,1,0,0|2,0,0]=3 1011 B12R1.8 OCC=CCNC1CSCSC1 m_270004__11971554__17507836 [0,0,0,1,0,0|3,0,0]=4 1012 B12R1.8 OCC=CCSC1CCCCC1 m_7__27197__16809272 [0,0,0,1,0,0|1,0,0]=2 1013 B12R1.8 OCC=CCSC1CCCNC1 m_7__22871154__16809272 [0,0,0,1,0,0|2,0,0]=3 1014 B12R1.8 OCC=CCSC1CCCOC1 m_7__8601826__16809272 [0,0,0,1,0,0|2,0,0]=3 1015 B12R1.8 OCC=CCSC1CCNCC1 m_7__22986816__16809272 [0,0,0,1,0,0|2,0,0]=3 1016 B12R1.8 OCC=CCSC1CCOCC1 m_7__7834816__16809272 [0,0,0,1,0,0|2,0,0]=3 1017 B12R1.8 OCC=CCSC1CCSCC1 m_7__15266834__16809272 [0,0,0,1,0,0|2,0,0]=3 1018 B12R1.8 OCCCCCN1CC=CCC1 m_2230__8375936__6079162 [0,0,0,1,0,0|3,0,0]=4 1019 B12R1.8 OCCCCCN1CCCCC1 m_2230__679042__6079162 [0,0,0,1,0,0|1,0,2]=4 1020 B12R1.8 OCCCCNC1CCCCC1 m_207__9433150__121598 [0,0,0,1,0,0|1,0,2]=4 1021 B12R1.8 OCCCCSC1CCCCC1 m_7__27197__3191338 [0,0,0,1,0,0|1,0,2]=4 1022 B12R1.8 OCCCNCC1CC=CCC1 m_207__109475__121213 [0,0,0,1,0,0|3,0,0]=4 1023 B12R1.8 OCCCNCC1CCCCC1 m_207__109475__121242 [0,0,0,1,0,0|1,0,2]=4 1024 B12R1.8 OCCCSCC1CCCCC1 m_7__2303152__6354 [0,0,0,1,0,0|1,0,2]=4 1025 B12R1.8 OCCCSC[C@@H]1CC=CCC1 m_7__10972294__23045116 [0,0,0,1,0,0|3,0,0]=4 1026 B12R1.8 OCCNCCC1CCCCC1 m_270004__8349608__9139688 [0,0,0,1,0,0|1,0,1]=3 1027 B12R1.8 OCCNCCC1CCCCO1 m_270004__8349608__17567356 [0,0,0,1,0,0|2,0,1]=4 1028 B12R1.8 OCCNCCC1CCCOC1 m_270004__8349608__11841900 [0,0,0,1,0,0|2,0,1]=4 1029 B12R1.8 OCCNCCC1CCOCC1 m_270004__8349608__9224548 [0,0,0,1,0,0|2,0,1]=4 1030 B12R1.8 OCCOCCN1CCCCC1 m_2230__679042__11974698 [0,0,0,1,0,0|2,0,1]=4 1031 B12R1.8 OCCSCCC1CCCCC1 m_7__17644380__102708 [0,0,0,1,0,0|1,0,1]=3 1032 B12R1.8 OCCSCCC1CCCCO1 m_62__11985414__10178562 [0,0,0,1,0,0|2,0,1]=4 1033 B12R1.8 OCCSCCC1CCCOC1 m_7__22987544__102708 [0,0,0,1,0,0|2,0,1]=4 1034 B12R1.8 OCCSCCC1CCOCC1 m_7__22988094__102708 [0,0,0,1,0,0|2,0,1]=4 1035 B12R1.8 OCCSCCN1CCCCC1 m_7__14468168__102708 [0,0,0,1,0,0|2,0,1]=4 1036 B12R1.8 OCCSCOC1CCCCC1 m_7__128807__12420498 [0,0,0,1,0,0|2,0,1]=4 1037 B12R1.18 CC1CCCCCC1NCCF m_2230__8960872__22320836 [0,0,0,1,0,0|2,0,1]=4 1038 B12R1.18 CC1CCCCCC1NCCO m_2230__8960872__6165700 [0,0,0,1,0,0|1,0,1]=3 1039 B12R1.18 CC1CCCCCN1CCCO m_2230__9017564__680950 [0,0,0,1,0,0|1,0,2]=4 1040 B12R1.18 CC1CCOCCC1NCCO m_270004__8349608__24722378 [0,0,0,1,0,0|2,0,1]=4 1041 B12R1.18 CCCNC1CCCCCC1C m_2230__8960872__13271112 [0,0,0,1,0,0|2,0,1]=4 1042 B12R1.18 OCCNC1CCCCCC1F m_269862__7193048__16603906 [0,0,0,1,0,0|2,0,1]=4 1043 B12R1.37 C=CC=CCCNC1CCCC1 m_207__12896152__121596 [0,0,0,1,0,0|2,0,1]=4 1044 B12R1.37 C=CC=CCCSC1CCCC1 m_62__12907966__10178584 [0,0,0,1,0,0|2,0,1]=4 1045 B12R1.37 CC/C=C\CCCN1CCCC1 m_270004__8127936__24594278 [0,0,0,1,0,0|2,0,0]=3 1046 B12R1.37 CCC=CCCSC1CCCC1 m_62__8859720__10178584 [0,0,0,1,0,0|2,0,0]=3 1047 B12R1.37 CCC=CCCSC1CCOC1 m_62__8859720__10903820 [0,0,0,1,0,0|3,0,0]=4 1048 B12R1.37 CCC=CCCSC1CCSC1 m_7__15266840__8859716 [0,0,0,1,0,0|3,0,0]=4 1049 B12R1.37 CCC=CCCS[C@H]1CCNC1 m_7__22987620__8859716 [0,0,0,1,0,0|3,0,0]=4 1050 B12R1.37 CCC=CCNCC1CCSC1 m_207__17312546__9438738 [0,0,0,1,0,0|3,0,0]=4 1051 B12R1.37 CCC=NOCCC1CCCC1 m_34__17309904__9139756 [0,0,0,1,0,0|3,0,0]=4 1052 B12R1.37 CCCCCCCN1C=CC=N1 m_34__5127994__7284630 [0,0,0,1,0,0|2,0,1]=4 1053 B12R1.37 CCCCCCCN1C=CN=C1 m_34__15541202__7284630 [0,0,0,1,0,0|3,0,0]=4 1054 B12R1.37 CCCCCCCN1C=CN=N1 m_34__1952206__7284630 [0,0,0,1,0,0|3,0,0]=4 1055 B12R1.37 CCCCCCN[C@H]1C=CCC1 m_270004__24793796__24715030 [0,0,0,1,0,0|2,0,0]=3 1056 B12R1.37 CCCCCNCC1=CC=CO1 m_207__109488__121207 [0,0,0,1,0,0|1,0,2]=4 1057 B12R1.37 CCCCCSCC1=CC=CO1 m_7__26781__5063386 [0,0,0,1,0,0|1,0,2]=4 1058 B12R1.37 CCCCCSCC1=CC=NO1 m_62__5063390__320426 [0,0,0,1,0,0|2,0,1]=4 1059 B12R1.37 CCCCCSCC1C=CCC1 m_62__5063390__14322920 [0,0,0,1,0,0|2,0,0]=3 1060 B12R1.37 CCCCCSCC1CCCO1 m_62__5063390__9419582 [0,0,0,1,0,0|1,0,2]=4 1061 B12R1.37 CCCCCSCC1OCCO1 m_7__8271838__5357046 [0,0,0,1,0,0|2,0,1]=4 1062 B12R1.37 CCCCNCCC1=CC=CO1 m_270004__8289202__24721640 [0,0,0,1,0,0|1,0,2]=4 1063 B12R1.37 CCCCNCCC1C=CCC1 m_270004__8289202__24714984 [0,0,0,1,0,0|2,0,0]=3 1064 B12R1.37 CCCCNCCC1CCCO1 m_270004__8289202__24594190 [0,0,0,1,0,0|1,0,2]=4 1065 B12R1.37 CCCCSCCC1=CC=CO1 m_7__22986766__770176 [0,0,0,1,0,0|1,0,2]=4 1066 B12R1.37 CCCCSCCC1CCCO1 m_7__22987628__770176 [0,0,0,1,0,0|1,0,2]=4 1067 B12R1.37 CCCNCCCC1=CC=CO1 m_270004__8288780__24714988 [0,0,0,1,0,0|1,0,2]=4 1068 B12R1.37 CCCNCCCC1CCCC1 m_270004__8288780__14924996 [0,0,0,1,0,0|2,0,1]=4 1069 B12R1.37 CCCSCCCC1CCCC1 m_62__875778__15113694 [0,0,0,1,0,0|2,0,1]=4 1070 B12R1.37 CCNCCCCC1CCCC1 m_270004__8297360__24715004 [0,0,0,1,0,0|2,0,1]=4 1071 B12R1.37 CCNCCSCC1C=CCC1 m_7__22986872__14322912 [0,0,0,1,0,0|3,0,0]=4 1072 B12R1.37 CCOCCSCC1C=CCC1 m_62__204255__14322920 [0,0,0,1,0,0|3,0,0]=4 1073 B12R1.37 CCSCCNCC1C=CCC1 m_270004__12894044__8765926 [0,0,0,1,0,0|3,0,0]=4 1074 B12R1.37 CCSCCSCC1C=CCC1 m_7__8765656__14322912 [0,0,0,1,0,0|3,0,0]=4 1075 B12R1.37 COCCCNCC1C=CCC1 m_270004__12894044__24710510 [0,0,0,1,0,0|3,0,0]=4 1076 B12R1.37 COCCCSCC1C=CCC1 m_62__9108898__14322920 [0,0,0,1,0,0|3,0,0]=4 1077 B12R1.37 COCCNCCC1C=CCC1 m_270004__8288600__24714984 [0,0,0,1,0,0|3,0,0]=4 1078 B12R1.37 CSCCCCCC1OCCO1 m_62__875850__15357132 [0,0,0,1,0,0|2,0,1]=4 1079 B12R1.37 CSCCCSCC1C=CCC1 m_7__10890048__14322912 [0,0,0,1,0,0|3,0,0]=4 1080 B12R1.37 CSCCNCCC1C=CCC1 m_270004__11963796__24714984 [0,0,0,1,0,0|3,0,0]=4 1081 B12R1.37 ClCCCCCN[C@H]1C=CCC1 m_270004__24793796__24721510 [0,0,0,1,0,0|3,0,0]=4 1082 B12R1.37 ClCCCCNCC1C=CCC1 m_270004__12894044__24721168 [0,0,0,1,0,0|3,0,0]=4 1083 B12R1.37 FCCCCSCC1C=CCC1 m_62__10157914__14322920 [0,0,0,1,0,0|3,0,0]=4 1084 B12R1.37 FCCCNCCC1C=CCC1 m_270004__17065596__24714984 [0,0,0,1,0,0|3,0,0]=4 1085 B12R1.37 FCCSCCCC1CCCC1 m_7__22987426__22320828 [0,0,0,1,0,0|2,0,1]=4 1086 B12R1.37 NCCCCSCC1C=CCC1 m_34__20871448__14322914 [0,0,0,1,0,0|3,0,0]=4 1087 B12R1.37 NCCSCCCC1CCCC1 m_7__20871276__15113686 [0,0,0,1,0,0|2,0,1]=4 1088 B12R1.37 OCC#CCCNC1CCCC1 m_207__21537544__121596 [0,0,0,1,0,0|1,0,2]=4 1089 B12R1.37 OCC#CCSCC1CCCC1 m_62__8766436__15141012 [0,0,0,1,0,0|1,0,2]=4 1090 B12R1.37 OCC=CCNCC1CCSC1 m_207__11971532__9438738 [0,0,0,1,0,0|2,0,0]=3 1091 B12R1.37 OCC=CCSCC1=CCCC1 m_7__22988114__16809272 [0,0,0,1,0,0|1,0,2]=4 1092 B12R1.37 OCC=CCSCC1CCCN1 m_7__22987948__16809272 [0,0,0,1,0,0|2,0,0]=3 1093 B12R1.37 OCC=CCSCC1CCOC1 m_7__13778716__16809272 [0,0,0,1,0,0|2,0,0]=3 1094 B12R1.37 OCC=CCSCC1OCCO1 m_7__22987978__16809272 [0,0,0,1,0,0|3,0,0]=4 1095 B12R1.37 OCCCCCCN1CCCC1 m_2230__678722__13038782 [0,0,0,1,0,0|1,0,2]=4 1096 B12R1.37 OCCCCCNC1CCCC1 m_207__9456940__121596 [0,0,0,1,0,0|1,0,2]=4 1097 B12R1.37 OCCCCCSC1CCCC1 m_7__27260__6079158 [0,0,0,1,0,0|1,0,2]=4 1098 B12R1.37 OCCCCNCC1CCCC1 m_270004__9433178__8300536 [0,0,0,1,0,0|1,0,2]=4 1099 B12R1.37 OCCCCSCC1C=CCC1 m_7__22849690__14322912 [0,0,0,1,0,0|3,0,0]=4 1100 B12R1.37 OCCCCSCC1CCCC1 m_7__22849690__783024 [0,0,0,1,0,0|1,0,2]=4 1101 B12R1.37 OCCCNCCC1C=CCC1 m_270004__8288584__24714984 [0,0,0,1,0,0|3,0,0]=4 1102 B12R1.37 OCCCSCCC1CCCC1 m_7__22987540__6354 [0,0,0,1,0,0|1,0,2]=4 1103 B12R1.37 OCCNCCCC1CCCC1 m_270004__8349608__14924996 [0,0,0,1,0,0|1,0,1]=3 1104 B12R1.37 OCCOCCNC1CCCC1 m_207__109688__121596 [0,0,0,1,0,0|2,0,1]=4 1105 B12R1.37 OCCOCCSC1CCCC1 m_62__8799514__10178584 [0,0,0,1,0,0|2,0,1]=4 1106 B12R1.37 OCCSCCCC1CCCC1 m_7__22987426__102708 [0,0,0,1,0,0|1,0,1]=3 1107 B12R1.37 OCCSCCCC1CCOC1 m_62__11570550__10178562 [0,0,0,1,0,0|2,0,1]=4 1108 B12R1.37 OCCSCCCN1CCCC1 m_7__128807__20990278 [0,0,0,1,0,0|2,0,1]=4 1109 B12R1.37 OCCSCCNC1CCCC1 m_207__21508840__121596 [0,0,0,1,0,0|2,0,1]=4 1110 B12R1.37 OCCSCCOC1CCCC1 m_7__128807__9402884 [0,0,0,1,0,0|2,0,1]=4 1111 B12R1.45 C#CC1CCCN1CC=CCO m_2230__13460984__16809276 [0,0,0,1,0,0|1,0,2]=4 1112 B12R1.45 C=CC1CCCN1CC=CCO m_2230__22409578__16809276 [0,0,0,1,0,0|1,0,2]=4 1113 B12R1.45 CCC1CC=NN1CC=CCO m_2230__22595176__16809276 [0,0,0,1,0,0|2,0,1]=4 1114 B12R1.45 CCC1CCCC1NCCCO m_2230__9296238__680950 [0,0,0,1,0,0|1,0,2]=4 1115 B12R1.45 CCC1CCCN1CC#CCO m_2230__4599928__15141016 [0,0,0,1,0,0|1,0,2]=4 1116 B12R1.45 CCC1CCCN1CC=CC#N m_2230__4599928__16945818 [0,0,0,1,0,0|2,0,1]=4 1117 B12R1.45 CCC1CCCN1CC=CCO m_2230__4599928__16809276 [0,0,0,1,0,0|1,0,0]=2 1118 B12R1.45 CCC1CCCN1CCCCO m_2230__4599928__3191342 [0,0,0,1,0,0|1,0,2]=4 1119 B12R1.45 CCCCCN1CC=CC1CO m_2230__12911330__5063396 [0,0,0,1,0,0|1,0,2]=4 1120 B12R1.45 CCCCCN1CCCC1CO m_2230__3379024__5063396 [0,0,0,1,0,0|1,0,2]=4 1121 B12R1.45 CCCCN[C@@H]1CCC[C@H]1CO m_2230__22399992__22993830 [0,0,0,1,0,0|1,0,2]=4 1122 B12R1.45 CCCCN[C@H]1CCC[C@H]1CO m_2230__22399092__22993830 [0,0,0,1,0,0|1,0,2]=4 1123 B12R1.45 OCC=CCN1CCCC1CO m_2230__3379024__16809276 [0,0,0,1,0,0|2,0,0]=3 1124 B12R1.45 OCC=CCN1CCC[C@H]1CF m_2230__17313732__16809276 [0,0,0,1,0,0|2,0,0]=3 1125 B12R1.52 CC1CCCCCCN1CCF m_2230__16908182__22320836 [0,0,0,1,0,0|2,0,1]=4 1126 B12R1.52 CC1CCCCCCN1CCO m_2230__16908182__6165700 [0,0,0,1,0,0|1,0,1]=3 1127 B12R1.52 CCCN1CCCCCCC1C m_2230__16908182__13271112 [0,0,0,1,0,0|2,0,1]=4 1128 B12R1.52 CCN[C@@H]1CCCCCC[C@H]1O m_270004__23854968__24715004 [0,0,0,1,0,0|1,0,2]=4 1129 B12R1.52 CCSC1CCCCCCC1O m_7__22987770__23815120 [0,0,0,1,0,0|1,0,2]=4 1130 B12R1.121 CCC1CCCCC1C=NOC m_4__461206__11560886 [0,0,0,1,0,0|3,0,0]=4 1131 B12R1.121 CCC1CCCCC1NCCF m_269862__9706110__8583362 [0,0,0,1,0,0|2,0,1]=4 1132 B12R1.121 CCC1CCCCC1NCCO m_269862__7193048__8583362 [0,0,0,1,0,0|1,0,1]=3 1133 B12R1.121 CCC1CCCCN1CCCO m_2230__1722000__680950 [0,0,0,1,0,0|1,0,2]=4 1134 B12R1.121 CCC1CCOCC1NCCO m_269862__7193048__14243584 [0,0,0,1,0,0|2,0,1]=4 1135 B12R1.121 CCC1COCCC1NCCO m_269862__7193048__12888726 [0,0,0,1,0,0|2,0,1]=4 1136 B12R1.121 CCCCN1CCC=CC1CO m_2230__18367858__22993830 [0,0,0,1,0,0|1,0,2]=4 1137 B12R1.121 CCCCN1CCCCC1CO m_2230__804372__22993830 [0,0,0,1,0,0|1,0,2]=4 1138 B12R1.121 CCCNC1CCCCC1CC m_2230__8960854__13271112 [0,0,0,1,0,0|2,0,1]=4 1139 B12R1.121 CCCN[C@@H]1CCCC[C@H]1CO m_2230__9438960__13271112 [0,0,0,1,0,0|1,0,2]=4 1140 B12R1.121 CCN1CCCCC1CCCO m_270004__24176602__24715004 [0,0,0,1,0,0|1,0,2]=4 1141 B12R1.121 CCNCC1CCCCC1CC m_270004__10686296__24715004 [0,0,0,1,0,0|2,0,1]=4 1142 B12R1.121 CNC1CCCCC1CCCO m_269862__7193148__10427888 [0,0,0,1,0,0|1,0,2]=4 1143 B12R1.121 COC1CCCCC1NCCO m_269862__7193048__10150290 [0,0,0,1,0,0|2,0,1]=4 1144 B12R1.121 CO[C@@H]1CCCC[C@H]1NCCO m_2230__11685560__6165700 [0,0,0,1,0,0|2,0,1]=4 1145 B12R1.121 CO[C@H]1CCCC[C@H]1SCCO m_7__128807__15344178 [0,0,0,1,0,0|2,0,1]=4 1146 B12R1.121 CSC1CCCCC1NCCO m_269862__7193048__7200708 [0,0,0,1,0,0|2,0,1]=4 1147 B12R1.121 NCC1CCCCC1NCCO m_269982__22505494__10880280 [0,0,0,1,0,0|2,0,1]=4 1148 B12R1.121 NC[C@H]1CCCC[C@H]1NCCO m_269982__17754838__10880280 [0,0,0,1,0,0|2,0,1]=4 1149 B12R1.121 OCCCC1CCCCC1=NO m_4__388124__10543686 [0,0,0,1,0,0|2,0,1]=4 1150 B12R1.121 OCCN[C@@H]1CCCC[C@H]1CO m_2230__9438960__6165700 [0,0,0,1,0,0|2,0,1]=4 1151 B12R1.169 CCCC1CCCCC1=NOC m_4__461206__11571974 [0,0,0,1,0,0|3,0,0]=4 1152 B12R1.169 CCCC1CCCCC1NCC m_2230__8960858__22383854 [0,0,0,1,0,0|2,0,1]=4 1153 B12R1.169 CCCC1CCCCN1CCC m_2230__8750840__13271112 [0,0,0,1,0,0|2,0,1]=4 1154 B12R1.169 CCCC1CCCCN1CCF m_2230__8750840__22320836 [0,0,0,1,0,0|2,0,1]=4 1155 B12R1.169 CCCC1CCCCN1CCO m_2230__8750840__6165700 [0,0,0,1,0,0|1,0,1]=3 1156 B12R1.169 CCCC1CNCCN1CCO m_269982__8629380__10880280 [0,0,0,1,0,0|2,0,1]=4 1157 B12R1.169 CCCC1COCCN1CCO m_2230__22409452__6165700 [0,0,0,1,0,0|2,0,1]=4 1158 B12R1.169 CCCN1CCCCC1CCO m_2230__3225030__13271112 [0,0,0,1,0,0|1,0,2]=4 1159 B12R1.169 CCN[C@H]1CCCC[C@H]1CCO m_2230__13770344__22383854 [0,0,0,1,0,0|1,0,2]=4 1160 B12R1.169 CNC[C@H]1CCCCN1CCO m_269982__12901168__10880280 [0,0,0,1,0,0|2,0,1]=4 1161 B12R1.169 COCC1CCCCN1CCO m_2230__10860868__6165700 [0,0,0,1,0,0|2,0,1]=4 1162 B12R1.169 NCC[C@H]1CCCCN1CCO m_269982__23163878__10880280 [0,0,0,1,0,0|2,0,1]=4 1163 B12R1.169 OCCC1CCCCN1CCO m_2230__3225030__6165700 [0,0,0,1,0,0|2,0,1]=4 1164 B12R1.173 CCCN1CCCCCCCC1 m_2230__10808630__13271112 [0,0,0,1,0,0|2,0,1]=4 1165 B12R1.173 CCNC1CCCCCCCC1 m_269862__7865270__16640202 [0,0,0,1,0,0|2,0,1]=4 1166 B12R1.173 CON=C1CCCCCCCC1 m_4__461206__16640196 [0,0,0,1,0,0|3,0,0]=4 1167 B12R1.173 FCCN1CCCCCCCC1 m_2230__10808630__22320836 [0,0,0,1,0,0|2,0,1]=4 1168 B12R1.173 NCCN1CCCCCCCC1 m_269982__15344188__14439794 [0,0,0,1,0,0|2,0,1]=4 1169 B12R1.173 OCCN1CCCCCCCC1 m_2230__10808630__6165700 [0,0,0,1,0,0|1,0,1]=3 1170 B12R1.267 CC1CCCCC1CSCCN m_7__20871276__11946492 [0,0,0,1,0,0|2,0,1]=4 1171 B12R1.267 CC1CCCCC1CSCCO m_62__11946498__10178562 [0,0,0,1,0,0|1,0,1]=3 1172 B12R1.267 CC1CCCCC1NCCCO m_2230__8740226__680950 [0,0,0,1,0,0|1,0,2]=4 1173 B12R1.267 CC1CCCCN1CC#CCO m_2230__678754__15141016 [0,0,0,1,0,0|1,0,2]=4 1174 B12R1.267 CC1CCCCN1CC=CC#N m_2230__678754__16945818 [0,0,0,1,0,0|2,0,1]=4 1175 B12R1.267 CC1CCCCN1CC=CCO m_2230__678754__16809276 [0,0,0,1,0,0|1,0,0]=2 1176 B12R1.267 CC1CCCCN1CCCCO m_2230__678754__3191342 [0,0,0,1,0,0|1,0,2]=4 1177 B12R1.267 CC1CNCCN1C/C=C/CN m_269982__7368790__22485940 [0,0,0,1,0,0|3,0,0]=4 1178 B12R1.267 CC1CNCCN1CC=CCO m_269982__7368790__16809282 [0,0,0,1,0,0|2,0,0]=3 1179 B12R1.267 CC1COCCN1CC=CCO m_2230__679548__16809276 [0,0,0,1,0,0|2,0,0]=3 1180 B12R1.267 CC1CSCCN1CC=CCO m_2230__5359444__16809276 [0,0,0,1,0,0|2,0,0]=3 1181 B12R1.267 CCCSCC1CCCCC1C m_62__11946498__875868 [0,0,0,1,0,0|2,0,1]=4 1182 B12R1.267 CCNCCC1CCCCC1C m_270004__8296150__24715004 [0,0,0,1,0,0|2,0,1]=4 1183 B12R1.267 CCNCC[C@H]1CCCC[C@H]1O m_270004__13314126__24715004 [0,0,0,1,0,0|1,0,2]=4 1184 B12R1.267 CN1CCCCC1CSCCO m_7__128807__22787166 [0,0,0,1,0,0|2,0,1]=4 1185 B12R1.267 C[C@@H]1CCCCN1CC#CCO m_2230__22409340__15141016 [0,0,0,1,0,0|1,0,2]=4 1186 B12R1.267 C[C@@H]1CCCCN1CC=CC#N m_2230__22409340__16945818 [0,0,0,1,0,0|2,0,1]=4 1187 B12R1.267 C[C@@H]1CCCCN1CC=CCO m_2230__22409340__16809276 [0,0,0,1,0,0|1,0,0]=2 1188 B12R1.267 C[C@@H]1CCCCN1CCCCO m_2230__22409340__3191342 [0,0,0,1,0,0|1,0,2]=4 1189 B12R1.267 C[C@H]1COCCN1CC=CCO m_2230__10745968__16809276 [0,0,0,1,0,0|2,0,0]=3 1190 B12R1.271 C=CC=CCCNCC1CC1C m_270004__12896186__9139722 [0,0,0,1,0,0|2,0,1]=4 1191 B12R1.271 C=CC=CCCSCC1CC1C m_62__12216592__12907968 [0,0,0,1,0,0|2,0,1]=4 1192 B12R1.271 C=CC=CCCSC[C@@H]1C[C@H]1C m_62__23861440__12907968 [0,0,0,1,0,0|2,0,1]=4 1193 B12R1.271 CC/C=C\CCCNC1CC1C m_270004__8294846__24594278 [0,0,0,1,0,0|2,0,0]=3 1194 B12R1.271 CC1CC1CCCCNCCO m_270004__8349608__24715066 [0,0,0,1,0,0|1,0,1]=3 1195 B12R1.271 CC1CC1CCCCSCCF m_7__22987818__22320828 [0,0,0,1,0,0|2,0,1]=4 1196 B12R1.271 CC1CC1CCCCSCCO m_7__22987818__102708 [0,0,0,1,0,0|1,0,1]=3 1197 B12R1.271 CC1CC1CCCSCCCO m_7__18317424__6354 [0,0,0,1,0,0|1,0,2]=4 1198 B12R1.271 CC1CC1CNCCC#CCO m_270004__21537562__9139722 [0,0,0,1,0,0|1,0,2]=4 1199 B12R1.271 CC1CC1CNCCCCCO m_270004__9456968__9139722 [0,0,0,1,0,0|1,0,2]=4 1200 B12R1.271 CC1CC1CNCCOCCO m_270004__8288648__9139722 [0,0,0,1,0,0|2,0,1]=4 1201 B12R1.271 CC1CC1CNCCSCCO m_270004__21508858__9139722 [0,0,0,1,0,0|2,0,1]=4 1202 B12R1.271 CC1CC1CSCCOCCO m_62__12216592__8799516 [0,0,0,1,0,0|2,0,1]=4 1203 B12R1.271 CCC=CCCSCC1CC1C m_62__12216592__8859722 [0,0,0,1,0,0|2,0,0]=3 1204 B12R1.271 CCC=CCCSC[C@@H]1C[C@H]1C m_62__8859720__23861442 [0,0,0,1,0,0|2,0,0]=3 1205 B12R1.271 CCC=NOCCCC1CC1C m_34__17309904__17055830 [0,0,0,1,0,0|3,0,0]=4 1206 B12R1.271 CCCCCCNC[C@@H]1C[C@H]1O m_270004__25073046__24715030 [0,0,0,1,0,0|1,0,2]=4 1207 B12R1.271 CCCNCCCCC1CC1C m_270004__8288780__24715066 [0,0,0,1,0,0|2,0,1]=4 1208 B12R1.271 CCCSCCCCC1CC1C m_7__22987818__14390332 [0,0,0,1,0,0|2,0,1]=4 1209 B12R1.271 C[C@H]1C[C@@H]1CSCCOCCO m_62__23861440__8799516 [0,0,0,1,0,0|2,0,1]=4 1210 B12R1.271 C[C@H]1C[C@H]1CCCNCCCO m_270004__8288584__24714994 [0,0,0,1,0,0|1,0,2]=4 1211 B12R1.272 C=CC=CCCNCC1CCC1 m_270004__12896186__24715052 [0,0,0,1,0,0|2,0,1]=4 1212 B12R1.272 C=CC=CCCSCC1CCC1 m_62__6007776__12907968 [0,0,0,1,0,0|2,0,1]=4 1213 B12R1.272 CC/C=C\CCCNC1COC1 m_270004__16799450__24594278 [0,0,0,1,0,0|3,0,0]=4 1214 B12R1.272 CC/C=C\CCCNC1CSC1 m_270004__13270386__24594278 [0,0,0,1,0,0|3,0,0]=4 1215 B12R1.272 CCC=CCCSCC1CCC1 m_62__8859720__6007778 [0,0,0,1,0,0|2,0,0]=3 1216 B12R1.272 CCC=CCCSCC1COC1 m_62__8859720__16613884 [0,0,0,1,0,0|3,0,0]=4 1217 B12R1.272 CCC=NOCCCC1CCC1 m_34__17309904__12056156 [0,0,0,1,0,0|3,0,0]=4 1218 B12R1.272 CCCCCCNC[C@H]1CCO1 m_270004__23851266__24715030 [0,0,0,1,0,0|1,0,2]=4 1219 B12R1.272 CCCCCSCCC1CCO1 m_7__8271838__22866650 [0,0,0,1,0,0|1,0,2]=4 1220 B12R1.272 N#CC=CCSCCC1CCC1 m_7__22987652__7140602 [0,0,0,1,0,0|2,0,1]=4 1221 B12R1.272 OCC#CCCNCC1CCC1 m_270004__21537562__24715052 [0,0,0,1,0,0|1,0,2]=4 1222 B12R1.272 OCC#CCSCCC1CCC1 m_62__12121632__15141012 [0,0,0,1,0,0|1,0,2]=4 1223 B12R1.272 OCC=CCSCCC1CCC1 m_7__22987652__16809272 [0,0,0,1,0,0|1,0,0]=2 1224 B12R1.272 OCCCCCCSC1CCC1 m_7__10684076__6673274 [0,0,0,1,0,0|1,0,2]=4 1225 B12R1.272 OCCCCCNCC1CCC1 m_270004__9456968__24715052 [0,0,0,1,0,0|1,0,2]=4 1226 B12R1.272 OCCCCSCCC1CCC1 m_7__22987652__3191338 [0,0,0,1,0,0|1,0,2]=4 1227 B12R1.272 OCCCNCCCC1CCC1 m_270004__8288584__18051886 [0,0,0,1,0,0|1,0,2]=4 1228 B12R1.272 OCCCSCCCC1CCC1 m_7__22987742__6354 [0,0,0,1,0,0|1,0,2]=4 1229 B12R1.272 OCCOCCNCC1CCC1 m_270004__8288648__24715052 [0,0,0,1,0,0|2,0,1]=4 1230 B12R1.272 OCCOCCSCC1CCC1 m_62__6007776__8799516 [0,0,0,1,0,0|2,0,1]=4 1231 B12R1.272 OCCSCCCOC1CCC1 m_62__13587822__10178562 [0,0,0,1,0,0|2,0,1]=4 1232 B12R1.272 OCCSCCNCC1CCC1 m_270004__21508858__24715052 [0,0,0,1,0,0|2,0,1]=4 1233 B12R1.272 OCCSCCOCC1CCC1 m_62__11245922__10178562 [0,0,0,1,0,0|2,0,1]=4 1234 B12R1.281 CCC1CCCCCC1=NOC m_4__461206__13610260 [0,0,0,1,0,0|3,0,0]=4 1235 B12R1.281 CCC1CCCCCN1CCF m_2230__5454866__22320836 [0,0,0,1,0,0|2,0,1]=4 1236 B12R1.281 CCC1CCCCCN1CCO m_2230__5454866__6165700 [0,0,0,1,0,0|1,0,1]=3 1237 B12R1.281 CCC1CCOCCN1CCO m_2230__14727166__6165700 [0,0,0,1,0,0|2,0,1]=4 1238 B12R1.281 CCCN1CCCCCC1CC m_2230__5454866__13271112 [0,0,0,1,0,0|2,0,1]=4 1239 B12R1.281 CCCN1CCCCCC1CO m_2230__11757172__13271112 [0,0,0,1,0,0|1,0,2]=4 1240 B12R1.281 CCN1CCCCCC1CCO m_270004__9966906__24715004 [0,0,0,1,0,0|1,0,2]=4 1241 B12R1.281 CCNC1CCCCCC1CC m_269862__7865270__13610262 [0,0,0,1,0,0|2,0,1]=4 1242 B12R1.281 CCNC1CCCCCC1CO m_2230__24001472__22383854 [0,0,0,1,0,0|1,0,2]=4 1243 B12R1.281 OCCN1CCCCCC1CO m_2230__11757172__6165700 [0,0,0,1,0,0|2,0,1]=4 1244 B12R1.320 CCCC1CCCC1CNCC m_270004__10741714__24715004 [0,0,0,1,0,0|2,0,1]=4 1245 B12R1.320 CCCC1CCCC1NCCF m_269862__9706110__9452584 [0,0,0,1,0,0|2,0,1]=4 1246 B12R1.320 CCCC1CCCC1NCCN m_272690__11349186__11348596 [0,0,0,1,0,0|2,0,1]=4 1247 B12R1.320 CCCC1CCCC1NCCO m_269862__7193048__9452584 [0,0,0,1,0,0|1,0,1]=3 1248 B12R1.320 CCCC1CCCN1CCCO m_2230__13579908__680950 [0,0,0,1,0,0|1,0,2]=4 1249 B12R1.320 CCCCC1CCCC1=NOC m_4__461206__2990870 [0,0,0,1,0,0|3,0,0]=4 1250 B12R1.320 CCCCC1CCCC1NCC m_2230__8740342__22383854 [0,0,0,1,0,0|2,0,1]=4 1251 B12R1.320 CCCCC1CCCN1CCC m_2230__15143778__13271112 [0,0,0,1,0,0|2,0,1]=4 1252 B12R1.320 CCCCC1CCCN1CCF m_2230__15143778__22320836 [0,0,0,1,0,0|2,0,1]=4 1253 B12R1.320 CCCCC1CCCN1CCO m_2230__15143778__6165700 [0,0,0,1,0,0|1,0,1]=3 1254 B12R1.320 CCCCN1CCCC1CCO m_2230__10893840__22993830 [0,0,0,1,0,0|1,0,2]=4 1255 B12R1.320 CCCN1CCCC1CCCO m_2230__2783860__13271112 [0,0,0,1,0,0|1,0,2]=4 1256 B12R1.320 CCCNC1CCCC1CCC m_269862__7192572__9452584 [0,0,0,1,0,0|2,0,1]=4 1257 B12R1.320 CCOC1CCCC1NCCO m_270004__8349608__24722270 [0,0,0,1,0,0|2,0,1]=4 1258 B12R1.320 CCO[C@@H]1CCC[C@H]1NCCO m_2230__10860538__6165700 [0,0,0,1,0,0|2,0,1]=4 1259 B12R1.320 CCO[C@H]1CCC[C@@H]1SCCO m_7__128807__13774702 [0,0,0,1,0,0|2,0,1]=4 1260 B12R1.320 CCSC1CCCC1NCCO m_2230__10117232__6165700 [0,0,0,1,0,0|2,0,1]=4 1261 B12R1.320 OCCCC1CCCN1CCO m_2230__2783860__6165700 [0,0,0,1,0,0|2,0,1]=4 1262 B12R1.320 OCCNC1CCCC1CCF m_270004__8349608__24722218 [0,0,0,1,0,0|2,0,1]=4 1263 B12R1.325 OCCNC1CCC1CCCCl m_270004__8349608__24722872 [0,0,0,1,0,0|2,0,1]=4 1264 B12R1.329 CCCNC1CCCCCCC1 m_269862__7192572__7200188 [0,0,0,1,0,0|2,0,1]=4 1265 B12R1.329 CCNCC1CCC=CCCC1 m_270004__13433636__24715004 [0,0,0,1,0,0|2,0,0]=3 1266 B12R1.329 CCNCC1CCCCCCC1 m_207__121480__6388778 [0,0,0,1,0,0|2,0,1]=4 1267 B12R1.329 CCSCC1CCC=CCCC1 m_62__875846__15780340 [0,0,0,1,0,0|2,0,0]=3 1268 B12R1.329 CON=CC1CCCCCCC1 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CCCCCCN[C@@H](C)CCO m_270004__13469994__24715030 [1,1,0,0,0,0|1,0,1]=4 1596 B11R0.4 CCCCCCSC(C)CCO m_7__5819074__846538 [1,1,0,0,0,0|1,0,1]=4 1597 B11R0.4 CCCCCSCC(=CCO)C m_7__8271838__20765532 [1,1,0,0,0,0|1,0,0]=3 1598 B11R0.4 CCCCCSCC(O)CCO m_63__8271842__16726650 [1,1,0,0,0,0|1,0,1]=4 1599 B11R0.4 CCCN(C)CCCCCCO m_2230__2261920__6673278 [1,1,0,0,0,0|1,0,1]=4 1600 B11R0.4 CCCSCCCC(=CCO)C m_7__22986886__22787184 [1,1,0,0,0,0|1,0,0]=3 1601 B11R0.4 CCNCCSCC(=CCO)C m_7__22986872__20765532 [1,1,0,0,0,0|2,0,0]=4 1602 B11R0.4 CCSCCSCC(=CCO)C m_7__8765656__20765532 [1,1,0,0,0,0|2,0,0]=4 1603 B11R0.4 COCC(C)CSCC=CCO m_7__20064958__16809272 [1,1,0,0,0,0|2,0,0]=4 1604 B11R0.4 COCCCSCC(=CCO)C m_7__17626136__20765532 [1,1,0,0,0,0|2,0,0]=4 1605 B11R0.4 COC[C@H](O)CNCC=CCO m_273610__13857830__11516246 [1,1,0,0,0,0|2,0,0]=4 1606 B11R0.4 CSCC(O)CNCC=CCO m_273610__13857830__11516278 [1,1,0,0,0,0|2,0,0]=4 1607 B11R0.4 CSCCCSCC(=CCO)C m_7__10890048__20765532 [1,1,0,0,0,0|2,0,0]=4 1608 B11R0.40 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B11R0.40 CC=CCCCSCC(O)CO m_7__6554250__16975672 [1,1,0,0,0,0|2,0,0]=4 1647 B11R0.40 CC=CCCCSC[C@@H](N)CC m_7__20871354__16975672 [1,1,0,0,0,0|1,0,0]=3 1648 B11R0.40 CCC(C)CCSCCCCO m_7__22849690__20058094 [1,1,0,0,0,0|1,0,1]=4 1649 B11R0.40 CCC(C)CNCCCCCO m_207__9456940__7687310 [1,1,0,0,0,0|1,0,1]=4 1650 B11R0.40 CCC(C)CSCCCCCO m_7__7022538__6079158 [1,1,0,0,0,0|1,0,1]=4 1651 B11R0.40 CCC(C)NCCCCCCO m_2230__22399526__13038782 [1,1,0,0,0,0|1,0,1]=4 1652 B11R0.40 CCC(O)CCSCCCCO m_7__22849690__16640702 [1,1,0,0,0,0|1,0,1]=4 1653 B11R0.40 CCC(O)CNCCCCCO m_273610__11554132__11516276 [1,1,0,0,0,0|1,0,1]=4 1654 B11R0.40 CCC(O)CSCCCCCO m_7__22988104__6079158 [1,1,0,0,0,0|1,0,1]=4 1655 B11R0.40 CCC=CCCSCC(C)CC m_62__10709932__8859722 [1,1,0,0,0,0|2,0,0]=4 1656 B11R0.40 CCC=CCCSCC(F)CC m_62__9787600__8859722 [1,1,0,0,0,0|2,0,0]=4 1657 B11R0.40 CCC=CCCSCC(O)CC m_7__22988104__8859716 [1,1,0,0,0,0|2,0,0]=4 1658 B11R0.40 CCC=CCCSC[C@@H](N)CC m_7__20871354__8859716 [1,1,0,0,0,0|2,0,0]=4 1659 B11R0.40 CCCCCCCCC(=O)NC m_22__387492__335740 [1,1,0,0,0,0|1,0,0]=3 1660 B11R0.40 CCCCCCCCC(=O)NN m_240690__7868478__7404582 [1,1,0,0,0,0|2,0,0]=4 1661 B11R0.40 CCCCCCCCC(=O)NO m_527__388132__336048 [1,1,0,0,0,0|1,0,0]=3 1662 B11R0.40 CCCCCCCCC(=O)OC m_276436__14076652__14088344 [1,1,0,0,0,0|1,0,0]=3 1663 B11R0.40 CCCCCCCCN(C)CC m_270004__18340810__24715004 [1,1,0,0,0,0|1,0,1]=4 1664 B11R0.40 CCCCCCCCN(C)OC m_2230__679026__9282126 [1,1,0,0,0,0|2,0,0]=4 1665 B11R0.40 CCCCCCCCS(=O)CC m_1498__7021596__9282122 [1,1,0,0,0,0|1,0,1]=4 1666 B11R0.40 CCCCCCCNC(=O)CC m_270062__12209966__22005658 [1,1,0,0,0,0|1,0,1]=4 1667 B11R0.40 CCCCCCCNC(=O)CN m_240690__12226084__3025698 [1,1,0,0,0,0|2,0,0]=4 1668 B11R0.40 CCCCCCCNC(=O)CO m_22__12209930__7941800 [1,1,0,0,0,0|1,0,0]=3 1669 B11R0.40 CCCCCCCNC(=O)NC m_2554__12209954__788506 [1,1,0,0,0,0|2,0,0]=4 1670 B11R0.40 CCCCCCCNC(=O)OC m_282070__22230938__22151046 [1,1,0,0,0,0|2,0,0]=4 1671 B11R0.40 CCCCCCCNC(=S)NC m_8__12209924__83693 [1,1,0,0,0,0|2,0,0]=4 1672 B11R0.40 CCCCCCCNC(C)CO m_269862__8315612__15157990 [1,1,0,0,0,0|1,0,1]=4 1673 B11R0.40 CCCCCCCN[C@H](C)CO m_2230__22399532__7284644 [1,1,0,0,0,0|1,0,1]=4 1674 B11R0.40 CCCCCCCOC(=O)CC m_276436__14076620__14101862 [1,1,0,0,0,0|1,0,1]=4 1675 B11R0.40 CCCCCCCSC(C)CO m_7__6338928__7284628 [1,1,0,0,0,0|1,0,1]=4 1676 B11R0.40 CCCCCCNCC(=O)OC m_270004__24790270__24715030 [1,1,0,0,0,0|2,0,0]=4 1677 B11R0.40 CCCCCCNCC(C)CO m_270004__8291276__24715030 [1,1,0,0,0,0|1,0,1]=4 1678 B11R0.40 CCCCCCNCC(F)CO m_270004__17069732__24715030 [1,1,0,0,0,0|1,0,1]=4 1679 B11R0.40 CCCCCCONC(=N)CO m_34__11944490__9139750 [1,1,0,0,0,0|2,0,0]=4 1680 B11R0.40 CCCCCCSCC(=CCl)C m_7__9703826__846538 [1,1,0,0,0,0|2,0,0]=4 1681 B11R0.40 CCCCCCSCC(=O)NC m_62__8854732__81300 [1,1,0,0,0,0|2,0,0]=4 1682 B11R0.40 CCCCCCSCC(=O)OC m_7__29561__846538 [1,1,0,0,0,0|2,0,0]=4 1683 B11R0.40 CCCCCCSCC(C)CO m_7__6078536__846538 [1,1,0,0,0,0|1,0,1]=4 1684 B11R0.40 CCCCCCSCC(O)CO m_63__18991476__8671902 [1,1,0,0,0,0|1,0,1]=4 1685 B11R0.40 CCCCCSCCC(=O)CC m_7__8271838__5062092 [1,1,0,0,0,0|1,0,1]=4 1686 B11R0.40 CCCCCSCCC(=O)OC m_7__8271838__131271 [1,1,0,0,0,0|2,0,0]=4 1687 B11R0.40 CCCCOCCNC(=O)CO m_22__2163352__7941800 [1,1,0,0,0,0|2,0,0]=4 1688 B11R0.40 CCCCSCCCC(=O)OC m_7__22987836__770176 [1,1,0,0,0,0|2,0,0]=4 1689 B11R0.40 CCCNCCCCC(=O)OC m_270004__8288780__18313460 [1,1,0,0,0,0|2,0,0]=4 1690 B11R0.40 CCCSCCCCC(=O)OC m_7__22986886__12341310 [1,1,0,0,0,0|2,0,0]=4 1691 B11R0.40 CCN(C)CCCCCCCO m_270004__24158974__24715004 [1,1,0,0,0,0|1,0,1]=4 1692 B11R0.40 CCN(C)CCSCC=CCO m_7__14769896__16809272 [1,1,0,0,0,0|2,0,0]=4 1693 B11R0.40 CCNCCCCCC(=O)OC m_270004__10205878__24715004 [1,1,0,0,0,0|2,0,0]=4 1694 B11R0.40 CCOCCCCCC(=O)NC m_22__387492__12623512 [1,1,0,0,0,0|2,0,0]=4 1695 B11R0.40 CCOCCCCCC(=O)NO m_527__388132__12623514 [1,1,0,0,0,0|2,0,0]=4 1696 B11R0.40 CCOCCCCCC(=O)OC m_276436__14076652__14107042 [1,1,0,0,0,0|2,0,0]=4 1697 B11R0.40 CCOCCCCNC(=O)CO m_22__1000086__7941800 [1,1,0,0,0,0|2,0,0]=4 1698 B11R0.40 CCSCCCCCC(=O)OC m_7__13890460__5047 [1,1,0,0,0,0|2,0,0]=4 1699 B11R0.40 CC[C@H](N)CSCCCCCO m_7__20871354__6079158 [1,1,0,0,0,0|1,0,1]=4 1700 B11R0.40 CNC(=O)CCCCCCCN m_240690__7355834__18318972 [1,1,0,0,0,0|2,0,0]=4 1701 B11R0.40 CNC(=O)CCCCCCSC m_22__387492__12298720 [1,1,0,0,0,0|2,0,0]=4 1702 B11R0.40 COC(=O)CCCCCCSC m_276436__14076652__14106382 [1,1,0,0,0,0|2,0,0]=4 1703 B11R0.40 COC(C)CCSCC=CCO m_7__22987798__16809272 [1,1,0,0,0,0|2,0,0]=4 1704 B11R0.40 COCCCCCNC(=O)CO m_22__23072890__7941800 [1,1,0,0,0,0|2,0,0]=4 1705 B11R0.40 CSCCCCCCC(=O)NO m_527__388132__12298722 [1,1,0,0,0,0|2,0,0]=4 1706 B11R0.40 CSCCCCCNC(=O)CO m_22__8992110__7941800 [1,1,0,0,0,0|2,0,0]=4 1707 B11R0.40 NCCCCCCNC(=O)CO m_240690__11579040__17025660 [1,1,0,0,0,0|2,0,0]=4 1708 B11R0.40 O=C(CO)NCCCCCCF m_22__23073300__7941800 [1,1,0,0,0,0|2,0,0]=4 1709 B11R0.40 O=C(CO)NCCCCCCO m_22__8282992__7941800 [1,1,0,0,0,0|2,0,0]=4 1710 B11R0.81 C/C=C/CCNC(=O)CCCC m_22__24036082__303718 [1,1,0,0,0,0|1,0,1]=4 1711 B11R0.81 C/C=C/CCNC(C)CCCC m_2230__22399858__23858420 [1,1,0,0,0,0|1,0,0]=3 1712 B11R0.81 C/C=C/CCNC(C)CCCCl m_270004__23849830__24722580 [1,1,0,0,0,0|2,0,0]=4 1713 B11R0.81 C/C=C/CCNC(C)CCCN m_269982__22505332__23858432 [1,1,0,0,0,0|2,0,0]=4 1714 B11R0.81 C/C=C/CCNC(C)CCCO m_2230__22399382__23858420 [1,1,0,0,0,0|2,0,0]=4 1715 B11R0.81 C/C=C/CCNC(C)CCNC m_269982__22505202__23858432 [1,1,0,0,0,0|2,0,0]=4 1716 B11R0.81 C/C=C/CCNC(C)CCOC m_2230__22398948__23858420 [1,1,0,0,0,0|2,0,0]=4 1717 B11R0.81 C/C=C/CCNC(C)CCSC m_2230__22399620__23858420 [1,1,0,0,0,0|2,0,0]=4 1718 B11R0.81 C/C=C/CCNC(C)COCC m_2230__22397432__23858420 [1,1,0,0,0,0|2,0,0]=4 1719 B11R0.81 C/C=C/CCOC(=O)CCCC m_276436__23822610__14088340 [1,1,0,0,0,0|1,0,1]=4 1720 B11R0.81 C/C=C/CCSC(C)CCCO m_7__22988038__23858408 [1,1,0,0,0,0|2,0,0]=4 1721 B11R0.81 C/C=C/CCSC(C)CCOC m_62__23858414__6956440 [1,1,0,0,0,0|2,0,0]=4 1722 B11R0.81 C/C=C/CCSC(Cl)CCCBr m_62__23915478__23858416 [1,1,0,0,0,0|2,0,0]=4 1723 B11R0.81 CC(CCCCl)NCC=CCO m_270004__11971554__24722580 [1,1,0,0,0,0|2,0,0]=4 1724 B11R0.81 CC(CCCN)NCC=CCO m_269982__22505332__16809282 [1,1,0,0,0,0|2,0,0]=4 1725 B11R0.81 CC(CCCO)NCC=CCO m_2230__22399382__16809276 [1,1,0,0,0,0|2,0,0]=4 1726 B11R0.81 CC(CCCO)SCC=CCO m_7__22988038__16809272 [1,1,0,0,0,0|2,0,0]=4 1727 B11R0.81 CC=CCC(=O)NCCCCC m_22__57680__21288486 [1,1,0,0,0,0|1,0,1]=4 1728 B11R0.81 CC=CCCCN(C)CCCC m_2230__665312__16975682 [1,1,0,0,0,0|1,0,0]=3 1729 B11R0.81 CC=CCCCN(C)CCCF m_2230__13040470__16975682 [1,1,0,0,0,0|2,0,0]=4 1730 B11R0.81 CC=CCCCN(C)CCCN m_269982__11965286__16975690 [1,1,0,0,0,0|2,0,0]=4 1731 B11R0.81 CC=CCCCN(C)CCCO m_2230__9787816__16975682 [1,1,0,0,0,0|2,0,0]=4 1732 B11R0.81 CC=CCCCN(C)CCNC m_269982__10880304__16975690 [1,1,0,0,0,0|2,0,0]=4 1733 B11R0.81 CC=CCCCN(C)CCOC m_2230__2013888__16975682 [1,1,0,0,0,0|2,0,0]=4 1734 B11R0.81 CC=CCCCN(C)CCSC m_2230__7207368__16975682 [1,1,0,0,0,0|2,0,0]=4 1735 B11R0.81 CC=CCN(C)CCCCCC m_2230__22406770__681024 [1,1,0,0,0,0|1,0,0]=3 1736 B11R0.81 CC=CCN(C)CCCCCO m_2230__9449864__681024 [1,1,0,0,0,0|2,0,0]=4 1737 B11R0.81 CC=CCN(C)CCCCOC m_2230__11246776__681024 [1,1,0,0,0,0|2,0,0]=4 1738 B11R0.81 CC=CCN(C)CCCOCC m_2230__22406790__681024 [1,1,0,0,0,0|2,0,0]=4 1739 B11R0.81 CC=CCNCC(O)CCOC m_273610__14317906__12549026 [1,1,0,0,0,0|2,0,0]=4 1740 B11R0.81 CC=CCNCC(O)COCC m_273610__14317906__11516306 [1,1,0,0,0,0|2,0,0]=4 1741 B11R0.81 CC=CCS(=O)CCCCCC m_265282__18991470__4272774 [1,1,0,0,0,0|1,0,0]=3 1742 B11R0.81 CC=CCS(=O)CCCCOC m_1498__3114452__6078492 [1,1,0,0,0,0|2,0,0]=4 1743 B11R0.81 CC=CCS(=O)CCOCCC m_1498__3114452__15503592 [1,1,0,0,0,0|2,0,0]=4 1744 B11R0.81 CCC=CCCC(C)NCCC m_269862__7192572__17320678 [1,1,0,0,0,0|2,0,0]=4 1745 B11R0.81 CCC=CCCN(C)CCCC m_2230__665312__8859726 [1,1,0,0,0,0|2,0,0]=4 1746 B11R0.81 CCC=CCNC(C)CCCC m_269862__17312576__7200136 [1,1,0,0,0,0|2,0,0]=4 1747 B11R0.81 CCCCC(=O)NCC=CCO m_527__11971536__156096 [1,1,0,0,0,0|1,0,1]=4 1748 B11R0.81 CCCCC(=O)OCC=CCO m_1458__473328__16809274 [1,1,0,0,0,0|1,0,1]=4 1749 B11R0.81 CCCCC(C)CNCCCO m_270004__8288584__24715008 [1,1,0,0,0,0|1,0,1]=4 1750 B11R0.81 CCCCC(C)NC/C=C\CN m_272690__21478164__11345926 [1,1,0,0,0,0|2,0,0]=4 1751 B11R0.81 CCCCC(C)NCC=CCO m_270004__11971554__8844922 [1,1,0,0,0,0|1,0,0]=3 1752 B11R0.81 CCCCC(C)NCCC=CBr m_269862__16490040__7200136 [1,1,0,0,0,0|2,0,0]=4 1753 B11R0.81 CCCCC(C)NCCCCO m_2230__22399858__3191342 [1,1,0,0,0,0|1,0,1]=4 1754 B11R0.81 CCCCC(O)CSC/C=C\Br m_7__22544354__15431214 [1,1,0,0,0,0|2,0,0]=4 1755 B11R0.81 CCCCC(O)CSCCCO m_7__10972294__15431214 [1,1,0,0,0,0|1,0,1]=4 1756 B11R0.81 CCCCCCC(C)NCCO m_269862__7193048__7200330 [1,1,0,0,0,0|1,0,1]=4 1757 B11R0.81 CCCCCCN(C)C/C=C\Br m_2230__22406770__22384838 [1,1,0,0,0,0|2,0,0]=4 1758 B11R0.81 CCCCCCN(C)CC=CCl m_2230__22406770__667198 [1,1,0,0,0,0|2,0,0]=4 1759 B11R0.81 CCCCCCN(C)CCCO m_2230__22406770__680950 [1,1,0,0,0,0|1,0,1]=4 1760 B11R0.81 CCCCCCS(=O)CC=CCl m_265282__18991470__13192768 [1,1,0,0,0,0|2,0,0]=4 1761 B11R0.81 CCCCCNC(=O)C=CCO m_22__57680__13570734 [1,1,0,0,0,0|1,0,1]=4 1762 B11R0.81 CCCCCNC(C)CCCO m_2230__22399382__5063396 [1,1,0,0,0,0|1,0,1]=4 1763 B11R0.81 CCCCCSC(C)CCCO m_7__8271838__10804146 [1,1,0,0,0,0|1,0,1]=4 1764 B11R0.81 CCCCN(C)CCCCCO m_2230__665312__6079162 [1,1,0,0,0,0|1,0,1]=4 1765 B11R0.81 CCCNC(C)CCCCCO m_2230__22404642__13271112 [1,1,0,0,0,0|1,0,1]=4 1766 B11R0.81 CCOCC(C)NCC=CCO m_269862__11971552__7201202 [1,1,0,0,0,0|2,0,0]=4 1767 B11R0.81 CNCCC(C)NCC=CCO m_269982__22505202__16809282 [1,1,0,0,0,0|2,0,0]=4 1768 B11R0.81 COCCC(C)NCC=CCO m_270004__11971554__8844978 [1,1,0,0,0,0|2,0,0]=4 1769 B11R0.81 CSCCC(C)NCC=CCO m_270004__11971554__24722956 [1,1,0,0,0,0|2,0,0]=4 1770 B11R0.140 C/C=C/CCN(C)CCCCC m_2230__22407254__23858420 [1,1,0,0,0,0|1,0,0]=3 1771 B11R0.140 C/C=C/CCN(C)CCCCO m_2230__9209606__23858420 [1,1,0,0,0,0|2,0,0]=4 1772 B11R0.140 C/C=C/CCN(C)CCCNC m_269982__10972426__23858432 [1,1,0,0,0,0|2,0,0]=4 1773 B11R0.140 C/C=C/CCN(C)CCCOC m_2230__2067964__23858420 [1,1,0,0,0,0|2,0,0]=4 1774 B11R0.140 C/C=C/CCN(C)CCCSC m_2230__9749472__23858420 [1,1,0,0,0,0|2,0,0]=4 1775 B11R0.140 C/C=C/CCN(C)CCOCC m_2230__8253658__23858420 [1,1,0,0,0,0|2,0,0]=4 1776 B11R0.140 CC=CCCC(=O)NCCCC m_527__154443__16726280 [1,1,0,0,0,0|1,0,1]=4 1777 B11R0.140 CC=CCCC(=O)OCCCC m_276436__14076536__16726292 [1,1,0,0,0,0|1,0,1]=4 1778 B11R0.140 CC=CCNC(=O)CCCCC m_1626__22076596__515356 [1,1,0,0,0,0|1,0,1]=4 1779 B11R0.140 CC=CCNC(C)CCCCC m_269862__14317892__7200472 [1,1,0,0,0,0|1,0,0]=3 1780 B11R0.140 CC=CCNC(C)CCCCO m_2230__22399050__681024 [1,1,0,0,0,0|2,0,0]=4 1781 B11R0.140 CC=CCNC(C)CCCOC m_269862__14317892__7201632 [1,1,0,0,0,0|2,0,0]=4 1782 B11R0.140 CC=CCNC(C)CCSCC m_2230__22399618__681024 [1,1,0,0,0,0|2,0,0]=4 1783 B11R0.140 CC=CCNC(C)CSCCC m_269862__14317892__13438920 [1,1,0,0,0,0|2,0,0]=4 1784 B11R0.140 CC=CCOC(=O)CCCCC m_276436__17781506__14085900 [1,1,0,0,0,0|1,0,1]=4 1785 B11R0.140 CCCCCC(C)NC/C=C\Br m_270004__23796022__8844946 [1,1,0,0,0,0|2,0,0]=4 1786 B11R0.140 CCCCCC(C)NCC=CBr m_269862__15075178__7200472 [1,1,0,0,0,0|2,0,0]=4 1787 B11R0.140 CCCCCC(C)NCC=CCl m_270004__13448032__8844946 [1,1,0,0,0,0|2,0,0]=4 1788 B11R0.140 CCCCCC(C)NCCCO m_269862__7192678__7200472 [1,1,0,0,0,0|1,0,1]=4 1789 B11R0.140 CCCCCN(C)CC=CCO m_2230__22407254__16809276 [1,1,0,0,0,0|1,0,0]=3 1790 B11R0.140 CCCCCN(C)CCCCO m_2230__22407254__3191342 [1,1,0,0,0,0|1,0,1]=4 1791 B11R0.140 CCCCNC(C)CCCCO m_2230__22399050__22993830 [1,1,0,0,0,0|1,0,1]=4 1792 B11R0.140 CCOCCN(C)CC=CCO m_2230__8253658__16809276 [1,1,0,0,0,0|2,0,0]=4 1793 B11R0.140 CN(CC=CCO)CCCCO m_2230__9209606__16809276 [1,1,0,0,0,0|2,0,0]=4 1794 B11R0.140 CNCCCN(C)CC=CCO m_269982__10972426__16809282 [1,1,0,0,0,0|2,0,0]=4 1795 B11R0.140 COCCCN(C)CC=CCO m_2230__2067964__16809276 [1,1,0,0,0,0|2,0,0]=4 1796 B11R0.140 CSCCCN(C)CC=CCO m_2230__9749472__16809276 [1,1,0,0,0,0|2,0,0]=4 1797 B11R0.148 C/C=C/CCNCCCC(C)C m_270004__23849830__9139706 [1,1,0,0,0,0|1,0,0]=3 1798 B11R0.148 C/C=C/CCSCCCC(C)C m_62__10892842__23858416 [1,1,0,0,0,0|1,0,0]=3 1799 B11R0.148 C/C=C/CCSCCCC(Cl)Cl m_62__23858414__23915480 [1,1,0,0,0,0|2,0,0]=4 1800 B11R0.148 C/C=C/CCSCCCC(F)F m_62__23858414__18239798 [1,1,0,0,0,0|2,0,0]=4 1801 B11R0.148 C/C=C/CCSCCCN(C)C m_7__15765946__23858408 [1,1,0,0,0,0|2,0,0]=4 1802 B11R0.148 C/C=C/CCSCCOC(C)C m_62__3569224__23858416 [1,1,0,0,0,0|2,0,0]=4 1803 B11R0.148 C/C=C/CCSCCSC(C)C m_62__23858414__10158466 [1,1,0,0,0,0|2,0,0]=4 1804 B11R0.148 C=C(C)CCCCNCCCC m_270004__8289202__23155964 [1,1,0,0,0,0|1,0,1]=4 1805 B11R0.148 C=C(C)CCCNCC/C=C/C m_270004__23849830__23155958 [1,1,0,0,0,0|1,0,1]=4 1806 B11R0.148 C=C(C)CCCNCCCCC m_270004__8288604__23155958 [1,1,0,0,0,0|1,0,1]=4 1807 B11R0.148 C=C(C)CCCSCC/C=C/C m_62__13608160__23858416 [1,1,0,0,0,0|1,0,1]=4 1808 B11R0.148 C=C(C)CCCSCCCCC m_62__13608160__5063392 [1,1,0,0,0,0|1,0,1]=4 1809 B11R0.148 C=C(C)CCNCCCCCC m_270004__10740086__24715030 [1,1,0,0,0,0|1,0,1]=4 1810 B11R0.148 C=C(C)CCSCCCC=CC m_62__10158742__16975678 [1,1,0,0,0,0|1,0,1]=4 1811 B11R0.148 C=C(C)CCSCCCCCC m_62__10158742__8854724 [1,1,0,0,0,0|1,0,1]=4 1812 B11R0.148 C=C(C)CSCCCCCCC m_62__6464432__7284636 [1,1,0,0,0,0|1,0,1]=4 1813 B11R0.148 CC(=CCCCNCCCF)C m_270004__17065596__16886698 [1,1,0,0,0,0|2,0,0]=4 1814 B11R0.148 CC(=CCCCNCCCO)C m_270004__8288584__16886698 [1,1,0,0,0,0|2,0,0]=4 1815 B11R0.148 CC(=CCCNCCCCCl)C m_270004__9277484__24721168 [1,1,0,0,0,0|2,0,0]=4 1816 B11R0.148 CC(=CCCSCCCCF)C m_62__12121620__10157916 [1,1,0,0,0,0|2,0,0]=4 1817 B11R0.148 CC(=CCCSCCCCN)C m_34__20871448__12121618 [1,1,0,0,0,0|2,0,0]=4 1818 B11R0.148 CC(=CCCSCCCCO)C m_7__22849690__12121616 [1,1,0,0,0,0|2,0,0]=4 1819 B11R0.148 CC(=CCNCCCCCCl)C m_270004__9277694__24721510 [1,1,0,0,0,0|2,0,0]=4 1820 B11R0.148 CC(=CCSCCCCCF)C m_62__12201838__9984634 [1,1,0,0,0,0|2,0,0]=4 1821 B11R0.148 CC(=CCSCCCCCF)Cl m_7__22986778__12215356 [1,1,0,0,0,0|2,0,0]=4 1822 B11R0.148 CC(=CCSCCCCCN)C m_34__20871474__12201834 [1,1,0,0,0,0|2,0,0]=4 1823 B11R0.148 CC(=CCSCCCCCN)Cl m_34__20871474__12332112 [1,1,0,0,0,0|2,0,0]=4 1824 B11R0.148 CC(=O)NCCCCCCCO m_270062__16413930__15585492 [1,1,0,0,0,0|2,0,0]=4 1825 B11R0.148 CC(C)CCCCNCCCO m_270004__8288584__12202092 [1,1,0,0,0,0|1,0,1]=4 1826 B11R0.148 CC(C)CCCNCC=CCO m_207__11971532__7912414 [1,1,0,0,0,0|1,0,0]=3 1827 B11R0.148 CC(C)CCCNCCC=CBr m_207__16490010__7912414 [1,1,0,0,0,0|2,0,0]=4 1828 B11R0.148 CC(C)CCCNCCCCO m_207__9433150__7912414 [1,1,0,0,0,0|1,0,1]=4 1829 B11R0.148 CC(C)CCCSCC=CCO m_7__8333108__16809272 [1,1,0,0,0,0|1,0,0]=3 1830 B11R0.148 CC(C)CCCSCCCCO m_7__8333108__3191338 [1,1,0,0,0,0|1,0,1]=4 1831 B11R0.148 CC(C)CCNCCCCCO m_207__9456940__134014 [1,1,0,0,0,0|1,0,1]=4 1832 B11R0.148 CC(C)CCSCCCCCO m_7__22987856__6079158 [1,1,0,0,0,0|1,0,1]=4 1833 B11R0.148 CC(C)CNCCCCCCO m_207__8282998__121216 [1,1,0,0,0,0|1,0,1]=4 1834 B11R0.148 CC(C)CSCCCCCCO m_7__27301__6673274 [1,1,0,0,0,0|1,0,1]=4 1835 B11R0.148 CC(C)NCCCCCCCO m_269862__13810920__7204804 [1,1,0,0,0,0|1,0,1]=4 1836 B11R0.148 CC(C)OCCSCC=CCO m_7__22987390__16809272 [1,1,0,0,0,0|2,0,0]=4 1837 B11R0.148 CC(N)CCSCCCCCO m_7__20871360__6079158 [1,1,0,0,0,0|1,0,1]=4 1838 B11R0.148 CC(O)CCCSCCCCO m_7__22849690__10688172 [1,1,0,0,0,0|1,0,1]=4 1839 B11R0.148 CC(O)CNCCCCCCO m_273610__11554174__11516404 [1,1,0,0,0,0|1,0,1]=4 1840 B11R0.148 CC(O)CSCCCCCCO m_7__10953796__6673274 [1,1,0,0,0,0|1,0,1]=4 1841 B11R0.148 CC/C=C\CCCNCC(C)C m_270004__8288546__24594278 [1,1,0,0,0,0|2,0,0]=4 1842 B11R0.148 CC/C=C\CCCNCC(C)F m_270004__13461138__24594278 [1,1,0,0,0,0|2,0,0]=4 1843 B11R0.148 CC/C=C\CCCNCC(C)O m_270004__8288774__24594278 [1,1,0,0,0,0|2,0,0]=4 1844 B11R0.148 CC=CCCCNCCC(C)C m_207__17054526__134014 [1,1,0,0,0,0|1,0,0]=3 1845 B11R0.148 CC=CCCCSCCC(C)C m_62__7021584__16975678 [1,1,0,0,0,0|1,0,0]=3 1846 B11R0.148 CC=CCCCSCCC(C)F m_62__13165346__16975678 [1,1,0,0,0,0|1,0,0]=3 1847 B11R0.148 CC=CCCCSCCC(C)N m_34__20871470__16975674 [1,1,0,0,0,0|1,0,0]=3 1848 B11R0.148 CC=CCCCSCCC(C)O m_62__12057938__16975678 [1,1,0,0,0,0|1,0,0]=3 1849 B11R0.148 CC=CCCCSCCC(F)F m_7__22986868__16975672 [1,1,0,0,0,0|2,0,0]=4 1850 B11R0.148 CC=CCCCSCCN(C)C m_7__6950568__16975672 [1,1,0,0,0,0|2,0,0]=4 1851 B11R0.148 CC=CCSCCCOC(C)C m_62__4275932__9273986 [1,1,0,0,0,0|2,0,0]=4 1852 B11R0.148 CC=CCSCCOCC(C)C m_62__9820342__4275958 [1,1,0,0,0,0|2,0,0]=4 1853 B11R0.148 CC=CCSCCSCC(C)C m_62__4275932__8268574 [1,1,0,0,0,0|2,0,0]=4 1854 B11R0.148 CCC=CCCSCCC(C)C m_62__7021584__8859722 [1,1,0,0,0,0|2,0,0]=4 1855 B11R0.148 CCC=CCCSCCC(C)F m_62__13165346__8859722 [1,1,0,0,0,0|2,0,0]=4 1856 B11R0.148 CCC=CCCSCCC(C)N m_34__20871470__8899998 [1,1,0,0,0,0|2,0,0]=4 1857 B11R0.148 CCC=CCCSCCC(C)O m_62__12057938__8859722 [1,1,0,0,0,0|2,0,0]=4 1858 B11R0.148 CCC=CCNCCCC(C)C m_207__17312546__7912414 [1,1,0,0,0,0|2,0,0]=4 1859 B11R0.148 CCCCCCCCCC(=O)N m_22__58357__335744 [1,1,0,0,0,0|0,0,2]=4 1860 B11R0.148 CCCCCCCCCN(C)C m_2230__1182964__2463448 [1,1,0,0,0,0|1,0,1]=4 1861 B11R0.148 CCCCCCCCNC(=N)N m_58668__7793402__2227896 [1,1,0,0,0,0|2,0,0]=4 1862 B11R0.148 CCCCCCCCNC(=O)C m_270062__9801310__15585492 [1,1,0,0,0,0|1,0,0]=3 1863 B11R0.148 CCCCCCCCNC(=O)N m_2554__7793394__788524 [1,1,0,0,0,0|1,0,1]=4 1864 B11R0.148 CCCCCCCCNC(C)C m_269862__8256904__7204804 [1,1,0,0,0,0|1,0,1]=4 1865 B11R0.148 CCCCCCCCOC(=O)C m_276436__14076610__14088324 [1,1,0,0,0,0|1,0,0]=3 1866 B11R0.148 CCCCCCCCSC(C)C m_62__2390328__9282118 [1,1,0,0,0,0|1,0,1]=4 1867 B11R0.148 CCCCCCCNCC(C)O m_273610__12209978__11516404 [1,1,0,0,0,0|1,0,1]=4 1868 B11R0.148 CCCCCCCONC(=O)C m_34__2463346__7284630 [1,1,0,0,0,0|2,0,0]=4 1869 B11R0.148 CCCCCCCSCC(=O)O m_7__26823__7284628 [1,1,0,0,0,0|1,0,1]=4 1870 B11R0.148 CCCCCCCSCC(C)O m_7__10953796__7284628 [1,1,0,0,0,0|1,0,1]=4 1871 B11R0.148 CCCCCCNCC=C(C)C m_270004__9277694__24715030 [1,1,0,0,0,0|1,0,0]=3 1872 B11R0.148 CCCCCCNCCC(C)O m_270004__8296476__24715030 [1,1,0,0,0,0|1,0,1]=4 1873 B11R0.148 CCCCCCSCC=C(C)C m_62__12201838__8854724 [1,1,0,0,0,0|1,0,0]=3 1874 B11R0.148 CCCCCCSCC=C(Cl)Cl m_62__8854732__11985918 [1,1,0,0,0,0|2,0,0]=4 1875 B11R0.148 CCCCCCSCCC(C)O m_62__12057938__8854724 [1,1,0,0,0,0|1,0,1]=4 1876 B11R0.148 CCCCCSCCC=C(C)C m_62__12121620__5063392 [1,1,0,0,0,0|1,0,0]=3 1877 B11R0.148 CCCCCSCCCC(=O)C m_7__8271838__322712 [1,1,0,0,0,0|1,0,1]=4 1878 B11R0.148 CCCCCSCCCC(C)O m_7__8271838__10688172 [1,1,0,0,0,0|1,0,1]=4 1879 B11R0.148 CCCCCSCCNC(=O)C m_7__17756534__5063386 [1,1,0,0,0,0|2,0,0]=4 1880 B11R0.148 CCCCCSCCOC(=O)C m_7__8271838__22601252 [1,1,0,0,0,0|2,0,0]=4 1881 B11R0.148 CCCCNCCCC=C(C)C m_270004__8289202__16886698 [1,1,0,0,0,0|1,0,0]=3 1882 B11R0.148 CCCCNCCCCC(=O)O m_273456__11063970__23171790 [1,1,0,0,0,0|1,0,1]=4 1883 B11R0.148 CCCCOCCCNC(=O)C m_270062__7595124__15585492 [1,1,0,0,0,0|2,0,0]=4 1884 B11R0.148 CCCOCCSCC=C(C)C m_62__12201838__15503588 [1,1,0,0,0,0|2,0,0]=4 1885 B11R0.148 CCCOCCSCC=C(C)Cl m_7__22987516__12215356 [1,1,0,0,0,0|2,0,0]=4 1886 B11R0.148 CCCSCCCCCC(=O)C m_7__22986886__10738134 [1,1,0,0,0,0|1,0,1]=4 1887 B11R0.148 CCCSCCCCOC(=O)C m_7__22986886__2884962 [1,1,0,0,0,0|2,0,0]=4 1888 B11R0.148 CCNCCCCCCC(C)C m_270004__8288580__24715004 [1,1,0,0,0,0|1,0,1]=4 1889 B11R0.148 CCNCCSCCC=C(C)C m_7__22986872__12121616 [1,1,0,0,0,0|2,0,0]=4 1890 B11R0.148 CCOCCCSCC=C(C)C m_62__12201838__5730882 [1,1,0,0,0,0|2,0,0]=4 1891 B11R0.148 CCOCCCSCC=C(C)Cl m_7__22987520__12215356 [1,1,0,0,0,0|2,0,0]=4 1892 B11R0.148 CCOCCSCCC=C(C)C m_62__12121620__204256 [1,1,0,0,0,0|2,0,0]=4 1893 B11R0.148 CCSCCCCCNC(=O)C m_62__875846__13164566 [1,1,0,0,0,0|2,0,0]=4 1894 B11R0.148 CCSCCCCCOC(=O)C m_7__22987770__22787458 [1,1,0,0,0,0|2,0,0]=4 1895 B11R0.148 CCSCCNCCC=C(C)C m_270004__9277484__8765926 [1,1,0,0,0,0|2,0,0]=4 1896 B11R0.148 CCSCCSCCC=C(C)C m_7__8765656__12121616 [1,1,0,0,0,0|2,0,0]=4 1897 B11R0.148 CN(C)CCCSCC=CCO m_7__15765946__16809272 [1,1,0,0,0,0|2,0,0]=4 1898 B11R0.148 COCCCCCCNC(=O)C m_270062__21497420__15585492 [1,1,0,0,0,0|2,0,0]=4 1899 B11R0.148 COCCCCSCC=C(C)C m_62__12201838__10159086 [1,1,0,0,0,0|2,0,0]=4 1900 B11R0.148 COCCCCSCC=C(C)Cl m_7__22986808__12215356 [1,1,0,0,0,0|2,0,0]=4 1901 B11R0.148 COCCCNCCC=C(C)C m_270004__9277484__24710510 [1,1,0,0,0,0|2,0,0]=4 1902 B11R0.148 COCCCSCCC=C(C)C m_62__12121620__9108904 [1,1,0,0,0,0|2,0,0]=4 1903 B11R0.148 COCCNCCCC=C(C)C m_270004__8288600__16886698 [1,1,0,0,0,0|2,0,0]=4 1904 B11R0.148 CSCCCCCCNC(=O)C m_270062__16414636__15585492 [1,1,0,0,0,0|2,0,0]=4 1905 B11R0.148 CSCCCSCCC=C(C)C m_7__10890048__12121616 [1,1,0,0,0,0|2,0,0]=4 1906 B11R0.148 CSCCNCCCC=C(C)C m_270004__11963796__16886698 [1,1,0,0,0,0|2,0,0]=4 1907 B11R0.148 C[C@H](N)CSCCCCCCO m_7__20871336__6673274 [1,1,0,0,0,0|1,0,1]=4 1908 B11R0.148 OCC=CCSCCCC(F)F m_7__22986760__16809272 [1,1,0,0,0,0|2,0,0]=4 1909 B13R0.2 C/C=C/C(=O)NCCCCCCCC m_11__7793358__22136110 [0,2,0,0,0,0|1,0,1]=4 1910 B13R0.2 C=CC=CCCNCCC(C)CCC m_270004__12896186__24594192 [0,2,0,0,0,0|1,0,1]=4 1911 B13R0.2 C=CCC(=O)NCCCCCCCC m_22__7793362__16783972 [0,2,0,0,0,0|2,0,0]=4 1912 B13R0.2 CC(=CCO)CCCSCCCCN m_7__20871294__22787184 [0,2,0,0,0,0|1,0,0]=3 1913 B13R0.2 CC(=CCO)CCCSCCCCO m_7__22849690__22787184 [0,2,0,0,0,0|1,0,0]=3 1914 B13R0.2 CC(=CCO)CCCSCCCON m_7__22987730__22787184 [0,2,0,0,0,0|2,0,0]=4 1915 B13R0.2 CC(=CCO)CSCCNCCCN m_7__20871384__20765532 [0,2,0,0,0,0|2,0,0]=4 1916 B13R0.2 CC/C=C\CCCCCN(C)CCC m_270004__8134916__24594274 [0,2,0,0,0,0|1,0,0]=3 1917 B13R0.2 CC/C=C\CCCCCN(C)CCO m_270004__8127950__24594274 [0,2,0,0,0,0|2,0,0]=4 1918 B13R0.2 CC/C=C\CCCNCC(C)CCC m_270004__18902466__24594278 [0,2,0,0,0,0|1,0,0]=3 1919 B13R0.2 CC/C=C\CCCNCC(C)CCO m_270004__8297522__24594278 [0,2,0,0,0,0|2,0,0]=4 1920 B13R0.2 CC/C=C\CCCNCC(C)COC m_270004__8292074__24594278 [0,2,0,0,0,0|2,0,0]=4 1921 B13R0.2 CC/C=C\CCCNCC(F)COC m_270004__14051168__24594278 [0,2,0,0,0,0|2,0,0]=4 1922 B13R0.2 CC/C=C\CCCNC[C@H](O)COC m_270004__9876842__24594278 [0,2,0,0,0,0|2,0,0]=4 1923 B13R0.2 CC/C=C\CCCNC[C@H](O)CSC m_270004__24793750__24594278 [0,2,0,0,0,0|2,0,0]=4 1924 B13R0.2 CC=CC(=O)NCCCCCCCC m_273270__13675410__15281756 [0,2,0,0,0,0|1,0,1]=4 1925 B13R0.2 CCC#CCSCCCC(=CCO)C m_7__20984246__22787184 [0,2,0,0,0,0|0,0,2]=4 1926 B13R0.2 CCCC(C)CCCSCC#CCO m_62__12216606__15141012 [0,2,0,0,0,0|0,0,2]=4 1927 B13R0.2 CCCC(C)CCCSCCCCO m_7__22849690__12216600 [0,2,0,0,0,0|0,0,2]=4 1928 B13R0.2 CCCC(C)CCNCCC#CCO m_270004__21537562__24594192 [0,2,0,0,0,0|0,0,2]=4 1929 B13R0.2 CCCC(C)CCNCCCCCO m_270004__9456968__24594192 [0,2,0,0,0,0|0,0,2]=4 1930 B13R0.2 CCCC(C)CCNCCOCCO m_270004__8288648__24594192 [0,2,0,0,0,0|1,0,1]=4 1931 B13R0.2 CCCC(C)CCNCCSCCO m_270004__21508858__24594192 [0,2,0,0,0,0|1,0,1]=4 1932 B13R0.2 CCCC(C)CNCCCCCCO m_270004__8300498__8300564 [0,2,0,0,0,0|0,0,2]=4 1933 B13R0.2 CCCC(C)CNCCCOCCO m_270004__8602160__8300564 [0,2,0,0,0,0|1,0,1]=4 1934 B13R0.2 CCCC(C)CNCCCSCCO m_270004__23851182__8300564 [0,2,0,0,0,0|1,0,1]=4 1935 B13R0.2 CCCC(C)NCCCCCCCO m_2230__22397382__6174988 [0,2,0,0,0,0|0,0,2]=4 1936 B13R0.2 CCCC(C)SCCCCCCCO m_7__14428530__6174984 [0,2,0,0,0,0|0,0,2]=4 1937 B13R0.2 CCCC=CCCNCC(C)CCC m_270004__23849914__8300564 [0,2,0,0,0,0|2,0,0]=4 1938 B13R0.2 CCCCCCCCCC(=O)NCC m_22__57815__335744 [0,2,0,0,0,0|1,0,1]=4 1939 B13R0.2 CCCCCCCCCC(=O)NOC m_22__461212__335744 [0,2,0,0,0,0|1,0,1]=4 1940 B13R0.2 CCCCCCCCCC(=O)OCC m_1458__803710__1327610 [0,2,0,0,0,0|1,0,1]=4 1941 B13R0.2 CCCCCCCCCN(C)CCO m_2230__1182964__6165700 [0,2,0,0,0,0|0,0,2]=4 1942 B13R0.2 CCCCCCCCNC(=NCC)N m_264822__3499820__3499592 [0,2,0,0,0,0|2,0,0]=4 1943 B13R0.2 CCCCCCCCNC(=O)CC#N m_22__7793362__8794444 [0,2,0,0,0,0|2,0,0]=4 1944 B13R0.2 CCCCCCCCNC(=O)CCBr m_270062__9801310__20844442 [0,2,0,0,0,0|1,0,1]=4 1945 B13R0.2 CCCCCCCCNC(=O)CCC m_270062__9801310__17814498 [0,2,0,0,0,0|1,0,1]=4 1946 B13R0.2 CCCCCCCCNC(=O)CCN m_240690__21554314__3025680 [0,2,0,0,0,0|1,0,1]=4 1947 B13R0.2 CCCCCCCCNC(=O)CCO m_487__7793374__12879784 [0,2,0,0,0,0|0,0,1]=3 1948 B13R0.2 CCCCCCCCNC(=O)CNC m_240690__21554314__7368582 [0,2,0,0,0,0|2,0,0]=4 1949 B13R0.2 CCCCCCCCNC(=O)COC m_270062__9801310__15529360 [0,2,0,0,0,0|1,0,0]=3 1950 B13R0.2 CCCCCCCCNC(=O)CON m_240690__21554314__13151248 [0,2,0,0,0,0|1,0,0]=3 1951 B13R0.2 CCCCCCCCNC(=O)CSC m_527__7793380__237535 [0,2,0,0,0,0|1,1,0]=4 1952 B13R0.2 CCCCCCCCNC(=O)NCC m_2554__7793394__951600 [0,2,0,0,0,0|2,0,0]=4 1953 B13R0.2 CCCCCCCCNC(=O)NOC m_68__20639500__21690954 [0,2,0,0,0,0|2,0,0]=4 1954 B13R0.2 CCCCCCCCNC(=O)OCC m_282070__22211040__22150950 [0,2,0,0,0,0|2,0,0]=4 1955 B13R0.2 CCCCCCCCNC(=S)NCC m_8__7793356__83696 [0,2,0,0,0,0|2,0,0]=4 1956 B13R0.2 CCCCCCCCNC(C)CCO m_2230__22400640__9282126 [0,2,0,0,0,0|0,0,2]=4 1957 B13R0.2 CCCCCCCCNC(C)COC m_270004__8288906__8844972 [0,2,0,0,0,0|1,0,1]=4 1958 B13R0.2 CCCCCCCCN[C@H](C)COC m_2230__22399844__9282126 [0,2,0,0,0,0|1,0,1]=4 1959 B13R0.2 CCCCCCCCOC(=O)CCC m_276436__14076610__14088342 [0,2,0,0,0,0|1,0,1]=4 1960 B13R0.2 CCCCCCCCOC(=O)CCF m_276436__14076610__14107760 [0,2,0,0,0,0|1,0,1]=4 1961 B13R0.2 CCCCCCCCOC(=O)COC m_1458__473580__9282120 [0,2,0,0,0,0|1,0,0]=3 1962 B13R0.2 CCCCCCCCSC(C)CCO m_7__5819074__9282116 [0,2,0,0,0,0|0,0,2]=4 1963 B13R0.2 CCCCCCCCSC(C)COC m_62__6339274__9282118 [0,2,0,0,0,0|1,0,1]=4 1964 B13R0.2 CCCCCCCNCC(=O)NCC m_270004__11974938__24715022 [0,2,0,0,0,0|2,0,0]=4 1965 B13R0.2 CCCCCCCNCC(=O)OCC m_270004__8288904__8957134 [0,2,0,0,0,0|2,0,0]=4 1966 B13R0.2 CCCCCCCNCC(C)CCO m_270004__8297522__24715022 [0,2,0,0,0,0|0,0,2]=4 1967 B13R0.2 CCCCCCCON=C(N)CCO m_34__8845210__7284630 [0,2,0,0,0,0|1,0,1]=4 1968 B13R0.2 CCCCCCCSCC(=O)OCC m_7__27132__7284628 [0,2,0,0,0,0|2,0,0]=4 1969 B13R0.2 CCCCCCNCCC(=O)NCC m_270004__16735704__24715030 [0,2,0,0,0,0|2,0,0]=4 1970 B13R0.2 CCCCCCNCCC(=O)OCC m_270004__24792010__24715030 [0,2,0,0,0,0|2,0,0]=4 1971 B13R0.2 CCCCCCNCCC(C)CCO m_270004__10641330__24715030 [0,2,0,0,0,0|0,0,2]=4 1972 B13R0.2 CCCCCCNCCN(C)CCO m_270004__16913928__24715030 [0,2,0,0,0,0|1,0,1]=4 1973 B13R0.2 CCCCCCSCC=C(C)COC m_62__8854732__13443010 [0,2,0,0,0,0|1,0,0]=3 1974 B13R0.2 CCCCCCSCCC(=O)OCC m_7__12427120__846538 [0,2,0,0,0,0|2,0,0]=4 1975 B13R0.2 CCCCCSCCCC(=CCO)C m_7__8271838__22787184 [0,2,0,0,0,0|0,0,0]=2 1976 B13R0.2 CCCCCSCCCC(=O)OCC m_7__8271838__924718 [0,2,0,0,0,0|2,0,0]=4 1977 B13R0.2 CCCCCSCCNC(=O)COC m_7__8271838__22787786 [0,2,0,0,0,0|2,0,0]=4 1978 B13R0.2 CCCCCSCCOC(=O)COC m_1458__473580__15748366 [0,2,0,0,0,0|2,0,0]=4 1979 B13R0.2 CCCCNCCCCC(=O)OCC m_270004__8289202__24721568 [0,2,0,0,0,0|2,0,0]=4 1980 B13R0.2 CCCCOCCCNC(=O)CCO m_487__150758__12879784 [0,2,0,0,0,0|1,0,1]=4 1981 B13R0.2 CCCCOCCCNC(=O)COC m_270062__7595124__15529360 [0,2,0,0,0,0|2,0,0]=4 1982 B13R0.2 CCCCOCCCNC(=O)CON m_240690__7351216__13151248 [0,2,0,0,0,0|2,0,0]=4 1983 B13R0.2 CCCCOCCSCC(=CCO)C m_7__22987848__20765532 [0,2,0,0,0,0|1,0,0]=3 1984 B13R0.2 CCCN(C)CCCCCCCCO m_2230__2261920__22384170 [0,2,0,0,0,0|0,0,2]=4 1985 B13R0.2 CCCOCCSCC=C(C)COC m_62__13443008__15503588 [0,2,0,0,0,0|2,0,0]=4 1986 B13R0.2 CCCSCCCCCC(=O)OCC m_62__875778__5063380 [0,2,0,0,0,0|2,0,0]=4 1987 B13R0.2 CCNC(=O)CCCCCCCCN m_240690__7350950__18358874 [0,2,0,0,0,0|2,0,0]=4 1988 B13R0.2 CCNC(=O)CCCCCCCSC m_22__57815__18053892 [0,2,0,0,0,0|2,0,0]=4 1989 B13R0.2 CCNCCCCCCC(=O)OCC m_270004__24335978__24715004 [0,2,0,0,0,0|2,0,0]=4 1990 B13R0.2 CCNCCSCCCC(=CCO)C m_7__22986872__22787184 [0,2,0,0,0,0|1,0,0]=3 1991 B13R0.2 CCOC(=O)CCCCCCCSC m_1458__18053896__1327610 [0,2,0,0,0,0|2,0,0]=4 1992 B13R0.2 CCOC(=O)CCCCCCSCC m_7__22987770__20871656 [0,2,0,0,0,0|2,0,0]=4 1993 B13R0.2 CCOC(=O)CCCSCC=CCO m_7__22987394__16809272 [0,2,0,0,0,0|1,0,1]=4 1994 B13R0.2 CCOCCCCSCC(=CCO)C m_7__22987402__20765532 [0,2,0,0,0,0|1,0,0]=3 1995 B13R0.2 CCOCCCSCC=C(C)COC m_62__5730880__13443010 [0,2,0,0,0,0|2,0,0]=4 1996 B13R0.2 CCSCCSCCCC(=CCO)C m_7__8765656__22787184 [0,2,0,0,0,0|1,0,0]=3 1997 B13R0.2 CN(CCO)CCCCCCCCO m_2230__679202__22384170 [0,2,0,0,0,0|1,0,1]=4 1998 B13R0.2 COCC(=CCSCCCCCF)C m_62__13443008__9984634 [0,2,0,0,0,0|2,0,0]=4 1999 B13R0.2 COCC(=CCSCCCCCN)C m_34__20871474__13443004 [0,2,0,0,0,0|2,0,0]=4 2000 B13R0.2 COCC(=O)NCCCCCCCO m_270062__16413930__15529360 [0,2,0,0,0,0|2,0,0]=4 2001 B13R0.2 COCC(=O)NCCCCCCSC m_270062__16414636__15529360 [0,2,0,0,0,0|2,0,0]=4 2002 B13R0.2 COCCCCCCNC(=O)CCO m_487__21497390__12879784 [0,2,0,0,0,0|1,0,1]=4 2003 B13R0.2 COCCCCCCNC(=O)COC m_270062__21497420__15529360 [0,2,0,0,0,0|2,0,0]=4 2004 B13R0.2 COCCCCCCNC(=O)CON m_240690__21495460__13151248 [0,2,0,0,0,0|2,0,0]=4 2005 B13R0.2 COCCCCCSCC(=CCO)C m_7__22987588__20765532 [0,2,0,0,0,0|1,0,0]=3 2006 B13R0.2 COCCCCSCC=C(C)COC m_62__13443008__10159086 [0,2,0,0,0,0|2,0,0]=4 2007 B13R0.2 COCCCSCCCC(=CCO)C m_7__17626136__22787184 [0,2,0,0,0,0|1,0,0]=3 2008 B13R0.2 COCCOCCSCC(=CCO)C m_7__13607890__20765532 [0,2,0,0,0,0|2,0,0]=4 2009 B13R0.2 CSCCCCCCNC(=O)CCO m_487__8686118__12879784 [0,2,0,0,0,0|1,0,1]=4 2010 B13R0.2 CSCCCCCCNC(=O)CON m_240690__21581056__13151248 [0,2,0,0,0,0|2,0,0]=4 2011 B13R0.2 CSCCCSCCCC(=CCO)C m_7__10890048__22787184 [0,2,0,0,0,0|1,0,0]=3 2012 B13R0.2 NOCC(=O)NCCCCCCCO m_240690__21559754__13151248 [0,2,0,0,0,0|2,0,0]=4 2013 B13R0.2 O=C(CCO)NCCCCCCCO m_487__13810896__12879784 [0,2,0,0,0,0|1,0,1]=4 2014 B13R0.66 C#CCNC(=O)CCCCCCCC m_527__154469__336048 [0,2,0,0,0,0|2,0,0]=4 2015 B13R0.66 C#CCOC(=O)CCCCCCCC m_276436__14076544__14088344 [0,2,0,0,0,0|2,0,0]=4 2016 B13R0.66 C=CC=CCCNCC(C)CCCC m_270004__12896186__24715008 [0,2,0,0,0,0|1,0,1]=4 2017 B13R0.66 C=CCNC(=O)CCCCCCCC m_527__154357__336048 [0,2,0,0,0,0|2,0,0]=4 2018 B13R0.66 C=CCOC(=O)CCCCCCCC m_1458__803704__489874 [0,2,0,0,0,0|2,0,0]=4 2019 B13R0.66 CC/C=C\CCCNC(C)CCCC m_270004__15565488__24594278 [0,2,0,0,0,0|1,0,0]=3 2020 B13R0.66 CC/C=C\CCCNC(C)CCCO m_270004__8299056__24594278 [0,2,0,0,0,0|2,0,0]=4 2021 B13R0.66 CC/C=C\CCCNC(C)CCOC m_270004__8292830__24594278 [0,2,0,0,0,0|2,0,0]=4 2022 B13R0.66 CC/C=C\CCCNC(C)CCSC m_270004__8296848__24594278 [0,2,0,0,0,0|2,0,0]=4 2023 B13R0.66 CC/C=C\CCCNC(C)COCC m_270004__8294960__24594278 [0,2,0,0,0,0|2,0,0]=4 2024 B13R0.66 CC/C=C\CCCOC(=O)CCCC m_276436__20064276__14088340 [0,2,0,0,0,0|1,0,1]=4 2025 B13R0.66 CCC=CC(=O)NCCCCCCC m_22__12209930__12103034 [0,2,0,0,0,0|1,0,1]=4 2026 B13R0.66 CCC=CC(=O)OCCCCCCC m_276436__14076620__14096172 [0,2,0,0,0,0|1,0,1]=4 2027 B13R0.66 CCCC=CCCNC(C)CCCC m_2230__22399858__7875332 [0,2,0,0,0,0|2,0,0]=4 2028 B13R0.66 CCCCC(C)CNCCC#CCO m_270004__21537562__24715008 [0,2,0,0,0,0|0,0,2]=4 2029 B13R0.66 CCCCC(C)CNCCCCCO m_270004__9456968__24715008 [0,2,0,0,0,0|0,0,2]=4 2030 B13R0.66 CCCCC(C)CNCCOCCO m_270004__8288648__24715008 [0,2,0,0,0,0|1,0,1]=4 2031 B13R0.66 CCCCC(C)CNCCSCCO m_270004__21508858__24715008 [0,2,0,0,0,0|1,0,1]=4 2032 B13R0.66 CCCCC(C)NCCCCCCO m_2230__22399858__13038782 [0,2,0,0,0,0|0,0,2]=4 2033 B13R0.66 CCCCC(C)NCCCOCCO m_269862__8602158__7200136 [0,2,0,0,0,0|1,0,1]=4 2034 B13R0.66 CCCCC(C)NCCCSCCO m_270004__23851182__8844922 [0,2,0,0,0,0|1,0,1]=4 2035 B13R0.66 CCCCCCCCC(=O)NCCC m_527__154065__336048 [0,2,0,0,0,0|1,0,1]=4 2036 B13R0.66 CCCCCCCCC(=O)NCCF m_1626__22055678__512782 [0,2,0,0,0,0|1,0,1]=4 2037 B13R0.66 CCCCCCCCC(=O)NCCN m_270006__11615266__8408884 [0,2,0,0,0,0|1,0,1]=4 2038 B13R0.66 CCCCCCCCC(=O)NCCO m_527__154483__336048 [0,2,0,0,0,0|0,0,1]=3 2039 B13R0.66 CCCCCCCCC(=O)NNCC m_240690__21583724__7404582 [0,2,0,0,0,0|2,0,0]=4 2040 B13R0.66 CCCCCCCCC(=O)NOCC m_22__303688__335740 [0,2,0,0,0,0|2,0,0]=4 2041 B13R0.66 CCCCCCCCC(=O)OCC#N m_1458__803704__483934 [0,2,0,0,0,0|2,0,0]=4 2042 B13R0.66 CCCCCCCCC(=O)OCCC m_276436__14076550__14088344 [0,2,0,0,0,0|1,0,1]=4 2043 B13R0.66 CCCCCCCCC(=O)OCCF m_276436__14078274__14088344 [0,2,0,0,0,0|1,0,1]=4 2044 B13R0.66 CCCCCCCCC(=O)OCCO m_1458__803704__485506 [0,2,0,0,0,0|0,0,1]=3 2045 B13R0.66 CCCCCCCCC(=O)OCOC m_1458__803704__484704 [0,2,0,0,0,0|1,0,0]=3 2046 B13R0.66 CCCCCCCCC(C)NCCO m_270004__8349608__24709372 [0,2,0,0,0,0|0,0,2]=4 2047 B13R0.66 CCCCCCCCN(C)CCCO m_2230__18340798__680950 [0,2,0,0,0,0|0,0,2]=4 2048 B13R0.66 CCCCCCCCN(C)CCOC m_2230__18340798__666874 [0,2,0,0,0,0|1,0,1]=4 2049 B13R0.66 CCCCCCCNC(=O)/C=C/CF m_11__12209926__22137828 [0,2,0,0,0,0|1,0,1]=4 2050 B13R0.66 CCCCCCCNC(=O)/C=C/CN m_240690__12226084__16887350 [0,2,0,0,0,0|1,0,1]=4 2051 B13R0.66 CCCCCCCNC(=O)C=CCO m_22__12209930__13570734 [0,2,0,0,0,0|0,0,1]=3 2052 B13R0.66 CCCCCCCNC(=O)C=NOC m_527__12209944__9864668 [0,2,0,0,0,0|2,0,0]=4 2053 B13R0.66 CCCCCCCNC(=O)CCNO m_240690__12226084__21394576 [0,2,0,0,0,0|1,0,1]=4 2054 B13R0.66 CCCCCCCNC(=O)CCOC m_527__12209944__2909592 [0,2,0,0,0,0|1,0,1]=4 2055 B13R0.66 CCCCCCCNC(=O)NCCO m_2708__12209956__908988 [0,2,0,0,0,0|1,0,1]=4 2056 B13R0.66 CCCCCCCNC(C)CCCO m_2230__22399382__7284644 [0,2,0,0,0,0|0,0,2]=4 2057 B13R0.66 CCCCCCCOC(=O)CCOC m_1458__2909598__7284638 [0,2,0,0,0,0|1,0,1]=4 2058 B13R0.66 CCCCCCCSC(C)CCCO m_7__22988038__7284628 [0,2,0,0,0,0|0,0,2]=4 2059 B13R0.66 CCCCCCNCC(C)CCCO m_270004__10686648__24715030 [0,2,0,0,0,0|0,0,2]=4 2060 B13R0.66 CCCCCCNCC(C)OCCO m_270004__23831956__24715030 [0,2,0,0,0,0|1,0,1]=4 2061 B13R0.66 CCCCCSCCC(=O)NCCO m_7__8271838__22787884 [0,2,0,0,0,0|1,0,1]=4 2062 B13R0.66 CCCCN(C)CCCCCCCO m_2230__665312__6174988 [0,2,0,0,0,0|0,0,2]=4 2063 B13R0.66 CCCCOCCNC(=O)C=CCO m_22__2163352__13570734 [0,2,0,0,0,0|1,0,1]=4 2064 B13R0.66 CCOCCCCCC(=O)NCCO m_527__154483__12623514 [0,2,0,0,0,0|1,0,1]=4 2065 B13R0.66 CCOCCCCCC(=O)OCCO m_1458__12623516__485506 [0,2,0,0,0,0|1,0,1]=4 2066 B13R0.66 CCOCCCCCC(=O)OCOC m_1458__12623516__484704 [0,2,0,0,0,0|2,0,0]=4 2067 B13R0.66 CCOCCCCNC(=O)C=CCO m_22__1000086__13570734 [0,2,0,0,0,0|1,0,1]=4 2068 B13R0.66 COCCCCCNC(=O)C=CCO m_22__23072890__13570734 [0,2,0,0,0,0|1,0,1]=4 2069 B13R0.66 COCOC(=O)CCCCCCSC m_1458__12298724__484704 [0,2,0,0,0,0|2,0,0]=4 2070 B13R0.66 CSCCCCCCC(=O)NCCO m_527__154483__12298722 [0,2,0,0,0,0|1,0,1]=4 2071 B13R0.66 CSCCCCCCC(=O)OCCO m_1458__12298724__485506 [0,2,0,0,0,0|1,0,1]=4 2072 B13R0.66 CSCCCCCNC(=O)C=CCO m_22__8992110__13570734 [0,2,0,0,0,0|1,0,1]=4 2073 B13R0.66 NCCCCCCCC(=O)NCCO m_240690__14577196__18318972 [0,2,0,0,0,0|1,0,1]=4 2074 B13R0.66 NCCCCCCNC(=O)C=CCO m_240690__11579040__17667664 [0,2,0,0,0,0|1,0,1]=4 2075 B13R0.66 O=C(C=CCO)NCCCCCCF m_22__23073300__13570734 [0,2,0,0,0,0|1,0,1]=4 2076 B13R0.66 O=C(C=CCO)NCCCCCCO m_22__8282992__13570734 [0,2,0,0,0,0|1,0,1]=4 2077 B13R0.87 C=C(CO)CCNCCC(C)CCC m_270004__17763614__24594192 [0,2,0,0,0,0|1,0,1]=4 2078 B13R0.87 CC(=CCO)CCCSCC(C)CO m_7__6078536__22787184 [0,2,0,0,0,0|2,0,0]=4 2079 B13R0.87 CC(=CCO)CCCSCC(O)CO m_7__6554250__22787184 [0,2,0,0,0,0|2,0,0]=4 2080 B13R0.87 CCC(C)CSCCCC(=CCO)C m_7__7022538__22787184 [0,2,0,0,0,0|1,0,0]=3 2081 B13R0.87 CCC(O)CSCCCC(=CCO)C m_7__22988104__22787184 [0,2,0,0,0,0|1,0,0]=3 2082 B13R0.87 CCCC(C)CCCONC(=N)CO m_34__11944490__12216602 [0,2,0,0,0,0|2,0,0]=4 2083 B13R0.87 CCCC(C)CNCCNC(=O)CO m_270004__24793754__8300564 [0,2,0,0,0,0|2,0,0]=4 2084 B13R0.87 CC[C@H](N)CSCCCC(=CCO)C m_7__20871354__22787184 [0,2,0,0,0,0|1,0,0]=3 2085 B13R0.87 COC(C)CSCCCC(=CCO)C m_7__22986820__22787184 [0,2,0,0,0,0|2,0,0]=4 2086 B13R0.88 CC(=CCO)CCCSCCC(C)C m_7__22987856__22787184 [0,2,0,0,0,0|1,0,0]=3 2087 B13R0.88 CC(=CCO)CCCSCCC(C)N m_7__20871360__22787184 [0,2,0,0,0,0|1,0,0]=3 2088 B13R0.88 CC(=CCO)CCCSCCC(F)F m_7__22986868__22787184 [0,2,0,0,0,0|2,0,0]=4 2089 B13R0.88 CC(=CCO)CCCSCCN(C)C m_7__6950568__22787184 [0,2,0,0,0,0|2,0,0]=4 2090 B13R0.88 CC(=CCO)CSCCOCC(C)C m_7__22987970__20765532 [0,2,0,0,0,0|2,0,0]=4 2091 B13R0.88 CC(C)CCCCCNC(=O)CCO m_487__21496952__12879784 [0,2,0,0,0,0|1,0,1]=4 2092 B13R0.88 CCNC(=O)CCCCCCC(C)C m_22__57815__24594542 [0,2,0,0,0,0|2,0,0]=4 2093 B13R0.175 CC(=CCO)CCCN(C)CCCF m_2230__13040470__22383944 [0,2,0,0,0,0|2,0,0]=4 2094 B13R0.175 CC(=CCO)CCCN(C)CCCN m_269982__11965286__22488566 [0,2,0,0,0,0|2,0,0]=4 2095 B13R0.175 CC(=CCO)CCCN(C)CCCO m_2230__9787816__22383944 [0,2,0,0,0,0|2,0,0]=4 2096 B13R0.175 CCCC(C)CCCC(C)NCCO m_269862__7193048__12297092 [0,2,0,0,0,0|1,0,1]=4 2097 B13R0.175 CCCC(C)CCNC(=O)C=CCO m_22__12895386__13570734 [0,2,0,0,0,0|1,0,1]=4 2098 B13R0.175 CCCC(O)CCNC(=O)C=CCO m_22__13214974__13570734 [0,2,0,0,0,0|1,0,1]=4 2099 B13R0.175 CCCCN(C)CCCC(=CCO)C m_2230__665312__22383944 [0,2,0,0,0,0|1,0,0]=3 2100 B13R0.175 CNCCN(C)CCCC(=CCO)C m_269982__10880304__22488566 [0,2,0,0,0,0|2,0,0]=4 2101 B13R0.175 COCCN(C)CCCC(=CCO)C m_2230__2013888__22383944 [0,2,0,0,0,0|2,0,0]=4 2102 B13R0.175 CSCCN(C)CCCC(=CCO)C m_2230__7207368__22383944 [0,2,0,0,0,0|2,0,0]=4 2103 B13R0.193 CC(=CCO)CNC(C)CCCCN m_269982__22505242__22498250 [0,2,0,0,0,0|2,0,0]=4 2104 B13R0.193 CC(=CCO)CNC(C)CCCCO m_2230__22399050__20765536 [0,2,0,0,0,0|2,0,0]=4 2105 B13R0.193 CC/C=C(\C)/CNC(C)CCCCC m_270004__24045486__8844946 [0,2,0,0,0,0|2,0,0]=4 2106 B13R0.193 CCCCCC(=O)OCC(=CCO)C m_1458__473132__20765534 [0,2,0,0,0,0|1,0,1]=4 2107 B13R0.193 CCCCCC(O)CNC(=O)CCO m_487__14785454__12879784 [0,2,0,0,0,0|1,0,1]=4 2108 B13R0.193 CCSCCC(C)NCC(=CCO)C m_2230__22399618__20765536 [0,2,0,0,0,0|2,0,0]=4 2109 B13R0.275 CC/C=C\CCCN(C)C(C)CCC m_270004__8132922__24594278 [0,2,0,0,0,0|2,0,0]=4 2110 B13R0.275 CCC=CCCNC(C)C(C)CCC m_2230__22398864__8859726 [0,2,0,0,0,0|2,0,0]=4 2111 B13R0.275 CCCCCCCC(F)C(=O)NCC m_22__57815__24596518 [0,2,0,0,0,0|2,0,0]=4 2112 B13R0.275 CCCCCCNC(=O)C(=CCO)C m_22__303720__25074292 [0,2,0,0,0,0|1,0,1]=4 2113 B13R0.282 CC/C=C\CCCNC(C#N)CCC m_270004__24165598__24594278 [0,2,0,0,0,0|2,0,0]=4 2114 B13R0.282 CC/C=C\CCCNC(CC)CCC m_270004__8295044__24594278 [0,2,0,0,0,0|2,0,0]=4 2115 B13R0.282 CC/C=C\CCCNC(CO)CCC m_270004__18319878__24594278 [0,2,0,0,0,0|2,0,0]=4 2116 B13R0.282 CCC=CCCSCC(CCC)OC m_7__22987644__8859716 [0,2,0,0,0,0|2,0,0]=4 2117 B13R0.282 CCCCCCCCN(CC)CCO m_2230__3225026__9282126 [0,2,0,0,0,0|1,0,1]=4 2118 B13R0.282 CCCCCCCCN(CCO)OC m_2230__9111768__9282126 [0,2,0,0,0,0|1,0,1]=4 2119 B13R0.330 CC(=CCO)CN(C)CCCCCN m_269982__17757614__22498250 [0,2,0,0,0,0|2,0,0]=4 2120 B13R0.330 CC(=CCO)CN(C)CCCCCO m_2230__9449864__20765536 [0,2,0,0,0,0|2,0,0]=4 2121 B13R0.330 CCC=CCCC(C)NC(C)CCC m_269862__8257236__17320678 [0,2,0,0,0,0|2,0,0]=4 2122 B13R0.330 CCC=CCCN(C)CC(C)CCC m_2230__14478600__8859726 [0,2,0,0,0,0|2,0,0]=4 2123 B13R0.330 CCC=CCCN(C)CC(O)CCC m_2230__17660948__8859726 [0,2,0,0,0,0|2,0,0]=4 2124 B13R0.330 CCCC(C)CC(=O)NCC=CCO m_527__11971536__2443152 [0,2,0,0,0,0|1,0,1]=4 2125 B13R0.330 CCCC(C)CC(=O)OCC=CCO m_1458__2444070__16809274 [0,2,0,0,0,0|1,0,1]=4 2126 B13R0.330 CCCC(C)CC(C)NCC=CCO m_270004__11971554__24709350 [0,2,0,0,0,0|1,0,0]=3 2127 B13R0.330 CCCC(O)CC(=O)NCC=CCO m_22__11971526__7658070 [0,2,0,0,0,0|1,0,1]=4 2128 B13R0.330 CCCC(O)CC(=O)OCC=CCO m_1458__5054150__16809274 [0,2,0,0,0,0|1,0,1]=4 2129 B13R0.330 CCCCCCC(C)CC(=O)NCC m_22__57815__3020686 [0,2,0,0,0,0|2,0,0]=4 2130 B13R0.330 CCCCCCC(C)CC(=O)OCC m_1458__3020692__1327610 [0,2,0,0,0,0|2,0,0]=4 2131 B13R0.330 CCCCCCC(C)NC(=O)CCO m_487__308624__12879784 [0,2,0,0,0,0|1,0,1]=4 2132 B13R0.330 CCCCCCC(O)CN(C)CCO m_2230__679202__9322382 [0,2,0,0,0,0|1,0,1]=4 2133 B13R0.330 CCCCCCN(C)CC(=CCO)C m_2230__22406770__20765536 [0,2,0,0,0,0|1,0,0]=3 2134 B13R0.330 CCC[C@@H](N)CC(=O)NCC=CCO m_240690__11979432__13574274 [0,2,0,0,0,0|1,0,1]=4 2135 B13R0.330 CCC[C@H](O)CC(=O)NCC=CCO m_22__11971526__24596580 [0,2,0,0,0,0|1,0,1]=4 2136 B13R0.330 CCOCCCN(C)CC(=CCO)C m_2230__22406790__20765536 [0,2,0,0,0,0|2,0,0]=4 2137 B13R0.330 CNCCCCN(C)CC(=CCO)C m_269982__13951086__22498250 [0,2,0,0,0,0|2,0,0]=4 2138 B13R0.330 COCCCCN(C)CC(=CCO)C m_2230__11246776__20765536 [0,2,0,0,0,0|2,0,0]=4 2139 B13R0.335 CC/C=C\CCCNC(C)CC(C)C m_270004__8299180__24594278 [0,2,0,0,0,0|2,0,0]=4 2140 B13R0.335 CC/C=C\CCCNC(C)CC(C)O m_270004__8644134__24594278 [0,2,0,0,0,0|2,0,0]=4 2141 B13R0.335 CCC=CCCSCC(C)CC(C)C m_62__9746872__8859722 [0,2,0,0,0,0|2,0,0]=4 2142 B13R0.335 CCC=CCCSC[C@H](N)CC(C)C m_7__20871394__8859716 [0,2,0,0,0,0|2,0,0]=4 2143 B13R0.335 CCCCCCCCC(=O)NC(C)C m_1626__513594__512782 [0,2,0,0,0,0|2,0,0]=4 2144 B13R0.335 CCCCCCCCC(=O)OC(C)C m_276436__14076930__14088344 [0,2,0,0,0,0|2,0,0]=4 2145 B13R0.335 CCCCCCCCN(C)CC(C)O m_2230__18340798__9736146 [0,2,0,0,0,0|1,0,1]=4 2146 B13R0.335 CCCCCCCNC(=O)CC(C)O m_487__12209942__23862482 [0,2,0,0,0,0|1,0,1]=4 2147 B13R0.335 CCCCCCCOC(=O)C[C@@H](C)O m_1458__21596576__7284638 [0,2,0,0,0,0|1,0,1]=4 2148 B13R0.340 C=C(CC)C(=O)NCCCCCCC m_273270__13687270__21397238 [0,2,0,0,0,0|2,0,0]=4 2149 B13R0.340 C=C(CO)C(=O)NCCCCCCC m_22__12209930__9436058 [0,2,0,0,0,0|1,0,0]=3 2150 B13R0.340 C=C(CO)C(=O)NCCCCCCF m_22__23073300__9436058 [0,2,0,0,0,0|2,0,0]=4 2151 B13R0.340 C=C(CO)C(=O)NCCCCCCO m_22__8282992__9436058 [0,2,0,0,0,0|2,0,0]=4 2152 B13R0.340 C=C(CO)C(=O)NCCCCCOC m_22__23072890__9436058 [0,2,0,0,0,0|2,0,0]=4 2153 B13R0.340 C=C(CO)C(=O)NCCCCCSC m_22__8992110__9436058 [0,2,0,0,0,0|2,0,0]=4 2154 B13R0.340 C=C(CO)C(=O)NCCCCOCC m_22__1000086__9436058 [0,2,0,0,0,0|2,0,0]=4 2155 B13R0.340 C=C(CO)C(=O)NCCOCCCC m_22__2163352__9436058 [0,2,0,0,0,0|2,0,0]=4 2156 B13R0.340 CC/C=C\CCCNC(C)C(C)CC m_270004__8296806__24594278 [0,2,0,0,0,0|2,0,0]=4 2157 B13R0.340 CC/C=C\CCCNC(C)C(O)CC m_270004__13583966__24594278 [0,2,0,0,0,0|2,0,0]=4 2158 B13R0.340 CCCCCCCCC(=O)N(C)CC m_1626__22018992__512782 [0,2,0,0,0,0|2,0,0]=4 2159 B13R0.340 CCCCCCCCC(C)C(=O)NO m_527__388132__12121044 [0,2,0,0,0,0|1,0,1]=4 2160 B13R0.340 CCCCCCCCN(C)C(=O)CC m_270062__18340812__22005658 [0,2,0,0,0,0|2,0,0]=4 2161 B13R0.340 CCCCCCCCN(C)C(=O)CN m_240690__18340860__3025698 [0,2,0,0,0,0|2,0,0]=4 2162 B13R0.340 CCCCCCCCN(C)C(=O)CO m_22__18340784__7941800 [0,2,0,0,0,0|1,0,0]=3 2163 B13R0.340 CCCCCCCCN(C)C(C)CO m_2230__7785428__9282126 [0,2,0,0,0,0|1,0,1]=4 2164 B13R0.340 CCCCCCCNC(=O)C(C)CO m_22__12209930__16784146 [0,2,0,0,0,0|1,0,1]=4 2165 B13R0.340 CCCCCCCNC(=O)C(N)CO m_240690__12226084__12887534 [0,2,0,0,0,0|1,0,1]=4 2166 B13R0.340 CCCCCCCNC(=O)[C@H](N)CO m_240690__12226084__12297580 [0,2,0,0,0,0|1,0,1]=4 2167 B13R0.340 CN(CCCCCCCO)C(=O)CO m_22__24036272__7941800 [0,2,0,0,0,0|2,0,0]=4 2168 B13R0.367 CC(=CCO)CCCNC(C)CCN m_269982__22505446__22488566 [0,2,0,0,0,0|2,0,0]=4 2169 B13R0.367 CC(=CCO)CCCNC(C)CCO m_2230__22400640__22383944 [0,2,0,0,0,0|2,0,0]=4 2170 B13R0.367 CC(=CCO)CCCN[C@H](C)CCF m_2230__22404666__22383944 [0,2,0,0,0,0|2,0,0]=4 2171 B13R0.367 CC(=CCO)CCCSC(C)CCO m_7__5819074__22787184 [0,2,0,0,0,0|2,0,0]=4 2172 B13R0.367 CCCC(C)NCCCC(=CCO)C m_2230__22397382__22383944 [0,2,0,0,0,0|1,0,0]=3 2173 B13R0.367 CCCC(C)SCCCC(=CCO)C m_7__14428530__22787184 [0,2,0,0,0,0|1,0,0]=3 2174 B13R0.367 CNCC(C)NCCCC(=CCO)C m_269982__22505308__22488566 [0,2,0,0,0,0|2,0,0]=4 2175 B13R0.367 COCC(C)SCCCC(=CCO)C m_7__22987942__22787184 [0,2,0,0,0,0|2,0,0]=4 2176 B13R0.367 COC[C@@H](C)NCCCC(=CCO)C m_2230__22399844__22383944 [0,2,0,0,0,0|2,0,0]=4 2177 B13R0.367 CSCC(C)NCCCC(=CCO)C m_2230__22400632__22383944 [0,2,0,0,0,0|2,0,0]=4 2178 B13R0.1338 CC/C=C\CCCNC(C)(C)CCC m_270004__8293954__24594278 [0,2,0,0,0,0|2,0,0]=4 2179 B13R0.1338 CCCCCCCCS(=O)(=O)CCO m_2714__6283136__9282128 [0,2,0,0,0,0|1,0,1]=4 2180 B13R0.54 C=C(C)CCCNCCC/C=C\CC m_270004__21497356__24594278 [0,2,0,0,0,0|1,0,1]=4 2181 B13R0.54 C=CC=CCCNCCCCC(C)C m_270004__12896186__12202092 [0,2,0,0,0,0|1,0,1]=4 2182 B13R0.54 CC(C)CCCCNCCC#CCO m_270004__21537562__12202092 [0,2,0,0,0,0|0,0,2]=4 2183 B13R0.54 CC(C)CCCCNCCCCCO m_270004__9456968__12202092 [0,2,0,0,0,0|0,0,2]=4 2184 B13R0.54 CC(C)CCCCNCCOCCO m_270004__8288648__12202092 [0,2,0,0,0,0|1,0,1]=4 2185 B13R0.54 CC(C)CCCCNCCSCCO m_270004__21508858__12202092 [0,2,0,0,0,0|1,0,1]=4 2186 B13R0.54 CC(C)CCCNCCCCCCO m_207__8282998__7912414 [0,2,0,0,0,0|0,0,2]=4 2187 B13R0.54 CC(C)CCCNCCCOCCO m_207__8602132__7912414 [0,2,0,0,0,0|1,0,1]=4 2188 B13R0.54 CC(C)CCCNCCCSCCO m_270004__23851182__9139706 [0,2,0,0,0,0|1,0,1]=4 2189 B13R0.54 CC(C)CCCSCCCCCCO m_7__8333108__6673274 [0,2,0,0,0,0|0,0,2]=4 2190 B13R0.54 CC(C)CCNCCCCCCCO m_207__13810894__134014 [0,2,0,0,0,0|0,0,2]=4 2191 B13R0.54 CC(C)CCSCCCCCCCO m_7__22987856__6174984 [0,2,0,0,0,0|0,0,2]=4 2192 B13R0.54 CC(C)CNCCCCCCCCO m_207__21500804__121216 [0,2,0,0,0,0|0,0,2]=4 2193 B13R0.54 CC(C)CSCCCCCCCCO m_7__27301__22787460 [0,2,0,0,0,0|0,0,2]=4 2194 B13R0.54 CC(N)CCSCCCCCCCO m_7__20871360__6174984 [0,2,0,0,0,0|0,0,2]=4 2195 B13R0.54 CC(O)CNCCCCCCCCO m_273610__21500840__11516404 [0,2,0,0,0,0|0,0,2]=4 2196 B13R0.54 CC(O)CSCCCCCCCCO m_7__10953796__22787460 [0,2,0,0,0,0|0,0,2]=4 2197 B13R0.54 CC/C=C\CCCCCNCC(C)C m_270004__8288546__24594274 [0,2,0,0,0,0|1,0,0]=3 2198 B13R0.54 CC/C=C\CCCCCNCC(C)F m_270004__13461138__24594274 [0,2,0,0,0,0|1,0,0]=3 2199 B13R0.54 CC/C=C\CCCCCNCC(C)O m_270004__8288774__24594274 [0,2,0,0,0,0|1,0,0]=3 2200 B13R0.54 CC/C=C\CCCCCNCC(F)Br m_270004__23851146__24594274 [0,2,0,0,0,0|2,0,0]=4 2201 B13R0.54 CC/C=C\CCCCCNCC(F)Cl m_270004__21631482__24594274 [0,2,0,0,0,0|2,0,0]=4 2202 B13R0.54 CC/C=C\CCCCCNCC(F)F m_270004__10150310__24594274 [0,2,0,0,0,0|2,0,0]=4 2203 B13R0.54 CC/C=C\CCCNCCCC(C)C m_270004__8294480__24594278 [0,2,0,0,0,0|1,0,0]=3 2204 B13R0.54 CC/C=C\CCCNCCCC(C)O m_270004__9448698__24594278 [0,2,0,0,0,0|1,0,0]=3 2205 B13R0.54 CC/C=C\CCCNCCCC(F)F m_270004__13135948__24594278 [0,2,0,0,0,0|2,0,0]=4 2206 B13R0.54 CC/C=C\CCCNCCCN(C)C m_270004__8288592__24594278 [0,2,0,0,0,0|2,0,0]=4 2207 B13R0.54 CC/C=C\CCCNCCCS(=O)C m_270004__13164350__24594278 [0,2,0,0,0,0|2,0,0]=4 2208 B13R0.54 CC/C=C\CCCNCCOC(C)C m_270004__8750494__24594278 [0,2,0,0,0,0|2,0,0]=4 2209 B13R0.54 CC/C=C\CCCNCCSC(C)C m_270004__10176234__24594278 [0,2,0,0,0,0|2,0,0]=4 2210 B13R0.54 CCC=CCCSCCCOC(C)C m_62__8859720__9273986 [0,2,0,0,0,0|2,0,0]=4 2211 B13R0.54 CCC=CCCSCCOCC(C)C m_62__9820342__8859722 [0,2,0,0,0,0|2,0,0]=4 2212 B13R0.54 CCC=CCCSCCSCC(C)C m_62__8859720__8268574 [0,2,0,0,0,0|2,0,0]=4 2213 B13R0.54 CCCC=CCCNCCCC(C)C m_270004__23849914__9139706 [0,2,0,0,0,0|2,0,0]=4 2214 B13R0.54 CCCC=CCCSCCCC(C)C m_62__10892842__7875324 [0,2,0,0,0,0|2,0,0]=4 2215 B13R0.54 CCCCCCCCCC=CC(=O)N m_22__58357__2834232 [0,2,0,0,0,0|0,0,2]=4 2216 B13R0.54 CCCCCCCCCNCC(C)O m_270004__8288774__24715050 [0,2,0,0,0,0|0,0,2]=4 2217 B13R0.54 CCCCCCCCCSCC(=O)O m_7__26823__9282132 [0,2,0,0,0,0|1,0,1]=4 2218 B13R0.54 CCCCCCCCCSCC(C)O m_7__10953796__9282132 [0,2,0,0,0,0|0,0,2]=4 2219 B13R0.54 CCCCCCCCON=CC(C)C m_34__19446766__9283556 [0,2,0,0,0,0|2,0,0]=4 2220 B13R0.54 CCCCCCCCSCCC(C)O m_62__12057938__9282118 [0,2,0,0,0,0|0,0,2]=4 2221 B13R0.54 CCCCCCCNCCCC(C)O m_270004__9448698__24715022 [0,2,0,0,0,0|0,0,2]=4 2222 B13R0.54 CN(C)CCNCCSCC=CCO m_7__22987912__16809272 [0,2,0,0,0,0|2,0,0]=4 2223 B13R0.54 C[C@H](N)CSCCCCCCCCO m_7__20871336__22787460 [0,2,0,0,0,0|0,0,2]=4 2224 B13R0.147 C#CC(C)NCCCCC/C=C\CC m_270004__10115238__24594274 [0,2,0,0,0,0|2,0,0]=4 2225 B13R0.147 C#CCCCCCCCNC(=O)CO m_22__24036514__7941800 [0,2,0,0,0,0|1,0,1]=4 2226 B13R0.147 C=C(CC)CSCCCCCCCC m_62__8265146__9282118 [0,2,0,0,0,0|1,0,1]=4 2227 B13R0.147 C=C(CO)CCNCCCCCCC m_270004__17763614__24715022 [0,2,0,0,0,0|0,0,1]=3 2228 B13R0.147 C=C(CO)CCNCCCCCCCl m_270004__17763614__24721042 [0,2,0,0,0,0|1,0,1]=4 2229 B13R0.147 C=C(CO)CCNCCCCCCF m_270004__17763614__16464048 [0,2,0,0,0,0|1,0,1]=4 2230 B13R0.147 C=C(CO)CCNCCCCCOC m_270004__17763614__24721444 [0,2,0,0,0,0|1,0,1]=4 2231 B13R0.147 C=C(CO)CCNCCCCOCC m_270004__17763614__24710482 [0,2,0,0,0,0|1,0,1]=4 2232 B13R0.147 C=C(CO)CSCCCCCCOC m_7__22987398__15422654 [0,2,0,0,0,0|1,0,1]=4 2233 B13R0.147 C=CC(C)CCNCCC/C=C\CC m_270004__23842090__24594278 [0,2,0,0,0,0|2,0,0]=4 2234 B13R0.147 C=CC(C)NCCCCC/C=C\CC m_270004__8298522__24594274 [0,2,0,0,0,0|2,0,0]=4 2235 B13R0.147 C=CCCCCCCCNC(=O)CO m_22__10301652__7941800 [0,2,0,0,0,0|1,0,1]=4 2236 B13R0.147 CC(CO)NCCCCCCCCO m_269862__21500832__15157990 [0,2,0,0,0,0|1,0,1]=4 2237 B13R0.147 CC(CO)SCCCCCCCCO m_7__6338928__22787460 [0,2,0,0,0,0|1,0,1]=4 2238 B13R0.147 CC/C=C\CCCCCNC(C)CC m_270004__8288602__24594274 [0,2,0,0,0,0|1,0,0]=3 2239 B13R0.147 CC/C=C\CCCCCNC(C)CF m_270004__10214060__24594274 [0,2,0,0,0,0|2,0,0]=4 2240 B13R0.147 CC/C=C\CCCCCN[C@H](C)CF m_270004__13811084__24594274 [0,2,0,0,0,0|2,0,0]=4 2241 B13R0.147 CC/C=C\CCCCCN[C@H](C)CO m_270004__8291226__24594274 [0,2,0,0,0,0|2,0,0]=4 2242 B13R0.147 CC/C=C\CCCNCCC(C)CC m_270004__11970592__24594278 [0,2,0,0,0,0|1,0,0]=3 2243 B13R0.147 CC/C=C\CCCNCCC(C)CO m_270004__23845770__24594278 [0,2,0,0,0,0|2,0,0]=4 2244 B13R0.147 CC/C=C\CCCNCCC(C)OC m_270004__10742084__24594278 [0,2,0,0,0,0|2,0,0]=4 2245 B13R0.147 CC/C=C\CCCNCCC(C)SC m_270004__8293102__24594278 [0,2,0,0,0,0|2,0,0]=4 2246 B13R0.147 CC/C=C\CCCNCCC(O)CC m_270004__8299014__24594278 [0,2,0,0,0,0|1,0,0]=3 2247 B13R0.147 CC/C=C\CCCNCCN(C)CC m_270004__23846852__24594278 [0,2,0,0,0,0|2,0,0]=4 2248 B13R0.147 CC/C=C\CCCNCCS(=O)CC m_270004__8296312__24594278 [0,2,0,0,0,0|2,0,0]=4 2249 B13R0.147 CCC(=O)NCCCCCCCCF m_22__23073304__58887 [0,2,0,0,0,0|2,0,0]=4 2250 B13R0.147 CCC(=O)NCCCCCCCCO m_270062__21500836__22005658 [0,2,0,0,0,0|2,0,0]=4 2251 B13R0.147 CCC(C)CNCCCCCCCO m_207__13810894__7687310 [0,2,0,0,0,0|0,0,2]=4 2252 B13R0.147 CCC(C)CNCCCCSCCO m_270004__23843874__9139664 [0,2,0,0,0,0|1,0,1]=4 2253 B13R0.147 CCC(C)CSCCCCCCCO m_7__7022538__6174984 [0,2,0,0,0,0|0,0,2]=4 2254 B13R0.147 CCC(C)NCCCCCCCCO m_269862__21500832__7200134 [0,2,0,0,0,0|0,0,2]=4 2255 B13R0.147 CCC(O)CNCCCCCCCO m_273610__13810926__11516276 [0,2,0,0,0,0|0,0,2]=4 2256 B13R0.147 CCC(O)CSCCCCCCCO m_7__22988104__6174984 [0,2,0,0,0,0|0,0,2]=4 2257 B13R0.147 CCCC=CCCSCCC(C)CC m_62__20058276__7875324 [0,2,0,0,0,0|2,0,0]=4 2258 B13R0.147 CCCC=CCCSCCC(O)CC m_62__16640708__7875324 [0,2,0,0,0,0|2,0,0]=4 2259 B13R0.147 CCCCCCCCCCC(=O)NO m_527__388132__848110 [0,2,0,0,0,0|1,0,1]=4 2260 B13R0.147 CCCCCCCCCN[C@H](C)CO m_2230__22399532__9282142 [0,2,0,0,0,0|0,0,2]=4 2261 B13R0.147 CCCCCCCCCOC(=O)CC m_1458__473508__9282136 [0,2,0,0,0,0|1,0,1]=4 2262 B13R0.147 CCCCCCCCCSC(C)CO m_7__6338928__9282132 [0,2,0,0,0,0|0,0,2]=4 2263 B13R0.147 CCCCCCCCNCC(O)CC m_273610__11525810__11516276 [0,2,0,0,0,0|1,0,1]=4 2264 B13R0.147 CCCCCCCCNC[C@H](O)CF m_273610__11525810__14323916 [0,2,0,0,0,0|1,0,1]=4 2265 B13R0.147 CCCCCCCCON=C(N)CC m_34__1129938__9283556 [0,2,0,0,0,0|2,0,0]=4 2266 B13R0.147 CCCCCCCCONC(=N)CO m_34__11944490__9283556 [0,2,0,0,0,0|1,0,0]=3 2267 B13R0.147 CCCCCCCCSCC(C)CO m_7__6078536__9282116 [0,2,0,0,0,0|0,0,2]=4 2268 B13R0.147 CCCCCCCCSCC(C)OC m_62__8635200__9282118 [0,2,0,0,0,0|1,0,1]=4 2269 B13R0.147 CCCCCCCCSCC(O)CC m_7__22988104__9282116 [0,2,0,0,0,0|1,0,1]=4 2270 B13R0.147 CCCCCCCCSCC(O)CO m_7__6554250__9282116 [0,2,0,0,0,0|0,0,2]=4 2271 B13R0.147 CCCCCCCNCCC(=O)NO m_270004__23833074__24715022 [0,2,0,0,0,0|1,0,1]=4 2272 B13R0.147 CCCCCCCNCCC(C)CO m_270004__23845770__24715022 [0,2,0,0,0,0|0,0,2]=4 2273 B13R0.147 CCCCCCNCCCC(=O)NO m_270004__23847014__24715030 [0,2,0,0,0,0|1,0,1]=4 2274 B13R0.147 CCCCCCNCCCC(C)CO m_270004__8300144__24715030 [0,2,0,0,0,0|0,0,2]=4 2275 B13R0.147 CCCCCCNCCNC(=O)CC m_270004__15726820__24715030 [0,2,0,0,0,0|2,0,0]=4 2276 B13R0.147 CCCCCCNCCNC(=O)CO m_270004__24793754__24715030 [0,2,0,0,0,0|1,0,0]=3 2277 B13R0.147 CCCCCCOCCOC(=O)CC m_276436__14079262__14101862 [0,2,0,0,0,0|2,0,0]=4 2278 B13R0.147 CCCCCCSCC=CC(=O)OC m_62__8854732__17800528 [0,2,0,0,0,0|1,0,1]=4 2279 B13R0.147 CCCCCSCCONC(=N)CO m_34__11944490__15748362 [0,2,0,0,0,0|2,0,0]=4 2280 B13R0.147 CCCCOCCCCOC(=O)CC m_276436__14078420__14101862 [0,2,0,0,0,0|2,0,0]=4 2281 B13R0.147 CC[C@H](N)CSCCCCCCCO m_7__20871354__6174984 [0,2,0,0,0,0|0,0,2]=4 2282 B13R0.147 C[C@H](CO)NCCCCCCCCO m_2230__22399532__22384170 [0,2,0,0,0,0|1,0,1]=4 2283 B13R0.147 NCC(=O)NCCCCCCCCF m_240690__24717922__3025698 [0,2,0,0,0,0|2,0,0]=4 2284 B13R0.147 NCC(=O)NCCCCCCCCO m_240690__21496000__3025698 [0,2,0,0,0,0|2,0,0]=4 2285 B13R0.147 O=C(CO)NCCCCCCCCF m_22__23073304__7941800 [0,2,0,0,0,0|1,0,0]=3 2286 B13R0.147 O=C(CO)NCCCCCCCCO m_22__20611212__7941800 [0,2,0,0,0,0|1,0,0]=3 2287 B13R0.147 O=C(CO)NCCNCCCCCCl m_270004__24793754__24721510 [0,2,0,0,0,0|2,0,0]=4 2288 B13R0.165 C=CC=CCCN(C)CCCCCC m_2230__22406770__12907972 [0,2,0,0,0,0|1,0,1]=4 2289 B13R0.165 C=CCCCCC(C)NCC=CCO m_270004__11971554__10814462 [0,2,0,0,0,0|0,0,2]=4 2290 B13R0.165 CC#CCCCC(C)NCC=CCO m_270004__11971554__24722830 [0,2,0,0,0,0|0,0,2]=4 2291 B13R0.165 CC(CCCCC#N)NCC=CCO m_270004__11971554__24722704 [0,2,0,0,0,0|1,0,1]=4 2292 B13R0.165 CC(CCCCCO)NCC=CCO m_2230__22404642__16809276 [0,2,0,0,0,0|1,0,0]=3 2293 B13R0.165 CCC=CCCC(C)NCC=CCO m_270004__11971554__17320680 [0,2,0,0,0,0|0,0,2]=4 2294 B13R0.165 CCC=CCCC(C)NCCCCC m_269862__7192702__17320678 [0,2,0,0,0,0|1,0,0]=3 2295 B13R0.165 CCC=CCCC(C)NCCCCF m_269862__10390194__17320678 [0,2,0,0,0,0|2,0,0]=4 2296 B13R0.165 CCC=CCCC(C)NCCCCO m_269862__9433176__17320678 [0,2,0,0,0,0|2,0,0]=4 2297 B13R0.165 CCC=CCCC(C)NCCCOC m_269862__7192676__17320678 [0,2,0,0,0,0|2,0,0]=4 2298 B13R0.165 CCC=CCCC(C)NCCCSC m_269862__7198366__17320678 [0,2,0,0,0,0|2,0,0]=4 2299 B13R0.165 CCC=CCCC(C)NCCOCC m_269862__7194340__17320678 [0,2,0,0,0,0|2,0,0]=4 2300 B13R0.165 CCC=CCCC(C)NCCSCC m_269862__13975980__17320678 [0,2,0,0,0,0|2,0,0]=4 2301 B13R0.165 CCC=CCCN(C)CCCCCC m_2230__22406770__8859726 [0,2,0,0,0,0|1,0,0]=3 2302 B13R0.165 CCC=CCCN(C)CCCCCO m_2230__9449864__8859726 [0,2,0,0,0,0|2,0,0]=4 2303 B13R0.165 CCC=CCCN(C)CCCCOC m_2230__11246776__8859726 [0,2,0,0,0,0|2,0,0]=4 2304 B13R0.165 CCC=CCCN(C)CCCOCC m_2230__22406790__8859726 [0,2,0,0,0,0|2,0,0]=4 2305 B13R0.165 CCC=CCNC(=O)CCCCCC m_527__17312556__336062 [0,2,0,0,0,0|1,0,1]=4 2306 B13R0.165 CCC=CCNC(C)CCCCCC m_269862__17312576__7200330 [0,2,0,0,0,0|1,0,0]=3 2307 B13R0.165 CCC=CCOC(=O)CCCCCC m_276436__14083704__14088496 [0,2,0,0,0,0|1,0,1]=4 2308 B13R0.165 CCCC=CCN(C)CCCCCC m_2230__22406770__22993520 [0,2,0,0,0,0|2,0,0]=4 2309 B13R0.165 CCCCCCC(=O)NC/C=C\CN m_240690__21478158__7405180 [0,2,0,0,0,0|1,0,1]=4 2310 B13R0.165 CCCCCCC(=O)NCC=CCO m_527__11971536__336062 [0,2,0,0,0,0|0,0,1]=3 2311 B13R0.165 CCCCCCC(=O)OCC=CCO m_1458__803728__16809274 [0,2,0,0,0,0|0,0,1]=3 2312 B13R0.165 CCCCCCC(C)NC/C=C\CN m_272690__21478164__11346110 [0,2,0,0,0,0|1,0,0]=3 2313 B13R0.165 CCCCCCC(C)NCC=CCO m_270004__11971554__8844932 [0,2,0,0,0,0|0,0,0]=2 2314 B13R0.165 CCCCCCC(C)NCCCCO m_269862__9433176__7200330 [0,2,0,0,0,0|0,0,2]=4 2315 B13R0.165 CCCCCCC(O)CNCCCO m_273610__11554108__11516296 [0,2,0,0,0,0|0,0,2]=4 2316 B13R0.165 CCCCCCC(O)CNCCOC m_273610__13857010__11516296 [0,2,0,0,0,0|1,0,1]=4 2317 B13R0.165 CCCCCCN(C)CCCCCO m_2230__22406770__6079162 [0,2,0,0,0,0|0,0,2]=4 2318 B13R0.165 CCCCCCN(C)CCOCCO m_2230__22406770__11974698 [0,2,0,0,0,0|1,0,1]=4 2319 B13R0.165 CCCCCNC(=O)NCC=CCO m_2708__905576__11971546 [0,2,0,0,0,0|1,0,1]=4 2320 B13R0.165 CCCCCNC(C)CCCCCO m_2230__22404642__5063396 [0,2,0,0,0,0|0,0,2]=4 2321 B13R0.165 CCCCCOC(=O)NCC=CCO m_282070__22229464__22312814 [0,2,0,0,0,0|1,0,1]=4 2322 B13R0.165 CCCCOCC(=O)NCC=CCO m_527__11971536__5125252 [0,2,0,0,0,0|1,0,1]=4 2323 B13R0.165 CCCCOCC(=O)OCC=CCO m_1458__5125256__16809274 [0,2,0,0,0,0|1,0,1]=4 2324 B13R0.165 CCCCSCC(=O)NCC=CCO m_527__11971536__548074 [0,2,0,0,0,0|1,0,1]=4 2325 B13R0.165 CCCOCCC(=O)NCC=CCO m_527__11971536__16471830 [0,2,0,0,0,0|1,0,1]=4 2326 B13R0.165 CCCOCCC(=O)OCC=CCO m_1458__16471832__16809274 [0,2,0,0,0,0|1,0,1]=4 2327 B13R0.165 CCCSCCC(=O)NCC=CCO 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B13R0.336 CCCCCCNCCCOCOC m_270004__23847210__24715030 [0,2,0,0,0,0|1,0,1]=4 2415 B13R0.336 CCCCCCNCCCSCCO m_270004__23851182__24715030 [0,2,0,0,0,0|0,0,2]=4 2416 B13R0.336 CCCCCCNCCOCCCO m_270004__10126306__24715030 [0,2,0,0,0,0|0,0,2]=4 2417 B13R0.336 CCCCCCNCCOCCOC m_270004__8291342__24715030 [0,2,0,0,0,0|1,0,1]=4 2418 B13R0.336 CCCCCCNCCSCCCO m_270004__8294464__24715030 [0,2,0,0,0,0|0,0,2]=4 2419 B13R0.336 CCCCCCNCCSCCOC m_270004__23839954__24715030 [0,2,0,0,0,0|1,0,1]=4 2420 B13R0.336 CCCCCCSCCCCCOC m_62__8854732__9273984 [0,2,0,0,0,0|0,0,2]=4 2421 B13R0.336 CCCCCCSCCOCCOC m_62__8854732__8738866 [0,2,0,0,0,0|1,0,1]=4 2422 B13R0.336 CCCCCNCCCCCCOC m_270004__8288604__24721252 [0,2,0,0,0,0|0,0,2]=4 2423 B13R0.336 CCCCCSCCCCCCCO m_7__8271838__6174984 [0,2,0,0,0,0|0,0,2]=4 2424 B13R0.336 CCCCCSCCCCCCOC m_7__22987398__5063386 [0,2,0,0,0,0|0,0,2]=4 2425 B13R0.336 CCCCCSCCCOCCCO m_7__8271838__22787260 [0,2,0,0,0,0|0,0,2]=4 2426 B13R0.336 CCCCCSCCCOCCOC m_62__5063390__15428358 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m_7__22987402__6079158 [0,2,0,0,0,0|0,0,2]=4 2440 B13R0.336 CCOCCCCSCCOCCO m_7__22987402__11974692 [0,2,0,0,0,0|1,0,1]=4 2441 B13R0.336 CCOCCCSCC=CCCOC m_7__22987520__20765548 [0,2,0,0,0,0|2,0,0]=4 2442 B13R0.336 CCOCCCSCCCCCCO m_7__22987520__6673274 [0,2,0,0,0,0|0,0,2]=4 2443 B13R0.336 CCOCCOCCSCC=CCO m_7__22987634__16809272 [0,2,0,0,0,0|1,0,0]=3 2444 B13R0.336 CCSCCNCCCCCCCO m_270004__13810922__8765926 [0,2,0,0,0,0|0,0,2]=4 2445 B13R0.336 CCSCCNCCCCSCCO m_270004__23843874__8765926 [0,2,0,0,0,0|1,0,1]=4 2446 B13R0.336 CCSCCSCCCCCCCO m_7__8765656__6174984 [0,2,0,0,0,0|0,0,2]=4 2447 B13R0.336 CNCCSCCCCCCCCO m_7__22986920__22787460 [0,2,0,0,0,0|0,0,2]=4 2448 B13R0.336 COCCC=CCSCCCCCF m_7__22986778__20765548 [0,2,0,0,0,0|2,0,0]=4 2449 B13R0.336 COCCC=CCSCCCCCN m_7__20871376__20765548 [0,2,0,0,0,0|2,0,0]=4 2450 B13R0.336 COCCC=CCSCCCCOC m_7__22986808__20765548 [0,2,0,0,0,0|2,0,0]=4 2451 B13R0.336 COCCCCCCNCCCCO m_270004__9433178__24721252 [0,2,0,0,0,0|0,0,2]=4 2452 B13R0.336 COCCCCCCSCC#CCO m_7__22987398__15141006 [0,2,0,0,0,0|0,0,2]=4 2453 B13R0.336 COCCCCCCSCC=CC#N m_7__22987398__7140602 [0,2,0,0,0,0|1,0,1]=4 2454 B13R0.336 COCCCCCCSCC=CCO m_7__22987398__16809272 [0,2,0,0,0,0|0,0,0]=2 2455 B13R0.336 COCCCCCCSCCCCO m_7__22987398__3191338 [0,2,0,0,0,0|0,0,2]=4 2456 B13R0.336 COCCCCCNCCC#CCO m_270004__21537562__24721444 [0,2,0,0,0,0|0,0,2]=4 2457 B13R0.336 COCCCCCNCCCCCO m_270004__9456968__24721444 [0,2,0,0,0,0|0,0,2]=4 2458 B13R0.336 COCCCCCNCCOCCO m_270004__8288648__24721444 [0,2,0,0,0,0|1,0,1]=4 2459 B13R0.336 COCCCCCNCCSCCO m_270004__21508858__24721444 [0,2,0,0,0,0|1,0,1]=4 2460 B13R0.336 COCCCCCSCCCCCO m_7__22987588__6079158 [0,2,0,0,0,0|0,0,2]=4 2461 B13R0.336 COCCCCCSCCOCCO m_62__5002782__8799516 [0,2,0,0,0,0|1,0,1]=4 2462 B13R0.336 COCCCCSCCCCCCO m_7__22986808__6673274 [0,2,0,0,0,0|0,0,2]=4 2463 B13R0.336 COCCCNCCCCCCCO m_270004__13810922__24710510 [0,2,0,0,0,0|0,0,2]=4 2464 B13R0.336 COCCCNCCCCSCCO m_270004__23843874__24710510 [0,2,0,0,0,0|1,0,1]=4 2465 B13R0.336 COCCCSCCCCCCCO m_7__17626136__6174984 [0,2,0,0,0,0|0,0,2]=4 2466 B13R0.336 COCCSCCCCCCCCO m_7__6362310__22787460 [0,2,0,0,0,0|0,0,2]=4 2467 B13R0.336 CSCCCSCCCCCCCO m_7__10890048__6174984 [0,2,0,0,0,0|0,0,2]=4 2468 B13R0.336 NCCCCCSCCCCCCO m_34__20871474__7207104 [0,2,0,0,0,0|0,0,2]=4 2469 B13R0.336 NCCCCSCCCCCCCO m_7__20871294__6174984 [0,2,0,0,0,0|0,0,2]=4 2470 B13R0.336 NCCCSCCCCCCCCO m_7__20871288__22787460 [0,2,0,0,0,0|0,0,2]=4 2471 B13R0.336 OCC#CCCNCCCCCCCl m_270004__21537562__24721042 [0,2,0,0,0,0|0,0,2]=4 2472 B13R0.336 OCC#CCCNCCCCCCF m_270004__21537562__16464048 [0,2,0,0,0,0|0,0,2]=4 2473 B13R0.336 OCCCCCCCCSCCCO m_7__10972294__22787460 [0,2,0,0,0,0|0,0,2]=4 2474 B13R0.336 OCCCCCCCNCCCCCl m_270004__13810922__24721168 [0,2,0,0,0,0|0,0,2]=4 2475 B13R0.336 OCCCCCCCSCCCCO m_7__22849690__6174984 [0,2,0,0,0,0|0,0,2]=4 2476 B13R0.336 OCCCCCCNCCCCCCl m_270004__8300498__24721510 [0,2,0,0,0,0|0,0,2]=4 2477 B13R0.336 OCCCCCCSCCCCCF m_7__22986778__6673274 [0,2,0,0,0,0|0,0,2]=4 2478 B13R0.336 OCCCCCNCCCCCCCl m_270004__9456968__24721042 [0,2,0,0,0,0|0,0,2]=4 2479 B13R0.336 OCCCCCNCCCCCCF m_270004__9456968__16464048 [0,2,0,0,0,0|0,0,2]=4 2480 B13R0.336 OCCCCOCCCCSCCO m_7__128807__22787552 [0,2,0,0,0,0|1,0,1]=4 2481 B13R0.336 OCCOCCCNCCCCCCl m_270004__8602160__24721510 [0,2,0,0,0,0|1,0,1]=4 2482 B13R0.336 OCCOCCNCCCCCCCl m_270004__8288648__24721042 [0,2,0,0,0,0|1,0,1]=4 2483 B13R0.336 OCCOCCNCCCCCCF m_270004__8288648__16464048 [0,2,0,0,0,0|1,0,1]=4 2484 B13R0.336 OCCSCCCCNCCCCCl m_270004__23843874__24721168 [0,2,0,0,0,0|1,0,1]=4 2485 B13R0.336 OCCSCCCNCCCCCCl m_270004__23851182__24721510 [0,2,0,0,0,0|1,0,1]=4 2486 B13R0.336 OCCSCCNCCCCCCCl m_270004__21508858__24721042 [0,2,0,0,0,0|1,0,1]=4 2487 B13R0.336 OCCSCCNCCCCCCF m_270004__21508858__16464048 [0,2,0,0,0,0|1,0,1]=4 2488 B13R0.338 C=CC=CCCNC(C)CCCCC m_269862__12896184__7200472 [0,2,0,0,0,0|1,0,1]=4 2489 B13R0.338 C=CCCCCCN(C)CC=CCO m_2230__5455842__16809276 [0,2,0,0,0,0|0,0,2]=4 2490 B13R0.338 CC/C=C/CC(=O)NCCCCCC m_22__303720__21288438 [0,2,0,0,0,0|1,0,1]=4 2491 B13R0.338 CC/C=C\CCCN(C)CCCCC m_270004__22489862__24594278 [0,2,0,0,0,0|1,0,0]=3 2492 B13R0.338 CC/C=C\CCCN(C)CCCCO m_270004__9209612__24594278 [0,2,0,0,0,0|2,0,0]=4 2493 B13R0.338 CC/C=C\CCCN(C)CCCOC m_270004__8134368__24594278 [0,2,0,0,0,0|2,0,0]=4 2494 B13R0.338 CC/C=C\CCCN(C)CCCSC m_270004__9749484__24594278 [0,2,0,0,0,0|2,0,0]=4 2495 B13R0.338 CC/C=C\CCCN(C)CCOCC m_270004__8583528__24594278 [0,2,0,0,0,0|2,0,0]=4 2496 B13R0.338 CCC=CCCNC(C)CCCCO m_2230__22399050__8859726 [0,2,0,0,0,0|2,0,0]=4 2497 B13R0.338 CCC=CCCNC(C)CCSCC m_2230__22399618__8859726 [0,2,0,0,0,0|2,0,0]=4 2498 B13R0.338 CCC=CCCOC(=O)CCCCC m_276436__14083774__14085900 [0,2,0,0,0,0|1,0,1]=4 2499 B13R0.338 CCC=CCNCC(O)CCOCC m_273610__17312600__11516302 [0,2,0,0,0,0|2,0,0]=4 2500 B13R0.338 CCCC=CCCN(C)CCCCC m_2230__22407254__7875332 [0,2,0,0,0,0|2,0,0]=4 2501 B13R0.338 CCCC=CCNC(C)CCCCC m_270004__14718658__8844946 [0,2,0,0,0,0|2,0,0]=4 2502 B13R0.338 CCCCCC(=O)NCC=CCOC m_11__22166306__53543 [0,2,0,0,0,0|1,0,1]=4 2503 B13R0.338 CCCCCC(C)NCC=CCOC m_270004__24044358__8844946 [0,2,0,0,0,0|1,0,0]=3 2504 B13R0.338 CCCCCC(C)NCC=CCSC m_270004__23005652__8844946 [0,2,0,0,0,0|1,1,0]=4 2505 B13R0.338 CCCCCC(C)NCCC#CCO m_269862__21537560__7200472 [0,2,0,0,0,0|0,0,2]=4 2506 B13R0.338 CCCCCC(C)NCCCCCO m_269862__9456966__7200472 [0,2,0,0,0,0|0,0,2]=4 2507 B13R0.338 CCCCCC(C)NCCOCCO m_269862__7193024__7200472 [0,2,0,0,0,0|1,0,1]=4 2508 B13R0.338 CCCCCC(C)NCCSCCO m_269862__21508856__7200472 [0,2,0,0,0,0|1,0,1]=4 2509 B13R0.338 CCCCCCCC(=O)CSCCO m_7__128807__22788322 [0,2,0,0,0,0|1,0,1]=4 2510 B13R0.338 CCCCCCCC(C)NCCCO m_270004__8288584__8844930 [0,2,0,0,0,0|0,0,2]=4 2511 B13R0.338 CCCCCCCC(C)NCCOC m_270004__8288600__8844930 [0,2,0,0,0,0|1,0,1]=4 2512 B13R0.338 CCCCCCCN(C)C/C=C/CN m_269982__22516394__22485940 [0,2,0,0,0,0|1,0,0]=3 2513 B13R0.338 CCCCCCCN(C)CC#CCO m_2230__22407266__15141016 [0,2,0,0,0,0|0,0,2]=4 2514 B13R0.338 CCCCCCCN(C)CC=CC#N m_2230__22407266__16945818 [0,2,0,0,0,0|1,0,1]=4 2515 B13R0.338 CCCCCCCN(C)CC=CCO m_2230__22407266__16809276 [0,2,0,0,0,0|0,0,0]=2 2516 B13R0.338 CCCCCCCN(C)CCCCO m_2230__22407266__3191342 [0,2,0,0,0,0|0,0,2]=4 2517 B13R0.338 CCCCCCNC(=O)/C=C/COC m_11__51507__22137674 [0,2,0,0,0,0|1,0,1]=4 2518 B13R0.338 CCCCCCNC(=O)C/C=C/CN m_240690__7350946__21394364 [0,2,0,0,0,0|1,0,1]=4 2519 B13R0.338 CCCCCCNC(=O)C=CCOC m_22__303720__12625302 [0,2,0,0,0,0|1,0,1]=4 2520 B13R0.338 CCCCCCNC(C)CCCCO m_2230__22399050__5530588 [0,2,0,0,0,0|0,0,2]=4 2521 B13R0.338 CCCCCCOC(=O)C=CCOC m_276436__14076618__14107148 [0,2,0,0,0,0|1,0,1]=4 2522 B13R0.338 CCCCCN(C)CCCCCCO m_2230__22407254__13038782 [0,2,0,0,0,0|0,0,2]=4 2523 B13R0.338 CCCCCOCC(O)CNCCO m_273610__11554104__15244456 [0,2,0,0,0,0|1,0,1]=4 2524 B13R0.338 CCCCOC(=O)CSCC=CCO m_7__12427116__16809272 [0,2,0,0,0,0|1,0,1]=4 2525 B13R0.338 CCCSCC(C)NCC=CCOC m_270004__24044358__13438922 [0,2,0,0,0,0|2,0,0]=4 2526 B13R0.338 CCOCCC(O)CNCC=CCO m_273610__13857830__11516302 [0,2,0,0,0,0|1,0,0]=3 2527 B13R0.338 CN(C/C=C/CN)CCCCCCN m_269982__12864432__22485940 [0,2,0,0,0,0|2,0,0]=4 2528 B13R0.338 CN(CC=CCO)CCCCCCN m_269982__12864432__16809282 [0,2,0,0,0,0|1,0,0]=3 2529 B13R0.338 CN(CC=CCO)CCOCCCN m_269982__22504818__16809282 [0,2,0,0,0,0|2,0,0]=4 2530 B13R0.338 CNCCOCCN(C)CC=CCO m_269982__12230994__16809282 [0,2,0,0,0,0|2,0,0]=4 2531 B13R0.338 COCC=CCNC(C)CCCCCl m_270004__24044358__24722576 [0,2,0,0,0,0|2,0,0]=4 2532 B13R0.338 COCC=CCNC(C)CCCOC m_270004__24044358__24709838 [0,2,0,0,0,0|2,0,0]=4 2533 B13R0.338 COCCOCCN(C)CC=CCO m_2230__10268178__16809276 [0,2,0,0,0,0|2,0,0]=4 2534 B13R0.1 CC(C)CCCC(=O)NCC=CCO m_527__11971536__10684764 [0,2,0,0,0,0|1,0,1]=4 2535 B13R0.1 CC(C)CCCC(=O)OCC=CCO m_1458__10684770__16809274 [0,2,0,0,0,0|1,0,1]=4 2536 B13R0.1 CC(C)CCCC(C)NC/C=C\CN m_272690__21478164__11346510 [0,2,0,0,0,0|2,0,0]=4 2537 B13R0.1 CC(C)CCCC(C)NCC=CCO m_270004__11971554__8844964 [0,2,0,0,0,0|1,0,0]=3 2538 B13R0.1 CCC=CCCC(C)NCCC(C)C m_269862__7192680__17320678 [0,2,0,0,0,0|2,0,0]=4 2539 B13R0.1 CCC=CCCC(C)NCCC(C)F m_269862__10546064__17320678 [0,2,0,0,0,0|2,0,0]=4 2540 B13R0.1 CCC=CCCC(C)NCCC(C)O m_269862__7198110__17320678 [0,2,0,0,0,0|2,0,0]=4 2541 B13R0.1 CCC=CCCN(C)CCCC(C)C m_2230__13824066__8859726 [0,2,0,0,0,0|2,0,0]=4 2542 B13R0.1 CCC=CCCN(C)CCCC(C)O m_2230__22405892__8859726 [0,2,0,0,0,0|2,0,0]=4 2543 B13R0.1 CCC=CCNC(C)CCCC(C)C m_269862__17312576__7200782 [0,2,0,0,0,0|2,0,0]=4 2544 B13R0.1 CCCCCCC(O)CNCC(C)O m_273610__11554114__11516296 [0,2,0,0,0,0|1,0,1]=4 2545 B13R0.1 CCCCCCN(C)C/C=C/C(=O)O m_270122__22561488__11726798 [0,2,0,0,0,0|1,0,1]=4 2546 B13R0.1 C[C@@H](N)CCCC(=O)NCC=CCO m_240690__11979432__24776996 [0,2,0,0,0,0|1,0,1]=4 2547 B13R0.188 CC(C)CCCCN(C)C/C=C/CN m_269982__22514312__22485940 [0,2,0,0,0,0|2,0,0]=4 2548 B13R0.188 CC(C)CCCCN(C)CC=CCO m_2230__22405628__16809276 [0,2,0,0,0,0|1,0,0]=3 2549 B13R0.188 CC(C)OCCCN(C)CC=CCO m_2230__10706832__16809276 [0,2,0,0,0,0|2,0,0]=4 2550 B13R0.194 C=C(CO)CCNC(C)CCCCC m_269862__17763612__7200472 [0,2,0,0,0,0|1,0,1]=4 2551 B13R0.194 CN(CC=CCO)CCCC(O)CO m_2230__22405068__16809276 [0,2,0,0,0,0|2,0,0]=4 2552 B13R0.195 CCCCCC(C)NC(=O)C=CCO m_22__505536__13570734 [0,2,0,0,0,0|1,0,1]=4 2553 B13R0.278 CCC=CCNC(CC)CCCCC m_269862__17312576__18242936 [0,2,0,0,0,0|2,0,0]=4 2554 B13R0.278 CCCCCC(CC)NCC=CCO m_270004__11971554__24709352 [0,2,0,0,0,0|1,0,0]=3 2555 B13R0.278 NCCCC[C@@H](CO)NCC=CCO m_269982__22505318__16809282 [0,2,0,0,0,0|2,0,0]=4 2556 B13R0.398 CCSCCC(C)N(C)CC=CCO m_2230__7463470__16809276 [0,2,0,0,0,0|2,0,0]=4 2557 B13R0.1129 CCCCCS(=O)(=O)NCC=CCO m_40__11971530__8331508 [0,2,0,0,0,0|2,0,0]=4 2558 B13R0.1129 COCCCC(C)(C)NCC=CCO m_2230__22400678__16809276 [0,2,0,0,0,0|2,0,0]=4 2559 B13R0.1170 CCC(C)CCC(=O)NCC=CCO m_527__11971536__10154790 [0,2,0,0,0,0|1,0,1]=4 2560 B13R0.1170 CCC(C)CCC(=O)OCC=CCO m_1458__10154796__16809274 [0,2,0,0,0,0|1,0,1]=4 2561 B13R0.1170 CCC(N)CCC(=O)NCC=CCO m_240690__11979432__14776994 [0,2,0,0,0,0|1,0,1]=4 2562 B13R0.1170 CCC=CCCC(C)NCC(C)CC m_269862__11352298__17320678 [0,2,0,0,0,0|2,0,0]=4 2563 B13R0.1170 CCC=CCCC(C)NCC(O)CC m_269862__11354032__17320678 [0,2,0,0,0,0|2,0,0]=4 2564 B13R0.1170 CCCCCCC(C)COC(=O)CC m_276436__14084316__14101862 [0,2,0,0,0,0|2,0,0]=4 2565 B13R0.1170 CCCCCCC(O)CN[C@H](C)CO m_273610__11554128__11516296 [0,2,0,0,0,0|1,0,1]=4 2566 B13R0.1170 CCCCOCC(O)CNC(=O)CO m_22__24630064__7941800 [0,2,0,0,0,0|2,0,0]=4 2567 B13R0.1171 CCC=CCCN(C)C(C)CCCC m_2230__10346846__8859726 [0,2,0,0,0,0|2,0,0]=4 2568 B13R0.1171 CCC=CCNC(C)C(C)CCCC m_269862__17312576__10267058 [0,2,0,0,0,0|2,0,0]=4 2569 B13R0.1171 CCCCC(C)C(=O)NCC=CCO m_527__11971536__9818850 [0,2,0,0,0,0|1,0,1]=4 2570 B13R0.1171 CCCCC(C)C(=O)OCC=CCO m_1458__9818856__16809274 [0,2,0,0,0,0|1,0,1]=4 2571 B13R0.1171 CCCCC(C)C(C)NC/C=C\CN m_272690__21478164__11348918 [0,2,0,0,0,0|2,0,0]=4 2572 B13R0.1171 CCCCC(C)C(C)NCC=CCO m_270004__11971554__10267060 [0,2,0,0,0,0|1,0,0]=3 2573 B13R0.1171 CCCCC(F)C(=O)NCC=CCO m_22__11971526__24596578 [0,2,0,0,0,0|1,0,1]=4 2574 B13R0.1171 CCCCC(N)C(=O)NCC=CCO m_240690__11979432__7676544 [0,2,0,0,0,0|1,0,1]=4 2575 B13R0.1171 CCCCC(O)C(=O)NCC=CCO m_22__11971526__9823424 [0,2,0,0,0,0|1,0,1]=4 2576 B13R0.1171 CCCCCCN(C)C(=O)C=CCO m_22__20842592__13570734 [0,2,0,0,0,0|1,0,1]=4 2577 B13R0.1171 CCCC[C@@H](O)C(=O)NCC=CCO m_22__11971526__20826292 [0,2,0,0,0,0|1,0,1]=4 2578 B13R0.113 C=C(CO)CCNCC(C)CCCC m_270004__17763614__24715008 [0,2,0,0,0,0|1,0,1]=4 2579 B13R0.113 CCCCC(C)NCCNC(=O)CO m_270004__24793754__8844922 [0,2,0,0,0,0|2,0,0]=4 2580 B13R0.119 CC(C)CCCCNC(=O)C=CCO m_22__22609478__13570734 [0,2,0,0,0,0|1,0,1]=4 2581 B13R0.154 CC(C)CCC(O)CNCC=CCO m_273610__13857830__11516318 [0,2,0,0,0,0|1,0,0]=3 2582 B13R0.154 CC(C)OCC(O)CNCC=CCO m_273610__13857830__11515930 [0,2,0,0,0,0|2,0,0]=4 2583 B13R0.154 CC/C=C\CCCN(C)CC[C@H](C)O m_270004__18186228__24594278 [0,2,0,0,0,0|2,0,0]=4 2584 B13R0.154 CCC=CCCNC(C)CCC(C)C m_2230__22397544__8859726 [0,2,0,0,0,0|2,0,0]=4 2585 B13R0.154 CCC=CCCSC(C)CCC(C)C m_62__8859720__13655718 [0,2,0,0,0,0|2,0,0]=4 2586 B13R0.154 CCC=CCNCC(O)CCC(C)C m_273610__17312600__11516318 [0,2,0,0,0,0|2,0,0]=4 2587 B13R0.154 CCCCCCCC(C)NCC(C)O m_270004__8288774__8844930 [0,2,0,0,0,0|1,0,1]=4 2588 B13R0.176 CCCCC(C)CCC(C)NCCO m_270004__8349608__24709324 [0,2,0,0,0,0|1,0,1]=4 2589 B13R0.176 CCCCC(O)CNC(=O)C=CCO m_22__24192092__13570734 [0,2,0,0,0,0|1,0,1]=4 2590 B13R0.272 CC/C=C\C(CO)NCCCCCC m_270004__24790136__24715030 [0,2,0,0,0,0|2,0,0]=4 2591 B13R0.272 CC/C=C\CCCN(CC)CCCC m_270004__8128034__24594278 [0,2,0,0,0,0|2,0,0]=4 2592 B13R0.272 CCC=CCCNC(CC)CCCC m_2230__22397214__8859726 [0,2,0,0,0,0|2,0,0]=4 2593 B13R0.272 CCCCC(CC)CSCC=CCO m_7__22987610__16809272 [0,2,0,0,0,0|1,0,0]=3 2594 B13R0.274 C=C(CO)CN(C)CCCCCCC m_2230__22407266__15422660 [0,2,0,0,0,0|1,0,1]=4 2595 B13R0.274 CC/C=C\CCCN(C)CC(C)CC m_270004__8137718__24594278 [0,2,0,0,0,0|2,0,0]=4 2596 B13R0.274 CC/C=C\CCCN(C)CC(O)CC m_270004__15766966__24594278 [0,2,0,0,0,0|2,0,0]=4 2597 B13R0.274 CCC=CCCNC(C)CC(C)CC m_2230__22399368__8859726 [0,2,0,0,0,0|2,0,0]=4 2598 B13R0.274 CCCCCCCC(C)N[C@H](C)CO m_270004__8291226__8844930 [0,2,0,0,0,0|1,0,1]=4 2599 B13R0.274 CCCCCCNC(=O)/C=C(\C)/CO m_22__303720__24596156 [0,2,0,0,0,0|1,0,1]=4 2600 B13R0.689 CCC=CCCNC(C)(C)CCCC m_2230__22397646__8859726 [0,2,0,0,0,0|2,0,0]=4 2601 B13R0.150 CC/C=C\CCCCCN(C)C(C)C m_270004__8128012__24594274 [0,2,0,0,0,0|2,0,0]=4 2602 B13R0.150 CC/C=C\CCCNCC(C)C(C)C m_270004__16787178__24594278 [0,2,0,0,0,0|2,0,0]=4 2603 B13R0.150 CC/C=C\CCCNCC(C)C(C)O m_270004__23847178__24594278 [0,2,0,0,0,0|2,0,0]=4 2604 B13R0.150 CC/C=C\CCCNCC(O)C(C)C m_270004__8297030__24594278 [0,2,0,0,0,0|2,0,0]=4 2605 B13R0.150 CCCCCCCCNC(=O)C(C)C m_270062__9801310__13861800 [0,2,0,0,0,0|2,0,0]=4 2606 B13R0.150 CCCCCCCCNC(=O)C(C)N m_240690__21554314__3025692 [0,2,0,0,0,0|2,0,0]=4 2607 B13R0.150 CCCCCCCCNC(=O)C(Cl)Cl m_1626__22046142__22134388 [0,2,0,0,0,0|2,0,0]=4 2608 B13R0.150 CCCCCCCCNC(=O)C(F)F m_527__7793380__8765604 [0,2,0,0,0,0|2,0,0]=4 2609 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)F m_22__7793362__24597924 [0,2,0,0,0,0|2,0,0]=4 2610 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)O m_22__7793362__17541882 [0,2,0,0,0,0|1,0,0]=3 2611 B13R0.150 CCCCCCCCNC(C)C(C)O m_269862__8256904__13817824 [0,2,0,0,0,0|1,0,1]=4 2612 B13R0.150 CCCCCCCCN[C@H](C)[C@H](C)O m_2230__22400278__9282126 [0,2,0,0,0,0|1,0,1]=4 2613 B13R0.150 CCCCCCCCOC(=O)C(C)Br m_1458__23414716__9282120 [0,2,0,0,0,0|2,0,0]=4 2614 B13R0.150 CCCCCCCCOC(=O)C(C)C m_276436__14076610__14088334 [0,2,0,0,0,0|2,0,0]=4 2615 B13R0.150 CCCCCCCCSC(C)C(C)O m_7__6286572__9282116 [0,2,0,0,0,0|1,0,1]=4 2616 B13R0.150 CCCCOCCCNC(=O)[C@@H](C)O m_22__58053__17541882 [0,2,0,0,0,0|2,0,0]=4 2617 B13R0.150 COCCCCCCNC(=O)[C@@H](C)O m_22__20613092__17541882 [0,2,0,0,0,0|2,0,0]=4 2618 B13R0.150 CSCCCCCCNC(=O)[C@@H](C)O m_22__8686110__17541882 [0,2,0,0,0,0|2,0,0]=4 2619 B13R0.150 C[C@@H](O)C(=O)NCCCCCCCO m_22__13810888__17541882 [0,2,0,0,0,0|2,0,0]=4 2620 B13R0.179 CC(C)CCCCCCNCC(C)O m_273610__11517610__11516404 [0,2,0,0,0,0|1,0,1]=4 2621 B13R0.179 CC(C)CCCCNCC=CC(=O)O m_271304__15608264__16776030 [0,2,0,0,0,0|1,0,1]=4 2622 B13R0.202 C=C(CO)CCNCCCCC(C)C m_270004__17763614__12202092 [0,2,0,0,0,0|1,0,1]=4 2623 B13R0.202 CC(=O)CCCCCCNC(=O)CO m_22__11560710__7941800 [0,2,0,0,0,0|1,0,1]=4 2624 B13R0.202 CC(C)CCCCCCNC(=O)CN m_270006__8381972__10128098 [0,2,0,0,0,0|2,0,0]=4 2625 B13R0.202 CC(C)CCCCCCNC(=O)CO m_22__505538__7941800 [0,2,0,0,0,0|1,0,0]=3 2626 B13R0.202 CC(C)CCCCCCNC(C)CO m_269862__7192674__15157990 [0,2,0,0,0,0|1,0,1]=4 2627 B13R0.202 CC(C)CCCNCCNC(=O)CO m_270004__24793754__9139706 [0,2,0,0,0,0|2,0,0]=4 2628 B13R0.202 CC(C)CCOCCCNC(=O)CO m_22__14244378__7941800 [0,2,0,0,0,0|2,0,0]=4 2629 B13R0.202 CCC(=O)NCCCCCCC(C)C m_270062__7599090__22005658 [0,2,0,0,0,0|2,0,0]=4 2630 B13R0.202 CN(C)CCCCCCNC(=O)CO m_22__15109862__7941800 [0,2,0,0,0,0|2,0,0]=4 2631 B13R0.280 CC(C)(C)OCCCSCC=CCO m_7__17838532__16809272 [0,2,0,0,0,0|2,0,0]=4 2632 B13R0.280 CC/C=C\CCCNCCC(C)(C)C m_270004__8289624__24594278 [0,2,0,0,0,0|2,0,0]=4 2633 B13R0.280 CC/C=C\CCCNCCC(C)(C)F m_270004__11987206__24594278 [0,2,0,0,0,0|2,0,0]=4 2634 B13R0.280 CC/C=C\CCCNCCC(C)(C)O m_270004__8992694__24594278 [0,2,0,0,0,0|2,0,0]=4 2635 B13R0.280 CC/C=C\CCCNCCC(C)(F)F m_270004__10640010__24594278 [0,2,0,0,0,0|2,0,0]=4 2636 B13R0.280 CCC=CCCSCCCC(C)(C)C m_62__9106512__8859722 [0,2,0,0,0,0|2,0,0]=4 2637 B13R0.280 CCC=CCCSCCCC(C)(F)F m_62__13153472__8859722 [0,2,0,0,0,0|2,0,0]=4 2638 B13R0.280 CCCCCCCCSCC(C)(C)O m_7__22987452__9282116 [0,2,0,0,0,0|1,0,1]=4 2639 B13R0.201 CCN(C)CCCCCNC(=O)CO m_22__16505806__7941800 [0,2,0,0,0,0|2,0,0]=4 2640 B13R0.412 C#CC(CC)CNCCC/C=C\CC m_270004__24793470__24594278 [0,2,0,0,0,0|2,0,0]=4 2641 B13R0.412 C#CC(CO)NCCCCCCCC m_2230__22400962__9282126 [0,2,0,0,0,0|1,0,1]=4 2642 B13R0.412 C=C[C@H](CO)NCCCCCCCC m_2230__12111600__9282126 [0,2,0,0,0,0|1,0,1]=4 2643 B13R0.412 CC/C=C\CCCCCN(CC)CC m_270004__8127954__24594274 [0,2,0,0,0,0|2,0,0]=4 2644 B13R0.412 CC/C=C\CCCNCC(C#N)CC m_270004__23836852__24594278 [0,2,0,0,0,0|2,0,0]=4 2645 B13R0.412 CC/C=C\CCCNCC(CC)CC m_270004__14650198__24594278 [0,2,0,0,0,0|2,0,0]=4 2646 B13R0.412 CC/C=C\CCCNCC(CC)CO m_270004__14523572__24594278 [0,2,0,0,0,0|2,0,0]=4 2647 B13R0.412 CC/C=C\CCCNCC(CC)OC m_270004__10345658__24594278 [0,2,0,0,0,0|2,0,0]=4 2648 B13R0.412 CCC=CCCSCCC(CC)CC m_7__22987542__8859716 [0,2,0,0,0,0|2,0,0]=4 2649 B13R0.412 CCCCCCCCNC(CC)CO m_2230__13047752__9282126 [0,2,0,0,0,0|1,0,1]=4 2650 B13R0.412 CCCCCCCCNC(CN)CO m_269982__22505370__22488850 [0,2,0,0,0,0|1,0,1]=4 2651 B13R0.412 CCCCCCCCNC(CO)CO m_2230__10738176__9282126 [0,2,0,0,0,0|1,0,1]=4 2652 B13R0.412 CCCCCCCCN[C@@H](CO)CF m_2230__22400244__9282126 [0,2,0,0,0,0|1,0,1]=4 2653 B13R0.1215 CC/C=C\CCCNCC(C)(C)CC m_270004__9320570__24594278 [0,2,0,0,0,0|2,0,0]=4 2654 B13R0.1215 CC/C=C\CCCNCC(C)(O)CC m_270004__15429118__24594278 [0,2,0,0,0,0|2,0,0]=4 2655 B13R0.1215 CCC=CCCSCCC(C)(C)CC m_62__11972488__8859722 [0,2,0,0,0,0|2,0,0]=4 2656 B13R0.1215 CCCCCCCCNC(C)(C)CO m_2230__3081244__9282126 [0,2,0,0,0,0|1,0,1]=4 2657 B13R0.1215 CCCCCCCCSC(C)(C)CO m_7__22987538__9282116 [0,2,0,0,0,0|1,0,1]=4 2658 B11R1.4 Br/C=C\CSCC1CCCC1 m_7__22544354__783024 [1,0,0,1,0,0|2,0,0]=4 2659 B11R1.4 BrC=CCCNC1CCCC1 m_207__16490010__121596 [1,0,0,1,0,0|2,0,0]=4 2660 B11R1.4 C/C=C/CCNC1CCCC1 m_270004__23849830__8157302 [1,0,0,1,0,0|1,0,0]=3 2661 B11R1.4 C/C=C/CCNC1CCOC1 m_270004__23849830__8157394 [1,0,0,1,0,0|2,0,0]=4 2662 B11R1.4 C/C=C/CCNC1CCSC1 m_270004__23849830__8157326 [1,0,0,1,0,0|2,0,0]=4 2663 B11R1.4 C/C=C/CCSC1CCCC1 m_62__23858414__10178584 [1,0,0,1,0,0|1,0,0]=3 2664 B11R1.4 C/C=C/CCSC1CCOC1 m_62__23858414__10903820 [1,0,0,1,0,0|2,0,0]=4 2665 B11R1.4 C/C=C/CCSC1CCSC1 m_7__15266840__23858408 [1,0,0,1,0,0|2,0,0]=4 2666 B11R1.4 C/C=C/CCS[C@H]1CCNC1 m_7__22987620__23858408 [1,0,0,1,0,0|2,0,0]=4 2667 B11R1.4 CC=CCCCN1CCCC1 m_2230__678722__16975682 [1,0,0,1,0,0|1,0,0]=3 2668 B11R1.4 CC=CCNCC1CCSC1 m_207__14317866__9438738 [1,0,0,1,0,0|2,0,0]=4 2669 B11R1.4 CC=CCSCC1CCCC1 m_62__4275932__8766438 [1,0,0,1,0,0|1,0,0]=3 2670 B11R1.4 CC=CCSCC1CCCO1 m_62__4275932__9419582 [1,0,0,1,0,0|2,0,0]=4 2671 B11R1.4 CC=CCSCC1CCOC1 m_62__4275932__8794298 [1,0,0,1,0,0|2,0,0]=4 2672 B11R1.4 CCC=CCCN1CCCC1 m_2230__678722__8859726 [1,0,0,1,0,0|2,0,0]=4 2673 B11R1.4 CCC=CCNC1CCCC1 m_207__17312546__121596 [1,0,0,1,0,0|2,0,0]=4 2674 B11R1.4 CCCCCCN1CC=CC1 m_270004__24150350__24715030 [1,0,0,1,0,0|1,0,0]=3 2675 B11R1.4 CCCCCSC1CC=CC1 m_62__5063390__16736522 [1,0,0,1,0,0|1,0,0]=3 2676 B11R1.4 CCCCNCC1CC=CC1 m_270004__8289202__15765768 [1,0,0,1,0,0|1,0,0]=3 2677 B11R1.4 CCCCSCC1C=CCC1 m_62__875776__14322920 [1,0,0,1,0,0|2,0,0]=4 2678 B11R1.4 CCCCSCC1CC=CC1 m_62__875776__12108678 [1,0,0,1,0,0|1,0,0]=3 2679 B11R1.4 CCCCSCC1CCCO1 m_62__875776__9419582 [1,0,0,1,0,0|1,0,1]=4 2680 B11R1.4 CCCNCCC1C=CCC1 m_270004__8288780__24714984 [1,0,0,1,0,0|2,0,0]=4 2681 B11R1.4 CCCNCCC1CCCO1 m_270004__8288780__24594190 [1,0,0,1,0,0|1,0,1]=4 2682 B11R1.4 CCCSCCC1CCCO1 m_62__875778__9194610 [1,0,0,1,0,0|1,0,1]=4 2683 B11R1.4 CCNCCCC1C=CCC1 m_270004__12854932__24715004 [1,0,0,1,0,0|2,0,0]=4 2684 B11R1.4 CCNCCCC1CCCC1 m_270004__8160850__14924996 [1,0,0,1,0,0|1,0,1]=4 2685 B11R1.4 CCNCCCN1CC=CC1 m_270004__23847172__24715004 [1,0,0,1,0,0|2,0,0]=4 2686 B11R1.4 CCNCCSC1CC=CC1 m_7__22986872__16736518 [1,0,0,1,0,0|2,0,0]=4 2687 B11R1.4 CCOCCSC1CC=CC1 m_62__204255__16736522 [1,0,0,1,0,0|2,0,0]=4 2688 B11R1.4 CCSCCCC1CCCC1 m_62__875846__15113694 [1,0,0,1,0,0|1,0,1]=4 2689 B11R1.4 CCSCCNC1CC=CC1 m_270004__11688256__8765926 [1,0,0,1,0,0|2,0,0]=4 2690 B11R1.4 CCSCCSC1CC=CC1 m_7__8765656__16736518 [1,0,0,1,0,0|2,0,0]=4 2691 B11R1.4 CNCCSCC1CC=CC1 m_7__22986920__12108670 [1,0,0,1,0,0|2,0,0]=4 2692 B11R1.4 COCCCNC1CC=CC1 m_270004__11688256__24710510 [1,0,0,1,0,0|2,0,0]=4 2693 B11R1.4 COCCCSC1CC=CC1 m_62__9108898__16736522 [1,0,0,1,0,0|2,0,0]=4 2694 B11R1.4 COCCNCC1CC=CC1 m_270004__8288600__15765768 [1,0,0,1,0,0|2,0,0]=4 2695 B11R1.4 COCCSCC1CC=CC1 m_62__524272__12108678 [1,0,0,1,0,0|2,0,0]=4 2696 B11R1.4 CSCCCSC1CC=CC1 m_7__10890048__16736518 [1,0,0,1,0,0|2,0,0]=4 2697 B11R1.4 CSCCNCC1CC=CC1 m_270004__11963796__15765768 [1,0,0,1,0,0|2,0,0]=4 2698 B11R1.4 CSCCSCC1CC=CC1 m_62__12108676__8268572 [1,0,0,1,0,0|2,0,0]=4 2699 B11R1.4 ClCCCCCN1CC=CC1 m_270004__24150350__24721510 [1,0,0,1,0,0|2,0,0]=4 2700 B11R1.4 ClCCCCNC1CC=CC1 m_270004__11688256__24721168 [1,0,0,1,0,0|2,0,0]=4 2701 B11R1.4 FCCCCSC1CC=CC1 m_62__10157914__16736522 [1,0,0,1,0,0|2,0,0]=4 2702 B11R1.4 FCCCNCC1CC=CC1 m_270004__17065596__15765768 [1,0,0,1,0,0|2,0,0]=4 2703 B11R1.4 NC/C=C\CNC1CCCC1 m_272690__21478164__11345956 [1,0,0,1,0,0|2,0,0]=4 2704 B11R1.4 NCCCCSC1CC=CC1 m_7__20871294__16736518 [1,0,0,1,0,0|2,0,0]=4 2705 B11R1.4 NCCCSCC1CC=CC1 m_7__20871288__12108670 [1,0,0,1,0,0|2,0,0]=4 2706 B11R1.4 OCC=CCNC1CCCC1 m_207__11971532__121596 [1,0,0,1,0,0|1,0,0]=3 2707 B11R1.4 OCC=CCNC1CCOC1 m_270004__11971554__8157394 [1,0,0,1,0,0|2,0,0]=4 2708 B11R1.4 OCC=CCNC1CCSC1 m_270004__11971554__8157326 [1,0,0,1,0,0|2,0,0]=4 2709 B11R1.4 OCC=CCSC1CCCC1 m_7__27260__16809272 [1,0,0,1,0,0|1,0,0]=3 2710 B11R1.4 OCC=CCSC1CCOC1 m_7__22987382__16809272 [1,0,0,1,0,0|2,0,0]=4 2711 B11R1.4 OCC=CCSC1CCSC1 m_7__15266840__16809272 [1,0,0,1,0,0|2,0,0]=4 2712 B11R1.4 OCC=CCS[C@H]1CCNC1 m_7__22987620__16809272 [1,0,0,1,0,0|2,0,0]=4 2713 B11R1.4 OCCCCCN1CCCC1 m_2230__678722__6079162 [1,0,0,1,0,0|1,0,1]=4 2714 B11R1.4 OCCCCNC1CCCC1 m_207__9433150__121596 [1,0,0,1,0,0|1,0,1]=4 2715 B11R1.4 OCCCCSC1CC=CC1 m_7__22849690__16736518 [1,0,0,1,0,0|2,0,0]=4 2716 B11R1.4 OCCCCSC1CCCC1 m_7__27260__3191338 [1,0,0,1,0,0|1,0,1]=4 2717 B11R1.4 OCCCNCC1CC=CC1 m_270004__8288584__15765768 [1,0,0,1,0,0|2,0,0]=4 2718 B11R1.4 OCCCNCC1CCCC1 m_270004__8288584__8300536 [1,0,0,1,0,0|1,0,1]=4 2719 B11R1.4 OCCCSCC1CC=CC1 m_7__10972294__12108670 [1,0,0,1,0,0|2,0,0]=4 2720 B11R1.4 OCCCSCC1CCCC1 m_7__10972294__783024 [1,0,0,1,0,0|1,0,1]=4 2721 B11R1.4 OCCSCCC1CCCC1 m_7__22987540__102708 [1,0,0,1,0,0|1,0,1]=4 2722 B11R1.5 CC1CCCCCN1CCO m_2230__9017564__6165700 [1,0,0,1,0,0|1,0,1]=4 2723 B11R1.5 CCNC1CCCCCC1C m_2230__8960872__22383854 [1,0,0,1,0,0|1,0,1]=4 2724 B11R1.5 CCN[C@@H]1CCCCC[C@H]1O m_270004__13613470__24715004 [1,0,0,1,0,0|1,0,1]=4 2725 B11R1.5 CN1CCCCCC1CCO m_2230__9966898__2463448 [1,0,0,1,0,0|1,0,1]=4 2726 B11R1.17 CC1CCCCC1NCCO m_2230__8740226__6165700 [1,0,0,1,0,0|1,0,1]=4 2727 B11R1.17 CC1CCCCN1C/C=C\Br m_2230__678754__22384838 [1,0,0,1,0,0|2,0,0]=4 2728 B11R1.17 CC1CCCCN1CC=CCl m_2230__678754__667198 [1,0,0,1,0,0|2,0,0]=4 2729 B11R1.17 CC1CCCCN1CCCO m_2230__678754__680950 [1,0,0,1,0,0|1,0,1]=4 2730 B11R1.17 CC=CCN1CCCCC1C m_2230__678754__681024 [1,0,0,1,0,0|1,0,0]=3 2731 B11R1.17 CC=CCN1CCCC[C@H]1C m_2230__22409340__681024 [1,0,0,1,0,0|1,0,0]=3 2732 B11R1.17 CC=CCN1CCOCC1C m_2230__679548__681024 [1,0,0,1,0,0|2,0,0]=4 2733 B11R1.17 CC=CCN1CCOC[C@@H]1C m_2230__10745968__681024 [1,0,0,1,0,0|2,0,0]=4 2734 B11R1.17 CC=CCN1CCSCC1C m_2230__5359444__681024 [1,0,0,1,0,0|2,0,0]=4 2735 B11R1.17 CCCNC1CCCC=C1Br m_2230__14593418__13271112 [1,0,0,1,0,0|2,0,0]=4 2736 B11R1.17 CCCSC1CCCC=C1Br m_7__22986886__14048730 [1,0,0,1,0,0|2,0,0]=4 2737 B11R1.17 CCNCC1CCCCC1C m_270004__8292578__24715004 [1,0,0,1,0,0|1,0,1]=4 2738 B11R1.17 CCNC[C@@H]1CCCC[C@H]1O m_270004__10811224__24715004 [1,0,0,1,0,0|1,0,1]=4 2739 B11R1.17 CCSCC1CCCCC1C m_62__11946498__6469026 [1,0,0,1,0,0|1,0,1]=4 2740 B11R1.17 CN1CCCCC1CCCO m_2230__22407830__2463448 [1,0,0,1,0,0|1,0,1]=4 2741 B11R1.17 C[C@@H]1CCCCN1C/C=C\Br m_2230__22409340__22384838 [1,0,0,1,0,0|2,0,0]=4 2742 B11R1.17 C[C@@H]1CCCCN1CC=CCl m_2230__22409340__667198 [1,0,0,1,0,0|2,0,0]=4 2743 B11R1.17 C[C@@H]1CCCCN1CCCO m_2230__22409340__680950 [1,0,0,1,0,0|1,0,1]=4 2744 B11R1.18 CC=CCN1CCCC1CC m_2230__4599928__681024 [1,0,0,1,0,0|1,0,0]=3 2745 B11R1.18 CC=CCN1CCCC1CO m_2230__3379024__681024 [1,0,0,1,0,0|2,0,0]=4 2746 B11R1.18 CC=CCN1CCC[C@H]1CF m_2230__17313732__681024 [1,0,0,1,0,0|2,0,0]=4 2747 B11R1.18 CCC1CCCC1NCCO m_2230__9296238__6165700 [1,0,0,1,0,0|1,0,1]=4 2748 B11R1.18 CCC1CCCN1C/C=C\Br m_2230__4599928__22384838 [1,0,0,1,0,0|2,0,0]=4 2749 B11R1.18 CCC1CCCN1CC=CCl m_2230__4599928__667198 [1,0,0,1,0,0|2,0,0]=4 2750 B11R1.18 CCC1CCCN1CCCO m_2230__4599928__680950 [1,0,0,1,0,0|1,0,1]=4 2751 B11R1.18 CCCCC1CCCC1=NO m_4__388124__2990870 [1,0,0,1,0,0|1,0,0]=3 2752 B11R1.18 CCCCC1CCCC1NC m_2230__8740342__2463448 [1,0,0,1,0,0|1,0,1]=4 2753 B11R1.18 CCCCC1CCCN1CC m_270004__24176190__24715004 [1,0,0,1,0,0|1,0,1]=4 2754 B11R1.18 CCCCN1CCCC1CO m_2230__3379024__22993830 [1,0,0,1,0,0|1,0,1]=4 2755 B11R1.18 CCCN[C@@H]1CCC[C@H]1CO m_2230__22399992__13271112 [1,0,0,1,0,0|1,0,1]=4 2756 B11R1.18 CCCN[C@H]1CCC[C@H]1CO m_2230__22399092__13271112 [1,0,0,1,0,0|1,0,1]=4 2757 B11R1.18 CCN1CCCC1CCCO m_270004__8135336__24715004 [1,0,0,1,0,0|1,0,1]=4 2758 B11R1.18 CCNCC1CCCC1CC m_270004__10689778__24715004 [1,0,0,1,0,0|1,0,1]=4 2759 B11R1.18 CCOCC1CCCC1=NO m_4__388124__9480088 [1,0,0,1,0,0|2,0,0]=4 2760 B11R1.18 COCCC1CCCC1=NO m_4__388124__9818058 [1,0,0,1,0,0|2,0,0]=4 2761 B11R1.18 ON=C1CCCC1CCCF m_4__388124__9870386 [1,0,0,1,0,0|2,0,0]=4 2762 B11R1.26 CCC1CCCCCCN1C m_2230__22408112__2463448 [1,0,0,1,0,0|1,0,1]=4 2763 B11R1.26 CCN1CCCCCCC1C m_270004__16908192__24715004 [1,0,0,1,0,0|1,0,1]=4 2764 B11R1.26 CNC1CCCCCC=C1F m_269862__7193148__14761812 [1,0,0,1,0,0|2,0,0]=4 2765 B11R1.28 Br/C=C\CNC1CCCCC1 m_270004__23796022__8157310 [1,0,0,1,0,0|2,0,0]=4 2766 B11R1.28 Br/C=C\CSC1CCCCC1 m_7__22544354__9868258 [1,0,0,1,0,0|2,0,0]=4 2767 B11R1.28 BrC=CCNC1CCCCC1 m_207__15075148__121598 [1,0,0,1,0,0|2,0,0]=4 2768 B11R1.28 C/C=C/CCN1CCCCC1 m_2230__679042__23858420 [1,0,0,1,0,0|1,0,0]=3 2769 B11R1.28 C/C=C/CCN1CCNCC1 m_269982__7368754__23858432 [1,0,0,1,0,0|2,0,0]=4 2770 B11R1.28 C/C=C/CCN1CCOCC1 m_2230__665308__23858420 [1,0,0,1,0,0|2,0,0]=4 2771 B11R1.28 C/C=C/CCN1CCSCC1 m_2230__848268__23858420 [1,0,0,1,0,0|2,0,0]=4 2772 B11R1.28 CC=CCNC1CCCCC1 m_207__14317866__121598 [1,0,0,1,0,0|1,0,0]=3 2773 B11R1.28 CC=CCNC1CCCSC1 m_207__14317866__9295358 [1,0,0,1,0,0|2,0,0]=4 2774 B11R1.28 CC=CCNC1CCOCC1 m_207__14317866__5624874 [1,0,0,1,0,0|2,0,0]=4 2775 B11R1.28 CC=CCNC1CCSCC1 m_207__14317866__121623 [1,0,0,1,0,0|2,0,0]=4 2776 B11R1.28 CCCCCN1CC=CCC1 m_2230__8375936__5063396 [1,0,0,1,0,0|1,0,0]=3 2777 B11R1.28 CCCNCC1CC=CCC1 m_207__109413__121213 [1,0,0,1,0,0|1,0,0]=3 2778 B11R1.28 CCCNCC1CCC=CO1 m_270004__8288780__9139666 [1,0,0,1,0,0|1,0,0]=3 2779 B11R1.28 CCCSCC1CCCCO1 m_62__875778__524424 [1,0,0,1,0,0|1,0,1]=4 2780 B11R1.28 CCCSCC1CCOCO1 m_7__22986886__6019 [1,0,0,1,0,0|2,0,0]=4 2781 B11R1.28 CCCSC[C@@H]1CC=CCC1 m_62__875778__23045122 [1,0,0,1,0,0|1,0,0]=3 2782 B11R1.28 CCNCCC1CC=CCC1 m_270004__12299622__24715004 [1,0,0,1,0,0|1,0,0]=3 2783 B11R1.28 CCNCCC1CCCCC1 m_270004__8160850__9139688 [1,0,0,1,0,0|1,0,1]=4 2784 B11R1.28 CCNCCC1CCCCO1 m_270004__8160850__17567356 [1,0,0,1,0,0|1,0,1]=4 2785 B11R1.28 CCNCCN1CC=CCC1 m_270004__9582278__24715004 [1,0,0,1,0,0|2,0,0]=4 2786 B11R1.28 CCOCCN1CC=CCC1 m_2230__8375936__681188 [1,0,0,1,0,0|2,0,0]=4 2787 B11R1.28 CCSCCC1CCCCC1 m_62__875846__21208858 [1,0,0,1,0,0|1,0,1]=4 2788 B11R1.28 CCSCCC1CCCCO1 m_62__875846__11985416 [1,0,0,1,0,0|1,0,1]=4 2789 B11R1.28 CCSCCN1CC=CCC1 m_2230__8375936__5530594 [1,0,0,1,0,0|2,0,0]=4 2790 B11R1.28 CNCCCN1CC=CCC1 m_269982__22517040__9707534 [1,0,0,1,0,0|2,0,0]=4 2791 B11R1.28 COCCCN1CC=CCC1 m_2230__8375936__9108922 [1,0,0,1,0,0|2,0,0]=4 2792 B11R1.28 CSCCCC1CCCCC1 m_62__875850__13430106 [1,0,0,1,0,0|1,0,1]=4 2793 B11R1.28 CSCCCN1CC=CCC1 m_2230__8375936__6165706 [1,0,0,1,0,0|2,0,0]=4 2794 B11R1.28 ClC=CCNC1CCCCC1 m_270004__13448032__8157310 [1,0,0,1,0,0|2,0,0]=4 2795 B11R1.28 ClC=CCSC1CCCCC1 m_7__27197__5103 [1,0,0,1,0,0|2,0,0]=4 2796 B11R1.28 ClCCCCN1CC=CCC1 m_270004__8375948__24721168 [1,0,0,1,0,0|2,0,0]=4 2797 B11R1.28 FCCCCN1CC=CCC1 m_2230__8375936__10157922 [1,0,0,1,0,0|2,0,0]=4 2798 B11R1.28 FCCNCC1CC=CCC1 m_207__18491578__121213 [1,0,0,1,0,0|2,0,0]=4 2799 B11R1.28 NC/C=C/CN1CCCCC1 m_269982__7374328__22485940 [1,0,0,1,0,0|2,0,0]=4 2800 B11R1.28 NCCSC[C@@H]1CC=CCC1 m_7__20871276__23045116 [1,0,0,1,0,0|2,0,0]=4 2801 B11R1.28 OCC=CCN1CCCCC1 m_2230__679042__16809276 [1,0,0,1,0,0|1,0,0]=3 2802 B11R1.28 OCC=CCN1CCNCC1 m_269982__7368754__16809282 [1,0,0,1,0,0|2,0,0]=4 2803 B11R1.28 OCC=CCN1CCOCC1 m_2230__665308__16809276 [1,0,0,1,0,0|2,0,0]=4 2804 B11R1.28 OCC=CCN1CCSCC1 m_2230__848268__16809276 [1,0,0,1,0,0|2,0,0]=4 2805 B11R1.28 OCCCCN1CC=CCC1 m_2230__8375936__3191342 [1,0,0,1,0,0|2,0,0]=4 2806 B11R1.28 OCCCCN1CCCCC1 m_2230__679042__3191342 [1,0,0,1,0,0|1,0,1]=4 2807 B11R1.28 OCCCNC1CCCCC1 m_207__109475__121598 [1,0,0,1,0,0|1,0,1]=4 2808 B11R1.28 OCCCSC1CCCCC1 m_7__27197__6354 [1,0,0,1,0,0|1,0,1]=4 2809 B11R1.28 OCCNCC1CC=CCC1 m_207__121484__121213 [1,0,0,1,0,0|2,0,0]=4 2810 B11R1.28 OCCNCC1CCC=CO1 m_270004__8349608__9139666 [1,0,0,1,0,0|2,0,0]=4 2811 B11R1.28 OCCNCC1CCCCC1 m_207__121484__121242 [1,0,0,1,0,0|1,0,1]=4 2812 B11R1.28 OCCSCC1CCCCC1 m_7__2303152__102708 [1,0,0,1,0,0|1,0,1]=4 2813 B11R1.28 OCCSC[C@@H]1CC=CCC1 m_62__23045120__10178562 [1,0,0,1,0,0|2,0,0]=4 2814 B11R1.28 ON=CCCC1CCCCC1 m_4__388124__9316218 [1,0,0,1,0,0|1,0,0]=3 2815 B11R1.28 ON=CCCC1CCOCC1 m_4__388124__8803226 [1,0,0,1,0,0|2,0,0]=4 2816 B11R1.41 CCC1CCCCC1C=NO m_4__388124__11560886 [1,0,0,1,0,0|1,0,0]=3 2817 B11R1.41 CCC1CCCCN1CCO m_2230__1722000__6165700 [1,0,0,1,0,0|1,0,1]=4 2818 B11R1.41 CCCC1CCCCC1=NO m_4__388124__11571974 [1,0,0,1,0,0|1,0,0]=3 2819 B11R1.41 CCCC1CCCCC1NC m_269862__7193148__11571976 [1,0,0,1,0,0|1,0,1]=4 2820 B11R1.41 CCCC1CCCCN1CC m_270004__8750850__24715004 [1,0,0,1,0,0|1,0,1]=4 2821 B11R1.41 CCCN1CCCCC1CO m_2230__804372__13271112 [1,0,0,1,0,0|1,0,1]=4 2822 B11R1.41 CCN1CCCCC1CCO m_2230__3225030__22383854 [1,0,0,1,0,0|1,0,1]=4 2823 B11R1.41 CCNC1CCCCC1CC m_269862__7865270__8583362 [1,0,0,1,0,0|1,0,1]=4 2824 B11R1.41 CCN[C@@H]1CCCC[C@@H]1CO m_270004__23044934__24715004 [1,0,0,1,0,0|1,0,1]=4 2825 B11R1.41 CCN[C@@H]1CCCC[C@H]1CO m_2230__9438960__22383854 [1,0,0,1,0,0|1,0,1]=4 2826 B11R1.41 CN[C@H]1CCCC[C@H]1CCO m_2230__13770344__2463448 [1,0,0,1,0,0|1,0,1]=4 2827 B11R1.46 C/C=C/CCNCC1CC1C m_270004__23849830__9139722 [1,0,0,1,0,0|1,0,0]=3 2828 B11R1.46 C/C=C/CCNCC1CC1Cl m_270004__23849830__15344010 [1,0,0,1,0,0|2,0,0]=4 2829 B11R1.46 C/C=C/CCSCC1CC1C m_62__23858414__12216594 [1,0,0,1,0,0|1,0,0]=3 2830 B11R1.46 C/C=C/CCSC[C@@H]1C[C@H]1C m_62__23858414__23861442 [1,0,0,1,0,0|1,0,0]=3 2831 B11R1.46 CC1CC1CCCSCCO m_7__18317424__102708 [1,0,0,1,0,0|1,0,1]=4 2832 B11R1.46 CC1CC1CNCCC=CBr m_270004__16490042__9139722 [1,0,0,1,0,0|2,0,0]=4 2833 B11R1.46 CC1CC1CNCCCCO m_270004__9433178__9139722 [1,0,0,1,0,0|1,0,1]=4 2834 B11R1.46 CC1CC1CSCCCCO m_7__22849690__12216586 [1,0,0,1,0,0|1,0,1]=4 2835 B11R1.46 CCNCCCCC1CC1C m_270004__21499558__24715004 [1,0,0,1,0,0|1,0,1]=4 2836 B11R1.46 CCSCCCCC1CC1C m_7__22987818__5047 [1,0,0,1,0,0|1,0,1]=4 2837 B11R1.46 C[C@H]1C[C@@H]1CSCCCCO m_7__22849690__23861434 [1,0,0,1,0,0|1,0,1]=4 2838 B11R1.46 C[C@H]1C[C@H]1CCCNCCO m_270004__8349608__24714994 [1,0,0,1,0,0|1,0,1]=4 2839 B11R1.47 Br/C=C\CSCCC1CCC1 m_7__22544354__12121628 [1,0,0,1,0,0|2,0,0]=4 2840 B11R1.47 BrC=CCCNCC1CCC1 m_270004__16490042__24715052 [1,0,0,1,0,0|2,0,0]=4 2841 B11R1.47 C/C=C/CCNCC1CCC1 m_270004__23849830__24715052 [1,0,0,1,0,0|1,0,0]=3 2842 B11R1.47 C/C=C/CCNCC1COC1 m_270004__23849830__22332604 [1,0,0,1,0,0|2,0,0]=4 2843 B11R1.47 C/C=C/CCSCC1CCC1 m_62__23858414__6007778 [1,0,0,1,0,0|1,0,0]=3 2844 B11R1.47 C/C=C/CCSCC1COC1 m_62__23858414__16613884 [1,0,0,1,0,0|2,0,0]=4 2845 B11R1.47 CC=CCCCNC1COC1 m_269862__17054556__7931470 [1,0,0,1,0,0|2,0,0]=4 2846 B11R1.47 CC=CCCCSC1CCC1 m_7__10684076__16975672 [1,0,0,1,0,0|1,0,0]=3 2847 B11R1.47 CC=CCCCSC1CNC1 m_7__22987816__16975672 [1,0,0,1,0,0|2,0,0]=4 2848 B11R1.47 CC=CCCCSC1COC1 m_7__13420946__16975672 [1,0,0,1,0,0|2,0,0]=4 2849 B11R1.47 CC=CCCCSC1CSC1 m_7__20064714__16975672 [1,0,0,1,0,0|2,0,0]=4 2850 B11R1.47 CC=CCSCCC1CCC1 m_62__4275932__12121634 [1,0,0,1,0,0|1,0,0]=3 2851 B11R1.47 CCC=CCCSC1CCC1 m_7__10684076__8859716 [1,0,0,1,0,0|2,0,0]=4 2852 B11R1.47 CCCCCSC[C@H]1CCO1 m_7__8271838__17058812 [1,0,0,1,0,0|1,0,1]=4 2853 B11R1.47 ClC=CCSCCC1CCC1 m_7__22987652__5103 [1,0,0,1,0,0|2,0,0]=4 2854 B11R1.47 OCC=CCNCC1COC1 m_207__11971532__22332602 [1,0,0,1,0,0|2,0,0]=4 2855 B11R1.47 OCC=CCSCC1COC1 m_7__22987642__16809272 [1,0,0,1,0,0|2,0,0]=4 2856 B11R1.47 OCCCCCSC1CCC1 m_7__10684076__6079158 [1,0,0,1,0,0|1,0,1]=4 2857 B11R1.47 OCCCCNCC1CCC1 m_270004__9433178__24715052 [1,0,0,1,0,0|1,0,1]=4 2858 B11R1.47 OCCCCSCC1CCC1 m_7__22849690__6078530 [1,0,0,1,0,0|1,0,1]=4 2859 B11R1.47 OCCCSCCC1CCC1 m_7__22987652__6354 [1,0,0,1,0,0|1,0,1]=4 2860 B11R1.47 OCCNCCCC1CCC1 m_270004__8349608__18051886 [1,0,0,1,0,0|1,0,1]=4 2861 B11R1.47 OCCSCCCC1CCC1 m_7__22987742__102708 [1,0,0,1,0,0|1,0,1]=4 2862 B11R1.51 CCC1CCCCCC1=NO m_4__388124__13610260 [1,0,0,1,0,0|1,0,0]=3 2863 B11R1.51 CCC1CCCCCC1NC m_269862__7193148__13610262 [1,0,0,1,0,0|1,0,1]=4 2864 B11R1.51 CCC1CCCCCN1CC m_270004__8138650__24715004 [1,0,0,1,0,0|1,0,1]=4 2865 B11R1.51 CCN1CCCCCC1CO m_270004__11756832__24715004 [1,0,0,1,0,0|1,0,1]=4 2866 B11R1.51 CNC1CCCCCC1CO m_2230__24001472__2463448 [1,0,0,1,0,0|1,0,1]=4 2867 B11R1.99 Br/C=C\CSCCCC1CC1 m_7__22544354__16975596 [1,0,0,1,0,0|2,0,0]=4 2868 B11R1.99 BrC=CCCNCCC1CC1 m_270004__16490042__13455800 [1,0,0,1,0,0|2,0,0]=4 2869 B11R1.99 C/C=C/CCNCCC1CC1 m_270004__23849830__13455800 [1,0,0,1,0,0|1,0,0]=3 2870 B11R1.99 C/C=C/CCSCCC1CC1 m_62__23858414__9143162 [1,0,0,1,0,0|1,0,0]=3 2871 B11R1.99 CC=CCCCNCC1CC1 m_207__17054526__2989440 [1,0,0,1,0,0|1,0,0]=3 2872 B11R1.99 CC=CCCCSCC1CC1 m_62__16975676__7141822 [1,0,0,1,0,0|1,0,0]=3 2873 B11R1.99 CC=CCSCCCC1CC1 m_62__4275932__12641598 [1,0,0,1,0,0|1,0,0]=3 2874 B11R1.99 CC=CCSCCOC1CC1 m_62__4275932__13445166 [1,0,0,1,0,0|2,0,0]=4 2875 B11R1.99 CCC=CCCSCC1CC1 m_62__8859720__7141822 [1,0,0,1,0,0|2,0,0]=4 2876 B11R1.99 CCNCCCCCC1CC1 m_270004__8160850__24715076 [1,0,0,1,0,0|1,0,1]=4 2877 B11R1.99 CCSCCCCCC1CC1 m_62__875846__13582082 [1,0,0,1,0,0|1,0,1]=4 2878 B11R1.99 ClC=CCSCCCC1CC1 m_7__22987332__5103 [1,0,0,1,0,0|2,0,0]=4 2879 B11R1.99 OCC=CCSCCC1CC1 m_7__18798568__16809272 [1,0,0,1,0,0|1,0,0]=3 2880 B11R1.99 OCCCCCCSC1CC1 m_7__22987858__6673274 [1,0,0,1,0,0|1,0,1]=4 2881 B11R1.99 OCCCCCNCC1CC1 m_207__9456940__2989440 [1,0,0,1,0,0|1,0,1]=4 2882 B11R1.99 OCCCCCSCC1CC1 m_7__10390288__6079158 [1,0,0,1,0,0|1,0,1]=4 2883 B11R1.99 OCCCCNCCC1CC1 m_270004__9433178__13455800 [1,0,0,1,0,0|1,0,1]=4 2884 B11R1.99 OCCCCSCCC1CC1 m_7__18798568__3191338 [1,0,0,1,0,0|1,0,1]=4 2885 B11R1.99 OCCCSCCCC1CC1 m_7__22987332__6354 [1,0,0,1,0,0|1,0,1]=4 2886 B11R1.99 OCCSCCCCC1CC1 m_62__13763130__10178562 [1,0,0,1,0,0|1,0,1]=4 2887 B11R1.101 CN1CCCCCCCCC1 m_2230__15361578__2463448 [1,0,0,1,0,0|1,0,1]=4 2888 B11R1.109 CCCC1CCCC1NCC m_269862__7865270__9452584 [1,0,0,1,0,0|1,0,1]=4 2889 B11R1.109 CCCC1CCCN1CCO m_2230__13579908__6165700 [1,0,0,1,0,0|1,0,1]=4 2890 B11R1.109 CCCN1CCCC1CCO m_2230__10893840__13271112 [1,0,0,1,0,0|1,0,1]=4 2891 B11R1.109 CCN[C@H]1CCC[C@H]1CCO m_270004__25073206__24715004 [1,0,0,1,0,0|1,0,1]=4 2892 B11R1.117 CC=CC1=CCCCCCC1 m_271570__16945674__15765696 [1,0,0,1,0,0|0,0,2]=4 2893 B11R1.117 CCNC1CCC=CCCC1 m_270004__13462464__24715004 [1,0,0,1,0,0|2,0,0]=4 2894 B11R1.117 CCNC1CCCCCCC1 m_269862__7865270__7200188 [1,0,0,1,0,0|1,0,1]=4 2895 B11R1.117 CNCC1CCCCCCC1 m_207__134027__6388778 [1,0,0,1,0,0|1,0,1]=4 2896 B11R1.117 CSCC1CCC=CCCC1 m_62__875850__15780340 [1,0,0,1,0,0|2,0,0]=4 2897 B11R1.117 OCCN1CCCCCCC1 m_2230__665322__6165700 [1,0,0,1,0,0|1,0,1]=4 2898 B11R1.117 ON=CC1CCCCCCC1 m_4__388124__7831728 [1,0,0,1,0,0|1,0,0]=3 2899 B11R1.180 C/C=C/CCN1CCCC1C m_2230__6338494__23858420 [1,0,0,1,0,0|1,0,0]=3 2900 B11R1.180 CC1CCCC1NC/C=C\Br m_2230__9296222__22384838 [1,0,0,1,0,0|2,0,0]=4 2901 B11R1.180 CC1CCCC1NCC=CBr m_207__15075148__6951098 [1,0,0,1,0,0|2,0,0]=4 2902 B11R1.180 CC1CCCC1NCC=CCl m_2230__9296222__667198 [1,0,0,1,0,0|2,0,0]=4 2903 B11R1.180 CC1CCCC1NCCCO m_2230__9296222__680950 [1,0,0,1,0,0|1,0,1]=4 2904 B11R1.180 CC1CCCN1CC=CCO m_2230__6338494__16809276 [1,0,0,1,0,0|1,0,0]=3 2905 B11R1.180 CC1CCCN1CCCCO m_2230__6338494__3191342 [1,0,0,1,0,0|1,0,1]=4 2906 B11R1.180 CC=CCNC1CCCC1C m_207__14317866__6951098 [1,0,0,1,0,0|1,0,0]=3 2907 B11R1.180 CC=CCNC1CCCC1O m_269862__14317892__15158002 [1,0,0,1,0,0|2,0,0]=4 2908 B11R1.180 CC=CCNC1CCOC1C m_207__14317866__9295352 [1,0,0,1,0,0|2,0,0]=4 2909 B11R1.180 CC=CCNC1COCC1C m_269862__14317892__13205946 [1,0,0,1,0,0|2,0,0]=4 2910 B11R1.180 CC=CCNC1CSCC1C m_269862__14317892__15343960 [1,0,0,1,0,0|2,0,0]=4 2911 B11R1.180 CC=CCN[C@H]1CCC[C@H]1C m_2230__22399140__681024 [1,0,0,1,0,0|1,0,0]=3 2912 B11R1.180 CC=CCN[C@H]1COC[C@H]1C m_2230__22403954__681024 [1,0,0,1,0,0|2,0,0]=4 2913 B11R1.180 CCCCNC1CCCC1O m_269862__7192636__15158002 [1,0,0,1,0,0|1,0,1]=4 2914 B11R1.180 CCNCC[C@@H]1CCC[C@H]1O m_270004__14730248__24715004 [1,0,0,1,0,0|1,0,1]=4 2915 B11R1.180 C[C@H]1CCC[C@@H]1CSCCO m_62__13911860__10178562 [1,0,0,1,0,0|1,0,1]=4 2916 B11R1.180 C[C@H]1CCC[C@H]1NC/C=C\Br m_2230__22399140__22384838 [1,0,0,1,0,0|2,0,0]=4 2917 B11R1.180 C[C@H]1CCC[C@H]1NCC=CCl m_2230__22399140__667198 [1,0,0,1,0,0|2,0,0]=4 2918 B11R1.180 C[C@H]1CCC[C@H]1NCCCO m_2230__22399140__680950 [1,0,0,1,0,0|1,0,1]=4 2919 B11R1.181 C/C=C/CCN1CCC1CO m_2230__13428546__23858420 [1,0,0,1,0,0|2,0,0]=4 2920 B11R1.181 CC=CCNC1CCC1CC m_269862__14317892__10177948 [1,0,0,1,0,0|1,0,0]=3 2921 B11R1.181 CC=CCNC1CCC1CO m_269862__14317892__17047872 [1,0,0,1,0,0|2,0,0]=4 2922 B11R1.181 CCC1CCC1NC/C=C\Br m_270004__23796022__10177950 [1,0,0,1,0,0|2,0,0]=4 2923 B11R1.181 CCC1CCC1NCC=CBr m_269862__15075178__10177948 [1,0,0,1,0,0|2,0,0]=4 2924 B11R1.181 CCC1CCC1NCC=CCl m_269862__13448030__10177948 [1,0,0,1,0,0|2,0,0]=4 2925 B11R1.181 CCC1CCC1NCCCO m_269862__7192678__10177948 [1,0,0,1,0,0|1,0,1]=4 2926 B11R1.181 CCCCCN1CCC1CO m_2230__13428546__5063396 [1,0,0,1,0,0|1,0,1]=4 2927 B11R1.181 CCCCNC1CCC1CO m_269862__7192636__17047872 [1,0,0,1,0,0|1,0,1]=4 2928 B11R1.181 OCC=CCN1CCC1CO m_2230__13428546__16809276 [1,0,0,1,0,0|2,0,0]=4 2929 B11R1.190 C/C=C/CCSC1CCC1O m_7__22986908__23858408 [1,0,0,1,0,0|2,0,0]=4 2930 B11R1.190 CC1CCC1NCC=CCO m_269862__11971552__9109936 [1,0,0,1,0,0|1,0,0]=3 2931 B11R1.190 CC1CCC1NCCC=CBr m_269862__16490040__9109936 [1,0,0,1,0,0|2,0,0]=4 2932 B11R1.190 CC1CCC1NCCCCO m_269862__9433176__9109936 [1,0,0,1,0,0|1,0,1]=4 2933 B11R1.190 CC=CCSC[C@@H]1CC[C@H]1O m_62__4275932__23862058 [1,0,0,1,0,0|2,0,0]=4 2934 B11R1.190 CC=CCSC[C@H]1CC[C@H]1C m_62__4275932__21674492 [1,0,0,1,0,0|1,0,0]=3 2935 B11R1.190 CCC=CCNC1CCC1C m_269862__17312576__9109936 [1,0,0,1,0,0|2,0,0]=4 2936 B11R1.190 CCCCCSC1CCC1O m_7__22986908__5063386 [1,0,0,1,0,0|1,0,1]=4 2937 B11R1.190 CCCCSC[C@@H]1CC[C@H]1O m_7__22986852__770176 [1,0,0,1,0,0|1,0,1]=4 2938 B11R1.190 C[C@H]1CC[C@H]1CSC/C=C\Br m_7__22544354__21674484 [1,0,0,1,0,0|2,0,0]=4 2939 B11R1.190 C[C@H]1CC[C@H]1CSCCCO m_7__10972294__21674484 [1,0,0,1,0,0|1,0,1]=4 2940 B11R1.190 OCC=CCSC1CCC1O m_7__22986908__16809272 [1,0,0,1,0,0|2,0,0]=4 2941 B11R1.203 Br/C=C\CN1CCCCCC1 m_2230__678972__22384838 [1,0,0,1,0,0|2,0,0]=4 2942 B11R1.203 CC=CCN1CCCCCC1 m_2230__678972__681024 [1,0,0,1,0,0|1,0,0]=3 2943 B11R1.203 CC=CCN1CCCOCC1 m_2230__6727026__681024 [1,0,0,1,0,0|2,0,0]=4 2944 B11R1.203 CC=CCN1CCCSCC1 m_2230__7912842__681024 [1,0,0,1,0,0|2,0,0]=4 2945 B11R1.203 CCCCN1CCC=CCC1 m_2230__22406010__22993830 [1,0,0,1,0,0|2,0,0]=4 2946 B11R1.203 CCCNC1CCC=CCC1 m_207__109413__17656400 [1,0,0,1,0,0|2,0,0]=4 2947 B11R1.203 CCNCC1CCC=CCC1 m_270004__13262608__24715004 [1,0,0,1,0,0|2,0,0]=4 2948 B11R1.203 CCNCC1CCCCCC1 m_207__121480__6005054 [1,0,0,1,0,0|1,0,1]=4 2949 B11R1.203 CCSCC1CCC=CCC1 m_62__875846__13460552 [1,0,0,1,0,0|2,0,0]=4 2950 B11R1.203 CCSCC1CCCCCC1 m_62__875846__8761748 [1,0,0,1,0,0|1,0,1]=4 2951 B11R1.203 CCSCC1CCCCCO1 m_7__22987770__14428538 [1,0,0,1,0,0|1,0,1]=4 2952 B11R1.203 CSCCC1CCCCCC1 m_62__875850__11763258 [1,0,0,1,0,0|1,0,1]=4 2953 B11R1.203 ClC=CCN1CCCCCC1 m_2230__678972__667198 [1,0,0,1,0,0|2,0,0]=4 2954 B11R1.203 OCCCN1CCCCCC1 m_2230__678972__680950 [1,0,0,1,0,0|1,0,1]=4 2955 B11R1.203 OCCNC1CCCCCC1 m_207__121484__121595 [1,0,0,1,0,0|1,0,1]=4 2956 B11R1.203 OCCSC1CCCCCC1 m_7__17653480__102708 [1,0,0,1,0,0|1,0,1]=4 2957 B11R1.203 ON=CCC1CCCCCC1 m_4__388124__9736608 [1,0,0,1,0,0|1,0,0]=3 2958 B11R1.229 CC=CCSC[C@@H]1C[C@H]1CC m_62__4275932__13155124 [1,0,0,1,0,0|1,0,0]=3 2959 B11R1.229 CCC1CC1CNCCCO m_270004__8288584__18234084 [1,0,0,1,0,0|1,0,1]=4 2960 B11R1.229 CC[C@H]1C[C@@H]1CNCCCO m_270004__8288584__18897550 [1,0,0,1,0,0|1,0,1]=4 2961 B11R1.229 CC[C@H]1C[C@@H]1CSC/C=C\Br m_7__22544354__13155114 [1,0,0,1,0,0|2,0,0]=4 2962 B11R1.229 CC[C@H]1C[C@@H]1CSCCCO m_7__10972294__13155114 [1,0,0,1,0,0|1,0,1]=4 2963 B11R1.248 CCN1CCCCCCCC1 m_2230__10808630__22383854 [1,0,0,1,0,0|1,0,1]=4 2964 B11R1.248 CNC1CCCCCCCC1 m_269862__7193148__16640202 [1,0,0,1,0,0|1,0,1]=4 2965 B11R1.248 ON=C1CCCCCCCC1 m_4__388124__16640196 [1,0,0,1,0,0|1,0,0]=3 2966 B13R1.6 CC1CC(CCO1)NCC=CCO m_270004__11971554__8331718 [0,1,0,1,0,0|2,0,0]=4 2967 B13R1.6 CC1CC(CCO1)SCC=CCO m_7__22988050__16809272 [0,1,0,1,0,0|2,0,0]=4 2968 B13R1.6 CC1CCCC(C1)CCSCCO m_62__7025036__10178562 [0,1,0,1,0,0|1,0,1]=4 2969 B13R1.6 CC1CCCC(C1)NC/C=C\CN m_272690__21478164__11346094 [0,1,0,1,0,0|2,0,0]=4 2970 B13R1.6 CC1CCCC(C1)NCC=CCO m_207__11971532__121616 [0,1,0,1,0,0|1,0,0]=3 2971 B13R1.6 CC1CCCC(C1)SCC=CCO m_7__2757870__16809272 [0,1,0,1,0,0|1,0,0]=3 2972 B13R1.6 CCC=CCCN1CCCC(C1)C m_2230__678730__8859726 [0,1,0,1,0,0|2,0,0]=4 2973 B13R1.6 CCC=CCCN1CCCC(C1)F m_2230__13466020__8859726 [0,1,0,1,0,0|2,0,0]=4 2974 B13R1.6 CCC=CCCN1CCCC(C1)O m_2230__678744__8859726 [0,1,0,1,0,0|2,0,0]=4 2975 B13R1.6 CCC=CCNC1CCCC(C1)C m_207__17312546__121616 [0,1,0,1,0,0|2,0,0]=4 2976 B13R1.6 CCCCCCN1CC=CC(C1)O m_2230__22405908__5530588 [0,1,0,1,0,0|1,0,0]=3 2977 B13R1.6 CCCCCCN1CCC=C(C1)Br m_2230__9785686__5530588 [0,1,0,1,0,0|2,0,0]=4 2978 B13R1.6 CCCCCCN1CCC=C(C1)C m_2230__9706914__5530588 [0,1,0,1,0,0|2,0,0]=4 2979 B13R1.6 CCCCCCN1CCC=C(C1)Cl m_2230__11676298__5530588 [0,1,0,1,0,0|2,0,0]=4 2980 B13R1.6 CCCCCCN1CCC=C(C1)F m_2230__8251980__5530588 [0,1,0,1,0,0|2,0,0]=4 2981 B13R1.6 CCCOCCN1CC=CC(C1)O m_2230__22405908__15503596 [0,1,0,1,0,0|2,0,0]=4 2982 B13R1.6 CCOCCCN1CC=CC(C1)O m_2230__22405908__5730886 [0,1,0,1,0,0|2,0,0]=4 2983 B13R1.6 CCSCCCN1CC=CC(C1)O m_2230__22405908__6165712 [0,1,0,1,0,0|2,0,0]=4 2984 B13R1.6 COCCCCN1CC=CC(C1)O m_2230__22405908__5062388 [0,1,0,1,0,0|2,0,0]=4 2985 B13R1.6 NCCCCCN1CC=CC(C1)O m_269982__22518096__22485950 [0,1,0,1,0,0|2,0,0]=4 2986 B13R1.6 OC1C=CCN(C1)CCCCCCl m_270004__24157966__24721510 [0,1,0,1,0,0|2,0,0]=4 2987 B13R1.6 OC1C=CCN(C1)CCCCCF m_2230__22405908__9984638 [0,1,0,1,0,0|2,0,0]=4 2988 B13R1.6 OCC=CCS[C@@H]1CCC[C@@H](C1)O m_7__17656074__16809272 [0,1,0,1,0,0|1,0,0]=3 2989 B13R1.6 OCCCCCN1CC=CC(C1)O m_2230__22405908__6079162 [0,1,0,1,0,0|2,0,0]=4 2990 B13R1.42 CC(=CCO)CCC1CNCCN1 m_269982__23917336__22498250 [0,1,0,1,0,0|2,0,0]=4 2991 B13R1.42 CC(=CCO)CSC1CCCCC1 m_7__27197__20765532 [0,1,0,1,0,0|1,0,0]=3 2992 B13R1.42 CC(=CCO)CSC1CCCNC1 m_7__22871154__20765532 [0,1,0,1,0,0|2,0,0]=4 2993 B13R1.42 CC(=CCO)CSC1CCCOC1 m_7__8601826__20765532 [0,1,0,1,0,0|2,0,0]=4 2994 B13R1.42 CC(=CCO)CSC1CCNCC1 m_7__22986816__20765532 [0,1,0,1,0,0|2,0,0]=4 2995 B13R1.42 CC(=CCO)CSC1CCOCC1 m_7__7834816__20765532 [0,1,0,1,0,0|2,0,0]=4 2996 B13R1.42 CC(=CCO)CSC1CCSCC1 m_7__15266834__20765532 [0,1,0,1,0,0|2,0,0]=4 2997 B13R1.42 CC(CCO)NCC1CC=CCO1 m_270004__14050670__13397824 [0,1,0,1,0,0|2,0,0]=4 2998 B13R1.42 CC/C=C(\C)/CNC1CCCCC1 m_270004__24045486__8157310 [0,1,0,1,0,0|2,0,0]=4 2999 B13R1.42 CCCC(=O)NCC1CC=CCO1 m_270062__14050672__17814498 [0,1,0,1,0,0|1,0,1]=4 3000 B13R1.42 CCCC(=O)OCC1CC=CCO1 m_276436__14085732__14088342 [0,1,0,1,0,0|1,0,1]=4 3001 B13R1.42 CCCC(C)CCN1CC=CCC1 m_270004__8375948__24594192 [0,1,0,1,0,0|2,0,0]=4 3002 B13R1.42 CCCC(C)CNC1CC=CCC1 m_270004__8296840__8300564 [0,1,0,1,0,0|2,0,0]=4 3003 B13R1.42 CCCC(C)NCC1CC=CCC1 m_207__894802__121213 [0,1,0,1,0,0|2,0,0]=4 3004 B13R1.42 CCCC(C)NCC1CC=CCO1 m_269862__14050668__7200560 [0,1,0,1,0,0|1,0,0]=3 3005 B13R1.42 CCCC(C)NC[C@@H]1CC=CCC1 m_2230__22397382__23045126 [0,1,0,1,0,0|2,0,0]=4 3006 B13R1.42 CCCC(C)SC[C@@H]1CC=CCC1 m_62__23045120__10638528 [0,1,0,1,0,0|2,0,0]=4 3007 B13R1.42 CCNC(=O)CCC1CCCCC1 m_22__57815__59188 [0,1,0,1,0,0|2,0,0]=4 3008 B13R1.42 CCOC(=O)CCC1CCCCC1 m_1458__472366__1327610 [0,1,0,1,0,0|2,0,0]=4 3009 B13R1.42 CN(CCO)CCC1CCCCC1 m_2230__2678218__6165700 [0,1,0,1,0,0|1,0,1]=4 3010 B13R1.42 COCC(C)NCC1CC=CCO1 m_270004__14050670__8844972 [0,1,0,1,0,0|2,0,0]=4 3011 B13R1.42 CSCC(C)NCC1CC=CCO1 m_269862__14050668__16464016 [0,1,0,1,0,0|2,0,0]=4 3012 B13R1.42 O=C(CCO)NCC1CCCCC1 m_487__150634__12879784 [0,1,0,1,0,0|1,0,1]=4 3013 B13R1.42 O=S(CCO)CCC1CCCCC1 m_265282__7088216__9274026 [0,1,0,1,0,0|1,0,1]=4 3014 B13R1.119 C=CC=CCCNCC1CCCC1 m_270004__12896186__8300536 [0,1,0,1,0,0|1,0,1]=4 3015 B13R1.119 C=CC=CCCSCC1CCCC1 m_62__8766436__12907968 [0,1,0,1,0,0|1,0,1]=4 3016 B13R1.119 CC/C=C\CCCNC1CCCC1 m_270004__8288556__24594278 [0,1,0,1,0,0|1,0,0]=3 3017 B13R1.119 CC/C=C\CCCNC1CCSC1 m_270004__9480264__24594278 [0,1,0,1,0,0|2,0,0]=4 3018 B13R1.119 CC/C=C\CCCN[C@H]1CCOC1 m_270004__13947678__24594278 [0,1,0,1,0,0|2,0,0]=4 3019 B13R1.119 CCC=CCCSCC1CCCC1 m_62__8859720__8766438 [0,1,0,1,0,0|1,0,0]=3 3020 B13R1.119 CCC=CCCSCC1CCCN1 m_7__22987948__8859716 [0,1,0,1,0,0|2,0,0]=4 3021 B13R1.119 CCC=CCCSCC1CCCO1 m_62__8859720__9419582 [0,1,0,1,0,0|2,0,0]=4 3022 B13R1.119 CCC=CCCSCC1CCOC1 m_62__8859720__8794298 [0,1,0,1,0,0|2,0,0]=4 3023 B13R1.119 CCC=NOCCCC1CCCC1 m_34__17309904__15113688 [0,1,0,1,0,0|2,0,0]=4 3024 B13R1.119 CCCC=CCCNC1CCCC1 m_270004__23849914__8157302 [0,1,0,1,0,0|2,0,0]=4 3025 B13R1.119 CCCC=CCCSC1CCCC1 m_7__27260__7875318 [0,1,0,1,0,0|2,0,0]=4 3026 B13R1.119 CCCCCCCCN1C=CC=N1 m_34__5127994__9283556 [0,1,0,1,0,0|1,0,1]=4 3027 B13R1.119 CCCCCCCCN1C=CN=N1 m_34__1952206__9283556 [0,1,0,1,0,0|2,0,0]=4 3028 B13R1.119 CCCCCCCNC1=NC=CO1 m_27__12209932__24798458 [0,1,0,1,0,0|1,0,1]=4 3029 B13R1.119 CCCCCCCN[C@H]1C=CCC1 m_270004__24793796__24715022 [0,1,0,1,0,0|1,0,0]=3 3030 B13R1.119 CCCCCCCSC1=NC=CO1 m_7__9405752__7284628 [0,1,0,1,0,0|1,0,1]=4 3031 B13R1.119 CCCCCCNCC1=CC=CO1 m_207__109479__121207 [0,1,0,1,0,0|0,0,2]=4 3032 B13R1.119 CCCCCCNCC1=CN=CO1 m_207__109479__16906216 [0,1,0,1,0,0|1,0,1]=4 3033 B13R1.119 CCCCCCNCC1=COC=C1 m_207__109479__2989444 [0,1,0,1,0,0|1,0,1]=4 3034 B13R1.119 CCCCCCNCC1=CON=C1 m_270004__8288590__24721452 [0,1,0,1,0,0|2,0,0]=4 3035 B13R1.119 CCCCCCNCC1=NC=CO1 m_207__109479__10542730 [0,1,0,1,0,0|1,0,1]=4 3036 B13R1.119 CCCCCCNCC1=NOC=C1 m_207__109479__12873822 [0,1,0,1,0,0|1,0,1]=4 3037 B13R1.119 CCCCCCNCC1C=CCC1 m_270004__12894044__24715030 [0,1,0,1,0,0|1,0,0]=3 3038 B13R1.119 CCCCCCNCC1CCCO1 m_270004__8288644__24715030 [0,1,0,1,0,0|0,0,2]=4 3039 B13R1.119 CCCCCCNCC1OCCO1 m_270004__18331526__24715030 [0,1,0,1,0,0|1,0,1]=4 3040 B13R1.119 CCCCCCSCC1=CC=CO1 m_7__26781__846538 [0,1,0,1,0,0|0,0,2]=4 3041 B13R1.119 CCCCCCSCC1=CC=NO1 m_62__8854732__320426 [0,1,0,1,0,0|1,0,1]=4 3042 B13R1.119 CCCCCCSCC1=CCCC1 m_62__8854732__11572528 [0,1,0,1,0,0|2,0,0]=4 3043 B13R1.119 CCCCCCSCC1=NOC=C1 m_62__8854732__10302582 [0,1,0,1,0,0|1,0,1]=4 3044 B13R1.119 CCCCCCSCC1C=CCC1 m_62__8854732__14322920 [0,1,0,1,0,0|1,0,0]=3 3045 B13R1.119 CCCCCCSCC1CCCO1 m_62__8854732__9419582 [0,1,0,1,0,0|0,0,2]=4 3046 B13R1.119 CCCCCCSCC1OCCO1 m_7__22987978__846538 [0,1,0,1,0,0|1,0,1]=4 3047 B13R1.119 CCCCCNCCC1=CC=CO1 m_270004__8288604__24721640 [0,1,0,1,0,0|0,0,2]=4 3048 B13R1.119 CCCCCNCCC1C=CCC1 m_270004__8288604__24714984 [0,1,0,1,0,0|1,0,0]=3 3049 B13R1.119 CCCCCNCCC1CCCO1 m_270004__8288604__24594190 [0,1,0,1,0,0|0,0,2]=4 3050 B13R1.119 CCCCCSCCC1=CC=CO1 m_7__22986766__5063386 [0,1,0,1,0,0|0,0,2]=4 3051 B13R1.119 CCCCCSCCC1=CON=C1 m_7__8271838__10804152 [0,1,0,1,0,0|2,0,0]=4 3052 B13R1.119 CCCCCSCCC1CCCO1 m_62__5063390__9194610 [0,1,0,1,0,0|0,0,2]=4 3053 B13R1.119 CCCCCSCCC1OCCO1 m_7__8271838__8861116 [0,1,0,1,0,0|1,0,1]=4 3054 B13R1.119 CCCCNCCCC1=CC=CO1 m_270004__8289202__24714988 [0,1,0,1,0,0|0,0,2]=4 3055 B13R1.119 CCCOCCSCC1C=CCC1 m_62__14322918__15503588 [0,1,0,1,0,0|2,0,0]=4 3056 B13R1.119 CCOCCCCN[C@H]1C=CCC1 m_270004__24793796__24710482 [0,1,0,1,0,0|2,0,0]=4 3057 B13R1.119 CCOCCCSCC1C=CCC1 m_62__5730880__14322920 [0,1,0,1,0,0|2,0,0]=4 3058 B13R1.119 CCOCCNCCC1C=CCC1 m_270004__8349722__24714984 [0,1,0,1,0,0|2,0,0]=4 3059 B13R1.119 CCSCCCCCC1OCCO1 m_62__875846__15357132 [0,1,0,1,0,0|1,0,1]=4 3060 B13R1.119 CCSCCNCCC1C=CCC1 m_270004__13975982__24714984 [0,1,0,1,0,0|2,0,0]=4 3061 B13R1.119 COCCCCCN[C@H]1C=CCC1 m_270004__24793796__24721444 [0,1,0,1,0,0|2,0,0]=4 3062 B13R1.119 COCCCCSCC1C=CCC1 m_62__10159084__14322920 [0,1,0,1,0,0|2,0,0]=4 3063 B13R1.119 COCCCNCCC1C=CCC1 m_270004__8288582__24714984 [0,1,0,1,0,0|2,0,0]=4 3064 B13R1.119 COCCNCCCC1CCCC1 m_270004__8288600__14924996 [0,1,0,1,0,0|1,0,1]=4 3065 B13R1.119 COCCSCCCC1CCCC1 m_62__524272__15113694 [0,1,0,1,0,0|1,0,1]=4 3066 B13R1.119 CSCCCNCCC1C=CCC1 m_270004__8296868__24714984 [0,1,0,1,0,0|2,0,0]=4 3067 B13R1.119 ClCCCCCCN[C@H]1C=CCC1 m_270004__24793796__24721042 [0,1,0,1,0,0|2,0,0]=4 3068 B13R1.119 ClCCCCCNCC1C=CCC1 m_270004__12894044__24721510 [0,1,0,1,0,0|2,0,0]=4 3069 B13R1.119 ClCCCCNCCC1C=CCC1 m_270004__23847180__24721168 [0,1,0,1,0,0|2,0,0]=4 3070 B13R1.119 FCCCCCCN[C@H]1C=CCC1 m_270004__24793796__16464048 [0,1,0,1,0,0|2,0,0]=4 3071 B13R1.119 FCCCCCSCC1C=CCC1 m_62__9984632__14322920 [0,1,0,1,0,0|2,0,0]=4 3072 B13R1.119 FCCCCNCCC1C=CCC1 m_270004__10390196__24714984 [0,1,0,1,0,0|2,0,0]=4 3073 B13R1.119 N#CC=CCSCCC1CCCC1 m_7__22987540__7140602 [0,1,0,1,0,0|1,0,1]=4 3074 B13R1.119 NCCCCCSCC1C=CCC1 m_34__20871474__14322914 [0,1,0,1,0,0|2,0,0]=4 3075 B13R1.119 OCC#CCCNCC1CCCC1 m_270004__21537562__8300536 [0,1,0,1,0,0|0,0,2]=4 3076 B13R1.119 OCC#CCSCCC1CCCC1 m_7__22987540__15141006 [0,1,0,1,0,0|0,0,2]=4 3077 B13R1.119 OCC=CCSCCC1CCCC1 m_7__22987540__16809272 [0,1,0,1,0,0|0,0,0]=2 3078 B13R1.119 OCC=CCSCCC1CCCO1 m_7__22987628__16809272 [0,1,0,1,0,0|1,0,0]=3 3079 B13R1.119 OCC=CCSCCC1CCOC1 m_7__22987862__16809272 [0,1,0,1,0,0|1,0,0]=3 3080 B13R1.119 OCCCCCCCN1CCCC1 m_2230__678722__6174988 [0,1,0,1,0,0|0,0,2]=4 3081 B13R1.119 OCCCCCCNC1CCCC1 m_207__8282998__121596 [0,1,0,1,0,0|0,0,2]=4 3082 B13R1.119 OCCCCCCSC1CCCC1 m_7__27260__6673274 [0,1,0,1,0,0|0,0,2]=4 3083 B13R1.119 OCCCCCNCC1CCCC1 m_270004__9456968__8300536 [0,1,0,1,0,0|0,0,2]=4 3084 B13R1.119 OCCCCNCCC1C=CCC1 m_270004__9433178__24714984 [0,1,0,1,0,0|2,0,0]=4 3085 B13R1.119 OCCCCSCCC1CCCC1 m_7__22987540__3191338 [0,1,0,1,0,0|0,0,2]=4 3086 B13R1.119 OCCCNCCCC1CCCC1 m_270004__8288584__14924996 [0,1,0,1,0,0|0,0,2]=4 3087 B13R1.119 OCCCSCCCC1CCCC1 m_7__22987426__6354 [0,1,0,1,0,0|0,0,2]=4 3088 B13R1.119 OCCNCCCOC1CCCC1 m_270004__8349608__24710490 [0,1,0,1,0,0|1,0,1]=4 3089 B13R1.119 OCCOCCCNC1CCCC1 m_207__8602132__121596 [0,1,0,1,0,0|1,0,1]=4 3090 B13R1.119 OCCOCCNCC1CCCC1 m_270004__8288648__8300536 [0,1,0,1,0,0|1,0,1]=4 3091 B13R1.119 OCCOCCSCC1CCCC1 m_62__8766436__8799516 [0,1,0,1,0,0|1,0,1]=4 3092 B13R1.119 OCCSCCCNC1CCCC1 m_270004__23851182__8157302 [0,1,0,1,0,0|1,0,1]=4 3093 B13R1.119 OCCSCCNCC1CCCC1 m_270004__21508858__8300536 [0,1,0,1,0,0|1,0,1]=4 3094 B13R1.119 OCCSCCOCC1CCCC1 m_62__10893182__10178562 [0,1,0,1,0,0|1,0,1]=4 3095 B13R1.188 C=CC=CCCNCC1CC1CC m_270004__12896186__18234084 [0,1,0,1,0,0|1,0,1]=4 3096 B13R1.188 C=CC=CCCNC[C@@H]1C[C@H]1CC m_270004__12896186__18897550 [0,1,0,1,0,0|1,0,1]=4 3097 B13R1.188 C=CC=CCCSC[C@@H]1C[C@H]1CC m_62__13155122__12907968 [0,1,0,1,0,0|1,0,1]=4 3098 B13R1.188 CCC1CC1CNCCC#CCO m_270004__21537562__18234084 [0,1,0,1,0,0|0,0,2]=4 3099 B13R1.188 CCC1CC1CNCCCCCO m_270004__9456968__18234084 [0,1,0,1,0,0|0,0,2]=4 3100 B13R1.188 CCC1CC1CNCCOCCO m_270004__8288648__18234084 [0,1,0,1,0,0|1,0,1]=4 3101 B13R1.188 CCC1CC1CNCCSCCO m_270004__21508858__18234084 [0,1,0,1,0,0|1,0,1]=4 3102 B13R1.188 CCC=CCCSC[C@@H]1C[C@H]1CC m_62__8859720__13155124 [0,1,0,1,0,0|1,0,0]=3 3103 B13R1.188 CCCCCCNC[C@H]1C[C@H]1CO m_270004__16790534__24715030 [0,1,0,1,0,0|0,0,2]=4 3104 B13R1.188 CC[C@H]1C[C@@H]1CNCCC#CCO m_270004__21537562__18897550 [0,1,0,1,0,0|0,0,2]=4 3105 B13R1.188 CC[C@H]1C[C@@H]1CNCCCCCO m_270004__9456968__18897550 [0,1,0,1,0,0|0,0,2]=4 3106 B13R1.188 CC[C@H]1C[C@@H]1CNCCOCCO m_270004__8288648__18897550 [0,1,0,1,0,0|1,0,1]=4 3107 B13R1.188 CC[C@H]1C[C@@H]1CNCCSCCO m_270004__21508858__18897550 [0,1,0,1,0,0|1,0,1]=4 3108 B13R1.188 CC[C@H]1C[C@@H]1CSCCOCCO m_62__13155122__8799516 [0,1,0,1,0,0|1,0,1]=4 3109 B13R1.190 CC1CN(CC1NCC=CCO)C m_2230__22397286__16809276 [0,1,0,1,0,0|2,0,0]=4 3110 B13R1.190 CCC=CCCN1CC(CC1C)C m_2230__5506422__8859726 [0,1,0,1,0,0|2,0,0]=4 3111 B13R1.190 CCC=CCCN1CC(CC1C)O m_2230__9209358__8859726 [0,1,0,1,0,0|2,0,0]=4 3112 B13R1.190 CCC=CCCN1C[C@H](C[C@H]1C)F m_2230__22545816__8859726 [0,1,0,1,0,0|2,0,0]=4 3113 B13R1.208 CCCC(C)C1CCCN1CCO m_2230__7345412__6165700 [0,1,0,1,0,0|1,0,1]=4 3114 B13R1.208 CCCC1CCCC1C(=O)NCC m_22__57815__10684782 [0,1,0,1,0,0|2,0,0]=4 3115 B13R1.208 CCCC1CCCC1C(=O)OCC m_1458__10684790__1327610 [0,1,0,1,0,0|2,0,0]=4 3116 B13R1.223 COCC1CCN1CC(=CCO)C m_2230__10478002__20765536 [0,1,0,1,0,0|2,0,0]=4 3117 B13R1.229 CON=C1CCCCCCCCC1 m_4__461206__14391994 [0,1,0,1,0,0|1,0,1]=4 3118 B13R1.229 OCCN1CCCCCCCCC1 m_2230__15361578__6165700 [0,1,0,1,0,0|0,0,2]=4 3119 B13R1.244 CCC[C@H]1C[C@@H]1CNC(=O)CCO m_487__14584596__12879784 [0,1,0,1,0,0|1,0,1]=4 3120 B13R1.362 CC/C=C\CCCNC1CC(C1)O m_270004__20075652__24594278 [0,1,0,1,0,0|2,0,0]=4 3121 B13R1.362 CC/C=C\CCCN[C@H]1C[C@@H](C1)C m_270004__23846548__24594278 [0,1,0,1,0,0|2,0,0]=4 3122 B13R1.362 CC/C=C\CCCN[C@H]1C[C@H](C1)F m_270004__23846822__24594278 [0,1,0,1,0,0|2,0,0]=4 3123 B13R1.362 CCC=CCCSCC1CC(C1)C m_62__13451110__8859722 [0,1,0,1,0,0|2,0,0]=4 3124 B13R1.362 CCC=CCCSCC1CC(C1)F m_62__8859720__13773720 [0,1,0,1,0,0|2,0,0]=4 3125 B13R1.362 CCC=CCCSCC1CC(C1)N m_34__20871486__8899998 [0,1,0,1,0,0|2,0,0]=4 3126 B13R1.362 NC1CC(C1)CCSCC=CCO m_7__21392882__16809272 [0,1,0,1,0,0|1,0,0]=3 3127 B13R1.362 OCC=CCSCCC1CC(C1)F m_7__22988106__16809272 [0,1,0,1,0,0|1,0,0]=3 3128 B13R1.369 CC1CN(CCN1CC=CCO)C m_2230__4711044__16809276 [0,1,0,1,0,0|2,0,0]=4 3129 B13R1.369 CC1CS(=O)CCN1CC=CCO m_2230__22409612__16809276 [0,1,0,1,0,0|2,0,0]=4 3130 B13R1.369 C[C@@H]1CCN([C@@H](C1)C)CC=CCO m_2230__21997054__16809276 [0,1,0,1,0,0|1,0,0]=3 3131 B13R1.369 C[C@@H]1C[C@@H](CCN1CC=CCO)O m_2230__12368178__16809276 [0,1,0,1,0,0|1,0,0]=3 3132 B13R1.369 C[C@H]1CCN([C@H](C1)C)CC=CCO m_2230__11949522__16809276 [0,1,0,1,0,0|1,0,0]=3 3133 B13R1.369 C[C@H]1CN(CCN1CC=CCO)C m_2230__22325092__16809276 [0,1,0,1,0,0|2,0,0]=4 3134 B13R1.404 CC(=CCO)CCCN1CCCC1 m_2230__678722__22383944 [0,1,0,1,0,0|1,0,0]=3 3135 B13R1.404 CC(=CCO)CSCC1CCCN1 m_7__22987948__20765532 [0,1,0,1,0,0|2,0,0]=4 3136 B13R1.404 CC(=CCO)CSCC1CCOC1 m_7__13778716__20765532 [0,1,0,1,0,0|2,0,0]=4 3137 B13R1.404 CCCC(C)CCN[C@H]1C=CCC1 m_270004__24793796__24594192 [0,1,0,1,0,0|2,0,0]=4 3138 B13R1.404 CCCC(C)CNCC1C=CCC1 m_270004__12894044__8300564 [0,1,0,1,0,0|2,0,0]=4 3139 B13R1.404 CCCC(C)NCCC1C=CCC1 m_2230__22397382__22384226 [0,1,0,1,0,0|2,0,0]=4 3140 B13R1.404 CCNC(=O)CCCC1CCCC1 m_22__57815__6202058 [0,1,0,1,0,0|2,0,0]=4 3141 B13R1.404 CCOC(=O)CCCC1CCCC1 m_1458__6202064__1327610 [0,1,0,1,0,0|2,0,0]=4 3142 B13R1.404 CN(CCO)CCCC1CCCC1 m_2230__679202__15113700 [0,1,0,1,0,0|1,0,1]=4 3143 B13R1.404 O=C(CCO)NCCC1CCCC1 m_487__676416__12879784 [0,1,0,1,0,0|1,0,1]=4 3144 B13R1.404 O=S(CCO)CCCC1CCCC1 m_265282__7088216__7206618 [0,1,0,1,0,0|1,0,1]=4 3145 B13R1.443 CC(=CCO)CN1CCCC1CO m_2230__3379024__20765536 [0,1,0,1,0,0|2,0,0]=4 3146 B13R1.443 CC(=CCO)CN1CCC[C@H]1CF m_2230__17313732__20765536 [0,1,0,1,0,0|2,0,0]=4 3147 B13R1.443 CCC1CCCN1CC(=CCO)C m_2230__4599928__20765536 [0,1,0,1,0,0|1,0,0]=3 3148 B13R1.444 CC(=CCO)CNC1CCCC1C m_2230__9296222__20765536 [0,1,0,1,0,0|1,0,0]=3 3149 B13R1.444 CC(=CCO)CNC1COCC1C m_2230__13166314__20765536 [0,1,0,1,0,0|2,0,0]=4 3150 B13R1.444 CC(=CCO)CNC1CSCC1C m_2230__10125964__20765536 [0,1,0,1,0,0|2,0,0]=4 3151 B13R1.444 CC(=CCO)CN[C@@H]1CNC[C@H]1C m_269982__22505224__22498250 [0,1,0,1,0,0|2,0,0]=4 3152 B13R1.444 CC(=CCO)CN[C@H]1CCC[C@H]1C m_2230__22399140__20765536 [0,1,0,1,0,0|1,0,0]=3 3153 B13R1.444 CC(=CCO)CN[C@H]1CCC[C@H]1N m_269982__17754792__22498250 [0,1,0,1,0,0|2,0,0]=4 3154 B13R1.444 CC(=CCO)CN[C@H]1CCO[C@H]1C m_2230__15404788__20765536 [0,1,0,1,0,0|2,0,0]=4 3155 B13R1.444 CC(=CCO)CN[C@H]1CNC[C@H]1C m_269982__22505270__22498250 [0,1,0,1,0,0|2,0,0]=4 3156 B13R1.444 CC(=CCO)CN[C@H]1COC[C@H]1C m_2230__22403954__20765536 [0,1,0,1,0,0|2,0,0]=4 3157 B13R1.444 CC(=CCO)CSC1CCOC1C m_7__7791670__20765532 [0,1,0,1,0,0|2,0,0]=4 3158 B13R1.444 CC/C=C(\C)/CNC1CCCC1C m_270004__24045486__8157370 [0,1,0,1,0,0|2,0,0]=4 3159 B13R1.444 CC1CCCC1CNC(=O)CCO m_487__9748782__12879784 [0,1,0,1,0,0|1,0,1]=4 3160 B13R1.445 CC/C=C(\C)/CNC1CCC1CC m_270004__24045486__10177950 [0,1,0,1,0,0|2,0,0]=4 3161 B13R1.447 CC1CC1CCCCN(C)CCO m_2230__679202__22384156 [0,1,0,1,0,0|1,0,1]=4 3162 B13R1.447 C[C@H]1C[C@@H]1CCCNC(=O)CCO m_487__17517096__12879784 [0,1,0,1,0,0|1,0,1]=4 3163 B13R1.448 CC(=CCO)CCCSC1CCC1 m_7__10684076__22787184 [0,1,0,1,0,0|1,0,0]=3 3164 B13R1.448 CC(=CCO)CCCSC1CNC1 m_7__22987816__22787184 [0,1,0,1,0,0|2,0,0]=4 3165 B13R1.448 CC(=CCO)CCCSC1COC1 m_7__13420946__22787184 [0,1,0,1,0,0|2,0,0]=4 3166 B13R1.448 CC(=CCO)CCCSC1CSC1 m_7__20064714__22787184 [0,1,0,1,0,0|2,0,0]=4 3167 B13R1.448 CC(=CCO)CSCCC1CCC1 m_7__22987652__20765532 [0,1,0,1,0,0|1,0,0]=3 3168 B13R1.448 O=C(CCO)NCCCC1CCC1 m_487__12055232__12879784 [0,1,0,1,0,0|1,0,1]=4 3169 B13R1.453 CC(=CCO)CCCSCC1CC1 m_7__10390288__22787184 [0,1,0,1,0,0|1,0,0]=3 3170 B13R1.453 CC(=CCO)CSCCCC1CC1 m_7__22987332__20765532 [0,1,0,1,0,0|1,0,0]=3 3171 B13R1.453 CN(CCO)CCCCCC1CC1 m_2230__679202__13582088 [0,1,0,1,0,0|1,0,1]=4 3172 B13R1.453 O=C(CCO)NCCCCC1CC1 m_487__12627752__12879784 [0,1,0,1,0,0|1,0,1]=4 3173 B13R1.461 CC(=CCO)CSC[C@@H]1CC[C@H]1O m_7__22986852__20765532 [0,1,0,1,0,0|2,0,0]=4 3174 B13R1.464 CCC1CCCCC1N(C)CCO m_2230__9099656__6165700 [0,1,0,1,0,0|1,0,1]=4 3175 B13R1.464 CCNC(=O)C1CCCCC1CC m_22__57815__9610398 [0,1,0,1,0,0|2,0,0]=4 3176 B13R1.464 CCOC(=O)C1CCCCC1CC m_1458__9610406__1327610 [0,1,0,1,0,0|2,0,0]=4 3177 B13R1.470 CC(=CCO)CN1CCCCC1C m_2230__678754__20765536 [0,1,0,1,0,0|1,0,0]=3 3178 B13R1.470 CC(=CCO)CN1CCCC[C@H]1C m_2230__22409340__20765536 [0,1,0,1,0,0|1,0,0]=3 3179 B13R1.470 CC(=CCO)CN1CCNCC1C m_269982__7368790__22498250 [0,1,0,1,0,0|2,0,0]=4 3180 B13R1.470 CC(=CCO)CN1CCOCC1C m_2230__679548__20765536 [0,1,0,1,0,0|2,0,0]=4 3181 B13R1.470 CC(=CCO)CN1CCOC[C@@H]1C m_2230__10745968__20765536 [0,1,0,1,0,0|2,0,0]=4 3182 B13R1.470 CC(=CCO)CN1CCSCC1C m_2230__5359444__20765536 [0,1,0,1,0,0|2,0,0]=4 3183 B13R1.470 CC(CCO)N[C@H]1CCC=C[C@H]1O m_270004__23854588__13397824 [0,1,0,1,0,0|2,0,0]=4 3184 B13R1.470 CC1CCCCC1CN(C)CCO m_2230__679202__11946504 [0,1,0,1,0,0|1,0,1]=4 3185 B13R1.470 CC1CCCCC1NC(=O)CCO m_487__150692__12879784 [0,1,0,1,0,0|1,0,1]=4 3186 B13R1.470 CCCC(=O)N[C@H]1CCC=C[C@H]1O m_270062__21870446__17814498 [0,1,0,1,0,0|1,0,1]=4 3187 B13R1.470 CCNC(=O)CC1CCCCC1C m_22__57815__1944574 [0,1,0,1,0,0|2,0,0]=4 3188 B13R1.470 CCOC(=O)CC1CCCCC1C m_1458__1944582__1327610 [0,1,0,1,0,0|2,0,0]=4 3189 B13R1.470 COCC(C)N[C@H]1CCC=C[C@H]1O m_270004__23854588__8844972 [0,1,0,1,0,0|2,0,0]=4 3190 B13R1.470 CSCC(C)N[C@H]1CCC=C[C@H]1O m_270004__23854588__15781876 [0,1,0,1,0,0|2,0,0]=4 3191 B13R1.567 CCCCC1CCCN(C1)CCO m_2230__15088552__6165700 [0,1,0,1,0,0|1,0,1]=4 3192 B13R1.654 C=CC=CCCNC1CCCC1C m_2230__9296222__12907972 [0,1,0,1,0,0|1,0,1]=4 3193 B13R1.654 C=CC=CCCN[C@H]1CCC[C@H]1C m_2230__22399140__12907972 [0,1,0,1,0,0|1,0,1]=4 3194 B13R1.654 CC/C=C\CCCN1CCCC1C m_270004__8137714__24594278 [0,1,0,1,0,0|1,0,0]=3 3195 B13R1.654 CC1CCCC1NCCC#CCO m_207__21537544__6951098 [0,1,0,1,0,0|0,0,2]=4 3196 B13R1.654 CC1CCCC1NCCCCCO m_2230__9296222__2463426 [0,1,0,1,0,0|0,0,2]=4 3197 B13R1.654 CC1CCCC1NCCOCCO m_2230__9296222__11974698 [0,1,0,1,0,0|1,0,1]=4 3198 B13R1.654 CC1CCCC1NCCSCCO m_207__21508840__6951098 [0,1,0,1,0,0|1,0,1]=4 3199 B13R1.654 CC1CCCN1CCCCCCO m_2230__6338494__13038782 [0,1,0,1,0,0|0,0,2]=4 3200 B13R1.654 CCC=CCCNC1CCCC1C m_2230__9296222__8859726 [0,1,0,1,0,0|1,0,0]=3 3201 B13R1.654 CCC=CCCNC1COCC1C m_2230__13166314__8859726 [0,1,0,1,0,0|2,0,0]=4 3202 B13R1.654 CCC=CCCNC1CSCC1C m_2230__10125964__8859726 [0,1,0,1,0,0|2,0,0]=4 3203 B13R1.654 CCC=CCCN[C@H]1CCC[C@H]1C m_2230__22399140__8859726 [0,1,0,1,0,0|1,0,0]=3 3204 B13R1.654 CCC=CCCN[C@H]1CCO[C@H]1C m_2230__15404788__8859726 [0,1,0,1,0,0|2,0,0]=4 3205 B13R1.654 CCC=CCCN[C@H]1COC[C@H]1C m_2230__22403954__8859726 [0,1,0,1,0,0|2,0,0]=4 3206 B13R1.654 CCC=CCCSC1CCOC1C m_7__7791670__8859716 [0,1,0,1,0,0|2,0,0]=4 3207 B13R1.654 CCCC=CCCN1CCCC1C m_2230__6338494__7875332 [0,1,0,1,0,0|2,0,0]=4 3208 B13R1.654 CCCC=CCNC1CCCC1C m_2230__9296222__22993520 [0,1,0,1,0,0|2,0,0]=4 3209 B13R1.654 CCCC=CCN[C@H]1CCC[C@H]1C m_2230__22399140__22993520 [0,1,0,1,0,0|2,0,0]=4 3210 B13R1.654 CCCCCCNC1CCCC1O m_269862__7192686__15158002 [0,1,0,1,0,0|0,0,2]=4 3211 B13R1.654 CCCCCCN[C@@H]1CCC[C@H]1O m_270004__10910694__24715030 [0,1,0,1,0,0|0,0,2]=4 3212 B13R1.654 CCCCCCN[C@@H]1COC[C@H]1O m_270004__23852260__24715030 [0,1,0,1,0,0|1,0,1]=4 3213 B13R1.654 CCCCCCN[C@@H]1COC[C@H]1O m_270004__23853474__24715030 [0,1,0,1,0,0|1,0,1]=4 3214 B13R1.654 CCCCCCN[C@H]1CCC[C@H]1O m_270004__23852616__24715030 [0,1,0,1,0,0|0,0,2]=4 3215 B13R1.654 CCCCCNC[C@H]1COC[C@H]1O m_2230__13038508__5063396 [0,1,0,1,0,0|1,0,1]=4 3216 B13R1.654 COCC=CCNC1CCCC1C m_270004__24044358__8157370 [0,1,0,1,0,0|1,0,0]=3 3217 B13R1.654 COCC=CCNC1CCOC1C m_270004__24044358__8157372 [0,1,0,1,0,0|2,0,0]=4 3218 B13R1.654 CSCC=CCNC1CCCC1C m_270004__23005652__8157370 [0,1,0,1,0,0|1,1,0]=4 3219 B13R1.654 C[C@H]1CCC[C@@H]1CSCC#CCO m_62__13911860__15141012 [0,1,0,1,0,0|0,0,2]=4 3220 B13R1.654 C[C@H]1CCC[C@@H]1CSCCCCO m_7__22849690__13911854 [0,1,0,1,0,0|0,0,2]=4 3221 B13R1.654 C[C@H]1CCC[C@H]1NCCCCCO m_2230__22399140__6079162 [0,1,0,1,0,0|0,0,2]=4 3222 B13R1.654 C[C@H]1CCC[C@H]1NCCOCCO m_2230__22399140__11974698 [0,1,0,1,0,0|1,0,1]=4 3223 B13R1.654 OCC=CCNC[C@H]1COC[C@H]1O m_2230__13038508__16809276 [0,1,0,1,0,0|2,0,0]=4 3224 B13R1.657 CCC=C1CCN(C1)CCCCC m_2230__14780924__5063396 [0,1,0,1,0,0|2,0,0]=4 3225 B13R1.657 CCCC1CCN(C1)C/C=C/CN m_269982__7372848__22485940 [0,1,0,1,0,0|2,0,0]=4 3226 B13R1.657 CCCC1CCN(C1)CC=CCO m_2230__6390760__16809276 [0,1,0,1,0,0|1,0,0]=3 3227 B13R1.657 CCNC1CCN(C1)CC=CCO m_269982__20083372__16809282 [0,1,0,1,0,0|2,0,0]=4 3228 B13R1.657 CCO[C@H]1CCN(C1)CC=CCO m_2230__13228234__16809276 [0,1,0,1,0,0|2,0,0]=4 3229 B13R1.657 CNCC1CCN(C1)CC=CCO m_269982__7368808__16809282 [0,1,0,1,0,0|2,0,0]=4 3230 B13R1.657 CNC[C@@H]1CCN(C1)CC=CCO m_269982__23409354__16809282 [0,1,0,1,0,0|2,0,0]=4 3231 B13R1.657 COCC1CCN(C1)CC=CCO m_2230__5453994__16809276 [0,1,0,1,0,0|2,0,0]=4 3232 B13R1.657 CSCC1CCN(C1)CC=CCO m_2230__5456508__16809276 [0,1,0,1,0,0|2,0,0]=4 3233 B13R1.657 OCC=CCN1CCC(C1)CCF m_2230__16521784__16809276 [0,1,0,1,0,0|2,0,0]=4 3234 B13R1.657 OCC=CCN1CCC(C1)CCO m_2230__16720226__16809276 [0,1,0,1,0,0|2,0,0]=4 3235 B13R1.1149 CC1CCCN(CC1)C/C=C/CN m_269982__7372658__22485940 [0,1,0,1,0,0|2,0,0]=4 3236 B13R1.1149 CC1CCCN(CC1)CC=CCO m_2230__3563028__16809276 [0,1,0,1,0,0|1,0,0]=3 3237 B13R1.1149 CC1CCN(CCN1)CC=CCO m_269982__17754846__16809282 [0,1,0,1,0,0|2,0,0]=4 3238 B13R1.1149 CC1CCN(CCO1)CC=CCO m_2230__13160604__16809276 [0,1,0,1,0,0|2,0,0]=4 3239 B13R1.1149 CC1CCN(CCS1)CC=CCO m_2230__9298202__16809276 [0,1,0,1,0,0|2,0,0]=4 3240 B13R1.1149 CN1CCCN(CC1)CC=CCO m_2230__678752__16809276 [0,1,0,1,0,0|2,0,0]=4 3241 B13R1.1149 NC/C=C/CN1CCCC(CC1)F m_269982__22514038__22485940 [0,1,0,1,0,0|2,0,0]=4 3242 B13R1.1149 NC/C=C/CN1CCCC(CC1)N m_269982__15733936__22485940 [0,1,0,1,0,0|2,0,0]=4 3243 B13R1.1149 NC/C=C/CN1CCCC(CC1)O m_269982__17669450__22485940 [0,1,0,1,0,0|2,0,0]=4 3244 B13R1.1149 NC1CCCN(CC1)CC=CCO m_269982__15733936__16809282 [0,1,0,1,0,0|1,0,0]=3 3245 B13R1.1149 OCC=CCN1CCCC(CC1)F m_2230__22406018__16809276 [0,1,0,1,0,0|1,0,0]=3 3246 B13R1.1149 OCC=CCN1CCCC(CC1)O m_2230__10565428__16809276 [0,1,0,1,0,0|1,0,0]=3 3247 B13R1.1464 CCNC(=O)C1CCCCCCC1 m_22__57815__5635440 [0,1,0,1,0,0|2,0,0]=4 3248 B13R1.1464 CCOC(=O)C1CCCCCCC1 m_1458__5635446__1327610 [0,1,0,1,0,0|2,0,0]=4 3249 B13R1.1464 CN(CCO)C1CCCCCCC1 m_2230__2442276__6165700 [0,1,0,1,0,0|1,0,1]=4 3250 B13R1.1464 O=C(CCO)N1CCCCCCC1 m_487__150459__12879784 [0,1,0,1,0,0|1,0,1]=4 3251 B13R1.1575 CC(=CCO)CN1CCCCCC1 m_2230__678972__20765536 [0,1,0,1,0,0|1,0,0]=3 3252 B13R1.1575 CC(=CCO)CN1CCCNCC1 m_269982__7368760__22498250 [0,1,0,1,0,0|2,0,0]=4 3253 B13R1.1575 CC(=CCO)CN1CCCOCC1 m_2230__6727026__20765536 [0,1,0,1,0,0|2,0,0]=4 3254 B13R1.1575 CC(=CCO)CN1CCCSCC1 m_2230__7912842__20765536 [0,1,0,1,0,0|2,0,0]=4 3255 B13R1.1575 CCCC(C)CN1CCC=CCC1 m_270004__24150684__8300564 [0,1,0,1,0,0|2,0,0]=4 3256 B13R1.1575 CCCC(C)NC1CCC=CCC1 m_269862__8257236__17656402 [0,1,0,1,0,0|2,0,0]=4 3257 B13R1.1575 CCCC(O)CN1CCC=CCC1 m_2230__22406010__15745982 [0,1,0,1,0,0|2,0,0]=4 3258 B13R1.1575 CCCN(C)CC1CCC=CCC1 m_2230__2261920__13460556 [0,1,0,1,0,0|2,0,0]=4 3259 B13R1.1575 CCNC(=O)CC1CCCCCC1 m_22__57815__6674344 [0,1,0,1,0,0|2,0,0]=4 3260 B13R1.1575 CCOC(=O)CC1CCCCCC1 m_1458__6674352__1327610 [0,1,0,1,0,0|2,0,0]=4 3261 B13R1.1575 CN(CCO)CC1CCCCCC1 m_2230__679202__8627208 [0,1,0,1,0,0|1,0,1]=4 3262 B13R1.1575 O=C(CCO)NC1CCCCCC1 m_487__150793__12879784 [0,1,0,1,0,0|1,0,1]=4 3263 B13R1.1892 CCC=C1CN(C1)CCCCCC m_270004__16977248__24715030 [0,1,0,1,0,0|2,0,0]=4 3264 B13R1.1892 CCOC1CC(C1)NCC=CCO m_270004__11971554__8633226 [0,1,0,1,0,0|2,0,0]=4 3265 B13R1.1892 COCC1CC(C1)NCC=CCO m_269862__11971552__14597268 [0,1,0,1,0,0|2,0,0]=4 3266 B13R1.1892 COCC1CC(C1)SCC=CCO m_7__22988024__16809272 [0,1,0,1,0,0|2,0,0]=4 3267 B13R1.1892 OCC=CCNC1CC(C1)CCCl m_270004__11971554__24722768 [0,1,0,1,0,0|2,0,0]=4 3268 B13R1.1892 OCC=CCNC1CC(C1)CCF m_270004__11971554__24719154 [0,1,0,1,0,0|2,0,0]=4 3269 B13R1.2856 CC1(CCN1CC=CCO)CCO m_2230__22408956__16809276 [0,1,0,1,0,0|2,0,0]=4 3270 B13R1.2856 CCCC1(CCN1CC=CCO)C m_2230__17835476__16809276 [0,1,0,1,0,0|1,0,0]=3 3271 B13R1.2856 COCC1(CCN1CC=CCO)C m_2230__22408908__16809276 [0,1,0,1,0,0|2,0,0]=4 3272 B13R1.2859 CC1CCN(C1CO)CC=CCO m_2230__9163424__16809276 [0,1,0,1,0,0|2,0,0]=4 3273 B13R1.2859 CCC1C(CCN1CC=CCO)C m_2230__8990332__16809276 [0,1,0,1,0,0|1,0,0]=3 3274 B13R1.2859 CC[C@H]1[C@H](CCN1CC=CCO)O m_2230__22408844__16809276 [0,1,0,1,0,0|1,0,0]=3 3275 B13R1.3151 CC/C=C\CCCNC(C)C1CC1 m_270004__8289428__24594278 [0,1,0,1,0,0|2,0,0]=4 3276 B13R1.3151 CCC=CCCSCC(C)C1CC1 m_62__15746286__8859722 [0,1,0,1,0,0|2,0,0]=4 3277 B13R1.3673 CC/C=C\CCCNC1(CCC1)C m_270004__8350472__24594278 [0,1,0,1,0,0|2,0,0]=4 3278 B13R1.3673 CCC=CCCSCC1(CCC1)O m_7__22987712__8859716 [0,1,0,1,0,0|2,0,0]=4 3279 B13R1.7836 CC/C=C\CCCNC1(CC1C)C m_270004__12221404__24594278 [0,1,0,1,0,0|2,0,0]=4 3280 B13R1.28 C=CC=CCCNC1CCCCC1 m_207__12896152__121598 [0,1,0,1,0,0|1,0,1]=4 3281 B13R1.28 C=CC=CCCSC1CCCCC1 m_7__27197__12907960 [0,1,0,1,0,0|1,0,1]=4 3282 B13R1.28 C=CCCCNCC1CC=CCO1 m_270004__14050670__17507834 [0,1,0,1,0,0|0,0,2]=4 3283 B13R1.28 CC/C=C\CCCN1CCCCC1 m_270004__8141062__24594278 [0,1,0,1,0,0|1,0,0]=3 3284 B13R1.28 CC/C=C\CCCN1CCOCC1 m_270004__7454768__24594278 [0,1,0,1,0,0|2,0,0]=4 3285 B13R1.28 CC/C=C\CCCN1CCSCC1 m_270004__8129500__24594278 [0,1,0,1,0,0|2,0,0]=4 3286 B13R1.28 CCC=CCCSC1CCCCC1 m_7__27197__8859716 [0,1,0,1,0,0|1,0,0]=3 3287 B13R1.28 CCC=CCCSC1CCCNC1 m_7__22871154__8859716 [0,1,0,1,0,0|2,0,0]=4 3288 B13R1.28 CCC=CCCSC1CCCOC1 m_7__8601826__8859716 [0,1,0,1,0,0|2,0,0]=4 3289 B13R1.28 CCC=CCCSC1CCNCC1 m_7__22986816__8859716 [0,1,0,1,0,0|2,0,0]=4 3290 B13R1.28 CCC=CCCSC1CCOCC1 m_7__7834816__8859716 [0,1,0,1,0,0|2,0,0]=4 3291 B13R1.28 CCC=CCCSC1CCSCC1 m_7__15266834__8859716 [0,1,0,1,0,0|2,0,0]=4 3292 B13R1.28 CCC=CCNCC1CCCCC1 m_207__17312546__121242 [0,1,0,1,0,0|1,0,0]=3 3293 B13R1.28 CCC=CCNCC1CCOCC1 m_207__17312546__5726270 [0,1,0,1,0,0|2,0,0]=4 3294 B13R1.28 CCC=NOCCC1CCCCC1 m_34__17309904__21208852 [0,1,0,1,0,0|2,0,0]=4 3295 B13R1.28 CCCC=CCCN1CCCCC1 m_2230__679042__7875332 [0,1,0,1,0,0|2,0,0]=4 3296 B13R1.28 CCCC=CCNC1CCCCC1 m_270004__14718658__8157310 [0,1,0,1,0,0|2,0,0]=4 3297 B13R1.28 CCCCCCCN1CC=CCC1 m_2230__8375936__7284644 [0,1,0,1,0,0|1,0,0]=3 3298 B13R1.28 CCCCCCNC1C=CCCC1 m_270004__8298828__24715030 [0,1,0,1,0,0|2,0,0]=4 3299 B13R1.28 CCCCCCNC1CC=CCC1 m_270004__8296840__24715030 [0,1,0,1,0,0|1,0,0]=3 3300 B13R1.28 CCCCCNCC1CC=CCC1 m_207__109488__121213 [0,1,0,1,0,0|1,0,0]=3 3301 B13R1.28 CCCCCNCC1CCC=CO1 m_270004__8288604__9139666 [0,1,0,1,0,0|0,0,2]=4 3302 B13R1.28 CCCCCSCC1C=CCCC1 m_62__5063390__14592770 [0,1,0,1,0,0|2,0,0]=4 3303 B13R1.28 CCCCCSCC1CCCCO1 m_62__5063390__524424 [0,1,0,1,0,0|0,0,2]=4 3304 B13R1.28 CCCCCSCC1CCOCO1 m_7__8271838__6019 [0,1,0,1,0,0|1,0,1]=4 3305 B13R1.28 CCCCCSCC1COCCO1 m_62__5063390__10738068 [0,1,0,1,0,0|1,0,1]=4 3306 B13R1.28 CCCCCSC[C@@H]1CC=CCC1 m_62__5063390__23045122 [0,1,0,1,0,0|1,0,0]=3 3307 B13R1.28 CCCCCSC[C@@H]1CNCCO1 m_7__22986850__5063386 [0,1,0,1,0,0|1,0,1]=4 3308 B13R1.28 CCCCNCCC1C=CCCC1 m_270004__8289202__24715080 [0,1,0,1,0,0|2,0,0]=4 3309 B13R1.28 CCCCNCCC1CCCCO1 m_270004__8289202__17567356 [0,1,0,1,0,0|0,0,2]=4 3310 B13R1.28 CCCCOCCN1CC=CCC1 m_2230__8375936__1128756 [0,1,0,1,0,0|2,0,0]=4 3311 B13R1.28 CCCCSCCC1CCCCO1 m_62__875776__11985416 [0,1,0,1,0,0|0,0,2]=4 3312 B13R1.28 CCCCSCCC1COCCO1 m_62__875776__14948410 [0,1,0,1,0,0|1,0,1]=4 3313 B13R1.28 CCCNCCCC1CC=CCC1 m_270004__8288780__24594658 [0,1,0,1,0,0|1,0,0]=3 3314 B13R1.28 CCNCCSC[C@@H]1CC=CCC1 m_7__22986872__23045116 [0,1,0,1,0,0|2,0,0]=4 3315 B13R1.28 CCOCCCCN1CC=CCC1 m_2230__8375936__22384190 [0,1,0,1,0,0|2,0,0]=4 3316 B13R1.28 CCOCCNCC1CC=CCC1 m_207__872232__121213 [0,1,0,1,0,0|2,0,0]=4 3317 B13R1.28 CCOCCSC[C@@H]1CC=CCC1 m_62__204255__23045122 [0,1,0,1,0,0|2,0,0]=4 3318 B13R1.28 CCON=CCCC1CCCCC1 m_4__158181__9316218 [0,1,0,1,0,0|2,0,0]=4 3319 B13R1.28 CCSCCNCC1C=CCOC1 m_270004__23850496__8765926 [0,1,0,1,0,0|2,0,0]=4 3320 B13R1.28 CCSCCNCC1CC=CCC1 m_207__13975948__121213 [0,1,0,1,0,0|2,0,0]=4 3321 B13R1.28 CCSCCNCC1CC=CCO1 m_270004__14050670__8765926 [0,1,0,1,0,0|1,0,0]=3 3322 B13R1.28 CCSCCSC[C@@H]1CC=CCC1 m_7__8765656__23045116 [0,1,0,1,0,0|2,0,0]=4 3323 B13R1.28 CNCCCCCN1CC=CCC1 m_269982__22517040__22486000 [0,1,0,1,0,0|2,0,0]=4 3324 B13R1.28 COCC=CCNC1CCCCC1 m_270004__24044358__8157310 [0,1,0,1,0,0|1,0,0]=3 3325 B13R1.28 COCC=CCNC1CCCOC1 m_270004__24044358__8157396 [0,1,0,1,0,0|2,0,0]=4 3326 B13R1.28 COCC=CCNC1CCCSC1 m_270004__24044358__8157390 [0,1,0,1,0,0|2,0,0]=4 3327 B13R1.28 COCC=CCNC1CCOCC1 m_270004__24044358__7676532 [0,1,0,1,0,0|2,0,0]=4 3328 B13R1.28 COCC=CCNC1CCSCC1 m_270004__24044358__8157340 [0,1,0,1,0,0|2,0,0]=4 3329 B13R1.28 COCCCCCN1CC=CCC1 m_2230__8375936__3219350 [0,1,0,1,0,0|2,0,0]=4 3330 B13R1.28 COCCCNCC1C=CCOC1 m_270004__23850496__24710510 [0,1,0,1,0,0|2,0,0]=4 3331 B13R1.28 COCCCNCC1CC=CCC1 m_207__109474__121213 [0,1,0,1,0,0|2,0,0]=4 3332 B13R1.28 COCCCNCC1CC=CCO1 m_270004__14050670__24710510 [0,1,0,1,0,0|1,0,0]=3 3333 B13R1.28 COCCCSC[C@@H]1CC=CCC1 m_62__9108898__23045122 [0,1,0,1,0,0|2,0,0]=4 3334 B13R1.28 COCCNCCC1CCCCC1 m_270004__8288600__9139688 [0,1,0,1,0,0|1,0,1]=4 3335 B13R1.28 COCCSCCC1CCCCC1 m_62__524272__21208858 [0,1,0,1,0,0|1,0,1]=4 3336 B13R1.28 CSCC=CCNC1CCCCC1 m_270004__23005652__8157310 [0,1,0,1,0,0|1,1,0]=4 3337 B13R1.28 CSCCCNCC1CC=CCC1 m_207__5135872__121213 [0,1,0,1,0,0|2,0,0]=4 3338 B13R1.28 CSCCCSC[C@@H]1CC=CCC1 m_7__10890048__23045116 [0,1,0,1,0,0|2,0,0]=4 3339 B13R1.28 ClCCCCCCN1CC=CCC1 m_270004__8375948__24721042 [0,1,0,1,0,0|2,0,0]=4 3340 B13R1.28 ClCCCCCNC1CC=CCC1 m_270004__8296840__24721510 [0,1,0,1,0,0|2,0,0]=4 3341 B13R1.28 ClCCCCNCC1C=CCOC1 m_270004__23850496__24721168 [0,1,0,1,0,0|2,0,0]=4 3342 B13R1.28 ClCCCCNCC1CC=CCC1 m_270004__8292238__24721168 [0,1,0,1,0,0|2,0,0]=4 3343 B13R1.28 ClCCCCNCC1CC=CCO1 m_270004__14050670__24721168 [0,1,0,1,0,0|1,0,0]=3 3344 B13R1.28 FCCCCCCN1CC=CCC1 m_2230__8375936__22993832 [0,1,0,1,0,0|2,0,0]=4 3345 B13R1.28 FCCCCNCC1CC=CCC1 m_207__10390152__121213 [0,1,0,1,0,0|2,0,0]=4 3346 B13R1.28 FCCCCSC[C@@H]1CC=CCC1 m_62__10157914__23045122 [0,1,0,1,0,0|2,0,0]=4 3347 B13R1.28 N#CC=CCSCC1CCCCC1 m_7__2303152__7140602 [0,1,0,1,0,0|1,0,1]=4 3348 B13R1.28 NC/C=C/CNC[C@H]1CCCCN1 m_269982__18320082__22485940 [0,1,0,1,0,0|2,0,0]=4 3349 B13R1.28 NCCCCCCN1CC=CCC1 m_269982__22517040__11677760 [0,1,0,1,0,0|2,0,0]=4 3350 B13R1.28 NCCCCSC[C@@H]1CC=CCC1 m_34__20871448__23045118 [0,1,0,1,0,0|2,0,0]=4 3351 B13R1.28 OCC#CCCNC1CCCCC1 m_207__21537544__121598 [0,1,0,1,0,0|0,0,2]=4 3352 B13R1.28 OCC#CCSCC1CCCCC1 m_62__5821484__15141012 [0,1,0,1,0,0|0,0,2]=4 3353 B13R1.28 OCC=CCNCC1CC=CCC1 m_207__11971532__121213 [0,1,0,1,0,0|0,0,2]=4 3354 B13R1.28 OCC=CCNCC1CCCCC1 m_207__11971532__121242 [0,1,0,1,0,0|0,0,0]=2 3355 B13R1.28 OCC=CCNCC1CCOCC1 m_207__11971532__5726270 [0,1,0,1,0,0|1,0,0]=3 3356 B13R1.28 OCC=CCNC[C@H]1CCCCN1 m_269982__18320082__16809282 [0,1,0,1,0,0|1,0,0]=3 3357 B13R1.28 OCC=CCSCC1=CCCCC1 m_7__22987508__16809272 [0,1,0,1,0,0|0,0,2]=4 3358 B13R1.28 OCC=CCSCC1CCCCC1 m_7__2303152__16809272 [0,1,0,1,0,0|0,0,0]=2 3359 B13R1.28 OCC=CCSCC1CCCCO1 m_7__22988072__16809272 [0,1,0,1,0,0|1,0,0]=3 3360 B13R1.28 OCC=CCSCC1CCCOC1 m_7__13584678__16809272 [0,1,0,1,0,0|1,0,0]=3 3361 B13R1.28 OCC=CCSCC1CCNCC1 m_7__22986844__16809272 [0,1,0,1,0,0|1,0,0]=3 3362 B13R1.28 OCC=CCSC[C@@H]1CCCNC1 m_7__22987726__16809272 [0,1,0,1,0,0|1,0,0]=3 3363 B13R1.28 OCC=CCSC[C@@H]1CNCCO1 m_7__22986850__16809272 [0,1,0,1,0,0|2,0,0]=4 3364 B13R1.28 OCCCCCCN1CC=CCC1 m_2230__8375936__13038782 [0,1,0,1,0,0|2,0,0]=4 3365 B13R1.28 OCCCCCCN1CCCCC1 m_2230__679042__13038782 [0,1,0,1,0,0|0,0,2]=4 3366 B13R1.28 OCCCCCNC1CCCCC1 m_207__9456940__121598 [0,1,0,1,0,0|0,0,2]=4 3367 B13R1.28 OCCCCCSC1CCCCC1 m_7__27197__6079158 [0,1,0,1,0,0|0,0,2]=4 3368 B13R1.28 OCCCCNCC1CC=CCC1 m_207__9433150__121213 [0,1,0,1,0,0|2,0,0]=4 3369 B13R1.28 OCCCCNCC1CCCCC1 m_207__9433150__121242 [0,1,0,1,0,0|0,0,2]=4 3370 B13R1.28 OCCCCSCC1CCCCC1 m_7__2303152__3191338 [0,1,0,1,0,0|0,0,2]=4 3371 B13R1.28 OCCCCSC[C@@H]1CC=CCC1 m_7__22849690__23045116 [0,1,0,1,0,0|2,0,0]=4 3372 B13R1.28 OCCCNCCC1CCCCC1 m_270004__8288584__9139688 [0,1,0,1,0,0|0,0,2]=4 3373 B13R1.28 OCCCSCCC1CCCCC1 m_7__17644380__6354 [0,1,0,1,0,0|0,0,2]=4 3374 B13R1.28 OCCNCCCC1CC=CCC1 m_270004__8349608__24594658 [0,1,0,1,0,0|2,0,0]=4 3375 B13R1.28 OCCNCCCC1CCCCC1 m_270004__8349608__9315710 [0,1,0,1,0,0|0,0,2]=4 3376 B13R1.28 OCCNCCCC1CCCOC1 m_270004__8349608__24721522 [0,1,0,1,0,0|1,0,1]=4 3377 B13R1.28 OCCOCCNC1CCCCC1 m_207__109688__121598 [0,1,0,1,0,0|1,0,1]=4 3378 B13R1.28 OCCOCCSC1CCCCC1 m_7__27197__11974692 [0,1,0,1,0,0|1,0,1]=4 3379 B13R1.28 OCCSCCCC1CCCCC1 m_62__13430104__10178562 [0,1,0,1,0,0|0,0,2]=4 3380 B13R1.28 OCCSCCCC1CCOCC1 m_62__9457312__10178562 [0,1,0,1,0,0|1,0,1]=4 3381 B13R1.28 OCCSCCCN1CCCCC1 m_7__128807__14468162 [0,1,0,1,0,0|1,0,1]=4 3382 B13R1.28 OCCSCCNC1CCCCC1 m_7__22986826__102708 [0,1,0,1,0,0|1,0,1]=4 3383 B13R1.28 OCCSCCOC1CCCCC1 m_7__128807__13038922 [0,1,0,1,0,0|1,0,1]=4 3384 B13R1.28 OCCSCCSC1CCCCC1 m_7__128807__13779410 [0,1,0,1,0,0|1,0,1]=4 3385 B13R1.34 CC1CCCCCC1NCCCO m_2230__8960872__680950 [0,1,0,1,0,0|0,0,2]=4 3386 B13R1.34 CC1CCCCCN1CC#CCO m_2230__9017564__15141016 [0,1,0,1,0,0|0,0,2]=4 3387 B13R1.34 CC1CCCCCN1CC=CC#N m_2230__9017564__16945818 [0,1,0,1,0,0|1,0,1]=4 3388 B13R1.34 CC1CCCCCN1CC=CCO m_2230__9017564__16809276 [0,1,0,1,0,0|0,0,0]=2 3389 B13R1.34 CC1CCCCCN1CCCCO m_2230__9017564__3191342 [0,1,0,1,0,0|0,0,2]=4 3390 B13R1.34 CC1CCNCCN1C/C=C/CN m_269982__14413696__22485940 [0,1,0,1,0,0|2,0,0]=4 3391 B13R1.34 CC1CCNCCN1CC=CCO m_269982__14413696__16809282 [0,1,0,1,0,0|1,0,0]=3 3392 B13R1.34 CC1CCOCCN1CC=CCO m_2230__13439614__16809276 [0,1,0,1,0,0|1,0,0]=3 3393 B13R1.34 CC1CCSCCN1CC=CCO m_2230__9285662__16809276 [0,1,0,1,0,0|1,0,0]=3 3394 B13R1.34 CC1COCCCN1CC=CCO m_2230__24525948__16809276 [0,1,0,1,0,0|1,0,0]=3 3395 B13R1.34 CC1CSCCCN1CC=CCO m_2230__13433016__16809276 [0,1,0,1,0,0|1,0,0]=3 3396 B13R1.34 COCCNC1CCCCCC1C m_2230__8960872__666874 [0,1,0,1,0,0|1,0,1]=4 3397 B13R1.34 C[C@@H]1CNCCCN1C/C=C/CN m_269982__22505118__22485940 [0,1,0,1,0,0|2,0,0]=4 3398 B13R1.34 C[C@@H]1CNCCCN1CC=CCO m_269982__22505118__16809282 [0,1,0,1,0,0|1,0,0]=3 3399 B13R1.34 C[C@@H]1COCCCN1C/C=C/CN m_269982__21997270__22485940 [0,1,0,1,0,0|2,0,0]=4 3400 B13R1.34 C[C@@H]1COCCCN1CC=CCO m_2230__21997220__16809276 [0,1,0,1,0,0|1,0,0]=3 3401 B13R1.84 C#CC1CCCCN1CC=CCO m_2230__13440892__16809276 [0,1,0,1,0,0|0,0,2]=4 3402 B13R1.84 C=CC1CCCCN1CC=CCO m_2230__9434618__16809276 [0,1,0,1,0,0|0,0,2]=4 3403 B13R1.84 CCC1CCCCC1CNCCO m_270004__8349608__11559920 [0,1,0,1,0,0|0,0,2]=4 3404 B13R1.84 CCC1CCCCC1NCCCO m_269862__7192678__8583362 [0,1,0,1,0,0|0,0,2]=4 3405 B13R1.84 CCC1CCCCC1NCCOC m_269862__7192698__8583362 [0,1,0,1,0,0|1,0,1]=4 3406 B13R1.84 CCC1CCCCN1CC#CCO m_2230__1722000__15141016 [0,1,0,1,0,0|0,0,2]=4 3407 B13R1.84 CCC1CCCCN1CC=CC#N m_2230__1722000__16945818 [0,1,0,1,0,0|1,0,1]=4 3408 B13R1.84 CCC1CCCCN1CC=CCO m_2230__1722000__16809276 [0,1,0,1,0,0|0,0,0]=2 3409 B13R1.84 CCC1CCCCN1CCCCO m_2230__1722000__3191342 [0,1,0,1,0,0|0,0,2]=4 3410 B13R1.84 CCC1COCCN1CC=CCO m_2230__4978178__16809276 [0,1,0,1,0,0|1,0,0]=3 3411 B13R1.84 CCCCCN1CCC=CC1CO m_2230__18367858__5063396 [0,1,0,1,0,0|1,0,0]=3 3412 B13R1.84 CCCCCN1CCCCC1CO m_2230__804372__5063396 [0,1,0,1,0,0|0,0,2]=4 3413 B13R1.84 CCCCN[C@@H]1CCCC[C@H]1CO m_2230__9438960__22993830 [0,1,0,1,0,0|0,0,2]=4 3414 B13R1.84 CCOCCN1CCC=CC1CO m_2230__18367858__681188 [0,1,0,1,0,0|2,0,0]=4 3415 B13R1.84 CCON=CC1CCCCC1CC m_4__158181__11560886 [0,1,0,1,0,0|2,0,0]=4 3416 B13R1.84 CCSCCN1CCC=CC1CO m_270004__24176336__8765926 [0,1,0,1,0,0|2,0,0]=4 3417 B13R1.84 COCCCN1CCC=CC1CO m_270004__24176336__24710510 [0,1,0,1,0,0|2,0,0]=4 3418 B13R1.84 CSCCCN1CCC=CC1CO m_2230__18367858__6165706 [0,1,0,1,0,0|2,0,0]=4 3419 B13R1.84 OCC1C=CCCN1CCCCCl m_270004__24176336__24721168 [0,1,0,1,0,0|2,0,0]=4 3420 B13R1.84 OCC1C=CCCN1CCCCF m_2230__18367858__10157922 [0,1,0,1,0,0|2,0,0]=4 3421 B13R1.84 OCC=CCN1CCCCC1CF m_2230__16896206__16809276 [0,1,0,1,0,0|1,0,0]=3 3422 B13R1.84 OCC=CCN1CCCCC1CO m_2230__804372__16809276 [0,1,0,1,0,0|1,0,0]=3 3423 B13R1.84 OCC=CCN1CCNCC1CF m_269982__22505114__16809282 [0,1,0,1,0,0|2,0,0]=4 3424 B13R1.84 OCC=CCN1CCNCC1CO m_269982__12889570__16809282 [0,1,0,1,0,0|2,0,0]=4 3425 B13R1.84 OCC=CCN1CCNC[C@H]1CO m_269982__23466534__16809282 [0,1,0,1,0,0|2,0,0]=4 3426 B13R1.84 OCC=CCN1CCOCC1CF m_2230__17068944__16809276 [0,1,0,1,0,0|2,0,0]=4 3427 B13R1.84 OCC=CCN1CCOCC1CO m_2230__15779506__16809276 [0,1,0,1,0,0|2,0,0]=4 3428 B13R1.84 OCC=CCN1CCSCC1CO m_2230__7964058__16809276 [0,1,0,1,0,0|2,0,0]=4 3429 B13R1.84 OCCCCN1CCC=CC1CO m_2230__18367858__3191342 [0,1,0,1,0,0|2,0,0]=4 3430 B13R1.137 C=CC=CCCN1CCCC1CC m_2230__4599928__12907972 [0,1,0,1,0,0|1,0,1]=4 3431 B13R1.137 CCC1CCCC1NC/C=C\CN m_272690__21478164__11347260 [0,1,0,1,0,0|1,0,0]=3 3432 B13R1.137 CCC1CCCC1NCC#CCO m_2230__9296238__15141016 [0,1,0,1,0,0|0,0,2]=4 3433 B13R1.137 CCC1CCCC1NCC=CCO m_270004__11971554__24181796 [0,1,0,1,0,0|0,0,0]=2 3434 B13R1.137 CCC1CCCC1NCCCCO m_2230__9296238__3191342 [0,1,0,1,0,0|0,0,2]=4 3435 B13R1.137 CCC1CCCN1CCCCCO m_2230__4599928__6079162 [0,1,0,1,0,0|0,0,2]=4 3436 B13R1.137 CCC1CCCN1CCOCCO m_2230__4599928__11974698 [0,1,0,1,0,0|1,0,1]=4 3437 B13R1.137 CCC1COCC1NCC=CCO m_270004__11971554__24722274 [0,1,0,1,0,0|1,0,0]=3 3438 B13R1.137 CCC=CCCN1CCCC1CC m_2230__4599928__8859726 [0,1,0,1,0,0|1,0,0]=3 3439 B13R1.137 CCC=CCCN1CCCC1CO m_2230__3379024__8859726 [0,1,0,1,0,0|2,0,0]=4 3440 B13R1.137 CCC=CCCN1CCC[C@H]1CF m_2230__17313732__8859726 [0,1,0,1,0,0|2,0,0]=4 3441 B13R1.137 CCC=CCNC1CCCC1CC m_269862__17312576__7202366 [0,1,0,1,0,0|1,0,0]=3 3442 B13R1.137 CCC=CCNC1CCCC1OC m_269862__17312576__12621944 [0,1,0,1,0,0|2,0,0]=4 3443 B13R1.137 CCC=CCNC1COCC1CC m_269862__17312576__11982532 [0,1,0,1,0,0|2,0,0]=4 3444 B13R1.137 CCCC=CCN1CCCC1CC m_2230__4599928__22993520 [0,1,0,1,0,0|2,0,0]=4 3445 B13R1.137 CCCCCCC1CCCC1=NO m_4__388124__3114760 [0,1,0,1,0,0|1,0,1]=4 3446 B13R1.137 CCCCCCN1C=CN=C1CO m_34__15789190__9139750 [0,1,0,1,0,0|1,0,1]=4 3447 B13R1.137 CCCCCCN1CC=CC1CF m_270004__24176356__24715030 [0,1,0,1,0,0|2,0,0]=4 3448 B13R1.137 CCCCCCN1CC=CC1CO m_270004__24176800__24715030 [0,1,0,1,0,0|1,0,0]=3 3449 B13R1.137 CCCCCCN1CCCC1CO m_270004__8134002__24715030 [0,1,0,1,0,0|0,0,2]=4 3450 B13R1.137 CCCCCN[C@@H]1CCC[C@H]1CO m_2230__22399992__5063396 [0,1,0,1,0,0|0,0,2]=4 3451 B13R1.137 CCCCCN[C@H]1CCC[C@H]1CO m_2230__22399092__5063396 [0,1,0,1,0,0|0,0,2]=4 3452 B13R1.137 CCCOCCN1CC=CC1CO m_2230__12911330__15503596 [0,1,0,1,0,0|2,0,0]=4 3453 B13R1.137 CCOCCCN1CC=CC1CO m_2230__12911330__5730886 [0,1,0,1,0,0|2,0,0]=4 3454 B13R1.137 CCSCCCN1CC=CC1CO m_2230__12911330__6165712 [0,1,0,1,0,0|2,0,0]=4 3455 B13R1.137 CC[C@@H]1OCC[C@H]1NCC=CCO m_2230__10911408__16809276 [0,1,0,1,0,0|1,0,0]=3 3456 B13R1.137 COC1CCCC1NCC=CCO m_270004__11971554__13287002 [0,1,0,1,0,0|1,0,0]=3 3457 B13R1.137 COCCCCN1CC=CC1CO m_2230__12911330__5062388 [0,1,0,1,0,0|2,0,0]=4 3458 B13R1.137 CO[C@@H]1CCC[C@H]1NCC=CCO m_2230__10745488__16809276 [0,1,0,1,0,0|1,0,0]=3 3459 B13R1.137 CO[C@@H]1COC[C@H]1NCC=CCO m_2230__11571956__16809276 [0,1,0,1,0,0|2,0,0]=4 3460 B13R1.137 CSC1CCCC1NCC=CCO m_2230__10117192__16809276 [0,1,0,1,0,0|1,0,0]=3 3461 B13R1.137 N#CC1CCCC1NCC=CCO m_2230__10117182__16809276 [0,1,0,1,0,0|1,0,1]=4 3462 B13R1.137 NC/C=C/CN[C@H]1CCC[C@@H]1CN m_269982__22505302__22485940 [0,1,0,1,0,0|2,0,0]=4 3463 B13R1.137 NC[C@H]1CCC[C@@H]1NCC=CCO m_269982__22505302__16809282 [0,1,0,1,0,0|1,0,0]=3 3464 B13R1.137 OCC1C=CCN1CCCCCCl m_270004__24176800__24721510 [0,1,0,1,0,0|2,0,0]=4 3465 B13R1.137 OCC1C=CCN1CCCCCF m_2230__12911330__9984638 [0,1,0,1,0,0|2,0,0]=4 3466 B13R1.137 OCC=CCN[C@@H]1CCC[C@H]1CF m_2230__22396922__16809276 [0,1,0,1,0,0|1,0,0]=3 3467 B13R1.137 OCC=CCN[C@@H]1CCC[C@H]1CO m_2230__22399992__16809276 [0,1,0,1,0,0|1,0,0]=3 3468 B13R1.137 OCC=CCN[C@H]1CCC[C@H]1CO m_2230__22399092__16809276 [0,1,0,1,0,0|1,0,0]=3 3469 B13R1.137 OCC=CCN[C@H]1COC[C@H]1CO m_2230__21290468__16809276 [0,1,0,1,0,0|2,0,0]=4 3470 B13R1.137 OCCCCCN1CC=CC1CO m_2230__12911330__6079162 [0,1,0,1,0,0|2,0,0]=4 3471 B13R1.154 CC1CCCCCCN1CCCO m_2230__16908182__680950 [0,1,0,1,0,0|0,0,2]=4 3472 B13R1.154 CCCSC1CCCCCCC1O m_7__22986886__23815120 [0,1,0,1,0,0|0,0,2]=4 3473 B13R1.154 COCCN1CCCCCCC1C m_2230__16908182__666874 [0,1,0,1,0,0|1,0,1]=4 3474 B13R1.154 N[C@H]1CCCCCC[C@H]1NCCO m_269982__22842878__10880280 [0,1,0,1,0,0|1,0,1]=4 3475 B13R1.154 OCCSC1CCCCCCC1O m_7__128807__23815120 [0,1,0,1,0,0|1,0,1]=4 3476 B13R1.192 CCC=CCCN1CCC1COC m_2230__10478002__8859726 [0,1,0,1,0,0|2,0,0]=4 3477 B13R1.192 COCC1CCC1NCC=CCO m_270004__11971554__24709852 [0,1,0,1,0,0|1,0,0]=3 3478 B13R1.192 N#CCC1CCC1NCC=CCO m_269862__11971552__23042128 [0,1,0,1,0,0|1,0,1]=4 3479 B13R1.192 OCC=CCNC1CCC1CCCl m_270004__11971554__24722846 [0,1,0,1,0,0|1,0,0]=3 3480 B13R1.207 CCC1CCCCCCN1CCO m_2230__22408112__6165700 [0,1,0,1,0,0|0,0,2]=4 3481 B13R1.225 CCCN1CCCCCC1CCO m_2230__9966898__13271112 [0,1,0,1,0,0|0,0,2]=4 3482 B13R1.225 OCCC1CCCCCN1CCO m_2230__9966898__6165700 [0,1,0,1,0,0|1,0,1]=4 3483 B13R1.485 CCCC1CCCCC1=NOCC m_4__158181__11571974 [0,1,0,1,0,0|2,0,0]=4 3484 B13R1.485 CCCC1CCCCC1NCCO m_2230__8960858__6165700 [0,1,0,1,0,0|0,0,2]=4 3485 B13R1.485 CCCC1CCCCN1CCCO m_2230__8750840__680950 [0,1,0,1,0,0|0,0,2]=4 3486 B13R1.485 CCCC1CCCCN1CCOC m_2230__8750840__666874 [0,1,0,1,0,0|1,0,1]=4 3487 B13R1.485 CCCC1CCOCC1NCCO m_270004__8349608__24722284 [0,1,0,1,0,0|1,0,1]=4 3488 B13R1.485 CCCC1COCCC1NCCO m_270004__8349608__24722480 [0,1,0,1,0,0|1,0,1]=4 3489 B13R1.485 CCCCN1CCCCC1CCO m_2230__3225030__22993830 [0,1,0,1,0,0|0,0,2]=4 3490 B13R1.485 CCCN1CCCCC1CCCO m_2230__22407830__13271112 [0,1,0,1,0,0|0,0,2]=4 3491 B13R1.485 CCCN[C@H]1CCCC[C@H]1CCO m_2230__13770344__13271112 [0,1,0,1,0,0|0,0,2]=4 3492 B13R1.485 CCNC1CCCCC1CCCO m_269862__7865270__10427888 [0,1,0,1,0,0|0,0,2]=4 3493 B13R1.485 CCOCC1CCCCN1CCO m_2230__10908642__6165700 [0,1,0,1,0,0|1,0,1]=4 3494 B13R1.485 CCO[C@@H]1CCCC[C@H]1NCCO m_2230__10861026__6165700 [0,1,0,1,0,0|1,0,1]=4 3495 B13R1.485 CCSC1CCCCC1NCCO m_2230__9012920__6165700 [0,1,0,1,0,0|1,0,1]=4 3496 B13R1.485 CNCCC1CCCCN1CCO m_269982__14180992__10880280 [0,1,0,1,0,0|1,0,1]=4 3497 B13R1.485 OCCCC1CCCCN1CCO m_2230__22407830__6165700 [0,1,0,1,0,0|1,0,1]=4 3498 B13R1.485 OCCN[C@H]1CCCC[C@H]1CCO m_2230__13770344__6165700 [0,1,0,1,0,0|1,0,1]=4 3499 B13R1.489 CCON=C1CCCCCCCC1 m_4__158181__16640196 [0,1,0,1,0,0|2,0,0]=4 3500 B13R1.489 COCCN1CCCCCCCC1 m_2230__10808630__666874 [0,1,0,1,0,0|1,0,1]=4 3501 B13R1.489 OCCCN1CCCCCCCC1 m_2230__10808630__680950 [0,1,0,1,0,0|0,0,2]=4 3502 B13R1.489 OCCNC1CCCCCCCC1 m_269862__7193048__16640202 [0,1,0,1,0,0|0,0,2]=4 3503 B13R1.555 C=CC=CCCN1CCCCC1C m_2230__678754__12907972 [0,1,0,1,0,0|1,0,1]=4 3504 B13R1.555 C=CC=CCCN1CCCC[C@H]1C m_2230__22409340__12907972 [0,1,0,1,0,0|1,0,1]=4 3505 B13R1.555 C=CCCCN[C@H]1CCC=C[C@H]1O m_270004__23854588__17507834 [0,1,0,1,0,0|0,0,2]=4 3506 B13R1.555 CC1CCCCC1CSCCCO m_7__10972294__11946492 [0,1,0,1,0,0|0,0,2]=4 3507 B13R1.555 CC1CCCCC1NC/C=C\CN m_272690__21478164__11346074 [0,1,0,1,0,0|1,0,0]=3 3508 B13R1.555 CC1CCCCC1NCC#CCO m_2230__8740226__15141016 [0,1,0,1,0,0|0,0,2]=4 3509 B13R1.555 CC1CCCCC1NCC=CCO m_270004__11971554__8157330 [0,1,0,1,0,0|0,0,0]=2 3510 B13R1.555 CC1CCCCC1NCCCCO m_2230__8740226__3191342 [0,1,0,1,0,0|0,0,2]=4 3511 B13R1.555 CC1CCCCN1CCCCCO m_2230__678754__6079162 [0,1,0,1,0,0|0,0,2]=4 3512 B13R1.555 CC1CCCCN1CCOCCO m_2230__678754__11974698 [0,1,0,1,0,0|1,0,1]=4 3513 B13R1.555 CC1CCNCC1NC/C=C/CN m_269982__22505482__22485940 [0,1,0,1,0,0|2,0,0]=4 3514 B13R1.555 CC1CCNCC1NCC=CCO m_269982__22505482__16809282 [0,1,0,1,0,0|1,0,0]=3 3515 B13R1.555 CC1CCOCC1NCC=CCO m_270004__11971554__13753810 [0,1,0,1,0,0|1,0,0]=3 3516 B13R1.555 CC1CNCCC1NC/C=C/CN m_269982__17670816__22485940 [0,1,0,1,0,0|2,0,0]=4 3517 B13R1.555 CC1CNCCC1NCC=CCO m_269982__17670816__16809282 [0,1,0,1,0,0|1,0,0]=3 3518 B13R1.555 CC1COCCC1NCC=CCO m_270004__11971554__9582754 [0,1,0,1,0,0|1,0,0]=3 3519 B13R1.555 CC1NCCCC1NC/C=C\CN m_272690__21478164__13074676 [0,1,0,1,0,0|2,0,0]=4 3520 B13R1.555 CC1SCCCC1NCC=CCO m_270004__11971554__24722464 [0,1,0,1,0,0|1,0,0]=3 3521 B13R1.555 CCC=CCCN1CCCCC1C m_2230__678754__8859726 [0,1,0,1,0,0|1,0,0]=3 3522 B13R1.555 CCC=CCCN1CCCC[C@H]1C m_2230__22409340__8859726 [0,1,0,1,0,0|1,0,0]=3 3523 B13R1.555 CCC=CCCN1CCOCC1C m_2230__679548__8859726 [0,1,0,1,0,0|2,0,0]=4 3524 B13R1.555 CCC=CCCN1CCOC[C@@H]1C m_2230__10745968__8859726 [0,1,0,1,0,0|2,0,0]=4 3525 B13R1.555 CCC=CCCN1CCSCC1C m_2230__5359444__8859726 [0,1,0,1,0,0|2,0,0]=4 3526 B13R1.555 CCC=CCNC1CCCCC1C m_269862__17312576__7200292 [0,1,0,1,0,0|1,0,0]=3 3527 B13R1.555 CCC=CCNC1CCCC[C@H]1F m_269862__17312576__16655726 [0,1,0,1,0,0|2,0,0]=4 3528 B13R1.555 CCC=CCNC1CCCSC1C m_269862__17312576__18353016 [0,1,0,1,0,0|2,0,0]=4 3529 B13R1.555 CCC=CCNC1CCOCC1C m_269862__17312576__9582752 [0,1,0,1,0,0|2,0,0]=4 3530 B13R1.555 CCC=CCNC1COCCC1C m_269862__17312576__15475114 [0,1,0,1,0,0|2,0,0]=4 3531 B13R1.555 CCC=NOCC1CCCCC1C m_34__17309904__11946494 [0,1,0,1,0,0|2,0,0]=4 3532 B13R1.555 CCCC=CCN1CCCCC1C m_2230__678754__22993520 [0,1,0,1,0,0|2,0,0]=4 3533 B13R1.555 CCCC=CCN1CCCC[C@H]1C m_2230__22409340__22993520 [0,1,0,1,0,0|2,0,0]=4 3534 B13R1.555 CCCCCN[C@@H]1CC=CC[C@H]1C m_2230__13442036__5063396 [0,1,0,1,0,0|2,0,0]=4 3535 B13R1.555 CCCCNCC1CC=CCC1C m_270004__8289202__16464034 [0,1,0,1,0,0|2,0,0]=4 3536 B13R1.555 CCSCCN[C@H]1CCC=C[C@H]1O m_270004__23854588__8765926 [0,1,0,1,0,0|1,0,0]=3 3537 B13R1.555 CN1CCCCC1CCSCCO m_7__128807__6699 [0,1,0,1,0,0|1,0,1]=4 3538 B13R1.555 COCCCN[C@H]1CCC=C[C@H]1O m_270004__23854588__24710510 [0,1,0,1,0,0|1,0,0]=3 3539 B13R1.555 COCCSCC1CCCCC1C m_62__11946498__8623480 [0,1,0,1,0,0|1,0,1]=4 3540 B13R1.555 C[C@@H]1CCCCN1CCCCCO m_2230__22409340__6079162 [0,1,0,1,0,0|0,0,2]=4 3541 B13R1.555 C[C@@H]1CCCCN1CCOCCO m_2230__22409340__11974698 [0,1,0,1,0,0|1,0,1]=4 3542 B13R1.555 C[C@H]1CC=CC[C@@H]1NCC=CCO m_2230__13442036__16809276 [0,1,0,1,0,0|0,0,2]=4 3543 B13R1.555 NC/C=C/CN[C@@H]1CCCC[C@H]1N m_269982__11506054__22485940 [0,1,0,1,0,0|2,0,0]=4 3544 B13R1.555 NC/C=C/CN[C@H]1CCCC[C@H]1N m_269982__15500706__22485940 [0,1,0,1,0,0|2,0,0]=4 3545 B13R1.555 N[C@@H]1CCCC[C@@H]1NCC=CCO m_269982__15500706__16809282 [0,1,0,1,0,0|1,0,0]=3 3546 B13R1.555 N[C@H]1CCCC[C@@H]1NCC=CCO m_269982__11506054__16809282 [0,1,0,1,0,0|1,0,0]=3 3547 B13R1.555 N[C@H]1CCOC[C@H]1NCC=CCO m_269982__17754826__16809282 [0,1,0,1,0,0|2,0,0]=4 3548 B13R1.555 N[C@H]1COCC[C@H]1NCC=CCO m_269982__17754790__16809282 [0,1,0,1,0,0|2,0,0]=4 3549 B13R1.555 OCC=CCNC1CCCC[C@H]1F m_270004__11971554__16655764 [0,1,0,1,0,0|1,0,0]=3 3550 B13R1.555 OCC=CCNC1CCOCC1F m_270004__11971554__24722146 [0,1,0,1,0,0|2,0,0]=4 3551 B13R1.555 O[C@H]1C=CCC[C@H]1NCCCCCl m_270004__23854588__24721168 [0,1,0,1,0,0|1,0,0]=3 3552 B13R1.559 CC/C=C\CCCNCC1CC1C m_270004__8290112__24594278 [0,1,0,1,0,0|1,0,0]=3 3553 B13R1.559 CC/C=C\CCCNCC1CC1Cl m_270004__18333456__24594278 [0,1,0,1,0,0|2,0,0]=4 3554 B13R1.559 CC/C=C\CCCNC[C@@H]1C[C@H]1Br m_270004__23833090__24594278 [0,1,0,1,0,0|2,0,0]=4 3555 B13R1.559 CC/C=C\CCCNC[C@@H]1C[C@H]1C m_270004__16491714__24594278 [0,1,0,1,0,0|1,0,0]=3 3556 B13R1.559 CC/C=C\CCCNC[C@@H]1C[C@H]1F m_270004__23817766__24594278 [0,1,0,1,0,0|2,0,0]=4 3557 B13R1.559 CC/C=C\CCCNC[C@@H]1C[C@H]1O m_270004__25073046__24594278 [0,1,0,1,0,0|2,0,0]=4 3558 B13R1.559 CC1CC1CCCCNCCCO m_270004__8288584__24715066 [0,1,0,1,0,0|0,0,2]=4 3559 B13R1.559 CC1CC1CCCCSCCCO m_7__22987818__6354 [0,1,0,1,0,0|0,0,2]=4 3560 B13R1.559 CC1CC1CCCSCC#CCO m_62__17055834__15141012 [0,1,0,1,0,0|0,0,2]=4 3561 B13R1.559 CC1CC1CCCSCC=CC#N m_7__18317424__7140602 [0,1,0,1,0,0|1,0,1]=4 3562 B13R1.559 CC1CC1CCCSCC=CCO m_7__18317424__16809272 [0,1,0,1,0,0|0,0,0]=2 3563 B13R1.559 CC1CC1CCCSCCCCO m_7__18317424__3191338 [0,1,0,1,0,0|0,0,2]=4 3564 B13R1.559 CC1CC1CNCCCCCCO m_270004__8300498__9139722 [0,1,0,1,0,0|0,0,2]=4 3565 B13R1.559 CC1CC1CNCCCOCCO m_270004__8602160__9139722 [0,1,0,1,0,0|1,0,1]=4 3566 B13R1.559 CC1CC1CNCCCSCCO m_270004__23851182__9139722 [0,1,0,1,0,0|1,0,1]=4 3567 B13R1.559 CCCC=CCCNCC1CC1C m_270004__23849914__9139722 [0,1,0,1,0,0|2,0,0]=4 3568 B13R1.559 CCCC=CCCSCC1CC1C m_62__12216592__7875324 [0,1,0,1,0,0|2,0,0]=4 3569 B13R1.559 CCCC=CCCSC[C@@H]1C[C@H]1C m_62__23861440__7875324 [0,1,0,1,0,0|2,0,0]=4 3570 B13R1.559 CCCCCCCNC[C@@H]1C[C@H]1O m_270004__25073046__24715022 [0,1,0,1,0,0|0,0,2]=4 3571 B13R1.559 COCCNCCCCC1CC1C m_270004__8288600__24715066 [0,1,0,1,0,0|1,0,1]=4 3572 B13R1.559 COCCSCCCCC1CC1C m_7__22987818__149891 [0,1,0,1,0,0|1,0,1]=4 3573 B13R1.559 C[C@H]1C[C@H]1CCCNCCCCO m_270004__9433178__24714994 [0,1,0,1,0,0|0,0,2]=4 3574 B13R1.560 C=CC=CCCSCCC1CCC1 m_62__12907966__12121634 [0,1,0,1,0,0|1,0,1]=4 3575 B13R1.560 CC/C=C\CCCNCC1CCC1 m_270004__8293648__24594278 [0,1,0,1,0,0|1,0,0]=3 3576 B13R1.560 CC/C=C\CCCNCC1COC1 m_270004__12311422__24594278 [0,1,0,1,0,0|2,0,0]=4 3577 B13R1.560 CC/C=C\CCCNCC1CSC1 m_270004__12420068__24594278 [0,1,0,1,0,0|2,0,0]=4 3578 B13R1.560 CC/C=C\CCCNC[C@H]1CCO1 m_270004__23851266__24594278 [0,1,0,1,0,0|2,0,0]=4 3579 B13R1.560 CCC=CCCSCCC1CCC1 m_62__8859720__12121634 [0,1,0,1,0,0|1,0,0]=3 3580 B13R1.560 CCCC=CCCNCC1CCC1 m_270004__23849914__24715052 [0,1,0,1,0,0|2,0,0]=4 3581 B13R1.560 CCCC=CCCSCC1CCC1 m_62__6007776__7875324 [0,1,0,1,0,0|2,0,0]=4 3582 B13R1.560 CCCCCCCCNC1COC1 m_269862__8256904__7931470 [0,1,0,1,0,0|1,0,1]=4 3583 B13R1.560 CCCCCCCCSC1COC1 m_7__13420946__9282116 [0,1,0,1,0,0|1,0,1]=4 3584 B13R1.560 CCCCCCCNC[C@H]1CCO1 m_270004__23851266__24715022 [0,1,0,1,0,0|0,0,2]=4 3585 B13R1.560 CCCCCCNCCC1CCO1 m_270004__23839986__24715030 [0,1,0,1,0,0|0,0,2]=4 3586 B13R1.560 N#CC=CCSCCCC1CCC1 m_7__22987742__7140602 [0,1,0,1,0,0|1,0,1]=4 3587 B13R1.560 OCC#CCSCCCC1CCC1 m_62__12056160__15141012 [0,1,0,1,0,0|0,0,2]=4 3588 B13R1.560 OCC=CCSCCCC1CCC1 m_7__22987742__16809272 [0,1,0,1,0,0|0,0,0]=2 3589 B13R1.560 OCC=CCSCCOC1CNC1 m_7__22871144__16809272 [0,1,0,1,0,0|2,0,0]=4 3590 B13R1.560 OCCCCCCCSC1CCC1 m_7__10684076__6174984 [0,1,0,1,0,0|0,0,2]=4 3591 B13R1.560 OCCCCCCNCC1CCC1 m_270004__8300498__24715052 [0,1,0,1,0,0|0,0,2]=4 3592 B13R1.560 OCCCCCSCCC1CCC1 m_7__22987652__6079158 [0,1,0,1,0,0|0,0,2]=4 3593 B13R1.560 OCCCCNCCCC1CCC1 m_270004__9433178__18051886 [0,1,0,1,0,0|0,0,2]=4 3594 B13R1.560 OCCCCSCCCC1CCC1 m_7__22987742__3191338 [0,1,0,1,0,0|0,0,2]=4 3595 B13R1.560 OCCOCCCNCC1CCC1 m_270004__8602160__24715052 [0,1,0,1,0,0|1,0,1]=4 3596 B13R1.560 OCCOCCSCCC1CCC1 m_62__12121632__8799516 [0,1,0,1,0,0|1,0,1]=4 3597 B13R1.560 OCCSCCCNCC1CCC1 m_270004__23851182__24715052 [0,1,0,1,0,0|1,0,1]=4 3598 B13R1.570 CCC1CCCCCC1NCCO m_269862__7193048__13610262 [0,1,0,1,0,0|0,0,2]=4 3599 B13R1.570 CCC1CCCCCN1CCCO m_2230__5454866__680950 [0,1,0,1,0,0|0,0,2]=4 3600 B13R1.570 CCC1CCCCCN1CCOC m_2230__5454866__666874 [0,1,0,1,0,0|1,0,1]=4 3601 B13R1.570 CCCCN1CCCCCC1CO m_2230__11757172__22993830 [0,1,0,1,0,0|0,0,2]=4 3602 B13R1.570 CCCNC1CCCCCC1CO m_2230__24001472__13271112 [0,1,0,1,0,0|0,0,2]=4 3603 B13R1.570 CCON=C1CCCCCC1CC m_4__158181__13610260 [0,1,0,1,0,0|2,0,0]=4 3604 B13R1.570 CO[C@@H]1CCCCC[C@H]1NCCO m_2230__14595306__6165700 [0,1,0,1,0,0|1,0,1]=4 3605 B13R1.570 OCCNC1CCCCCC1CO m_2230__24001472__6165700 [0,1,0,1,0,0|1,0,1]=4 3606 B13R1.579 CCCCC1CCCC1=NOCC m_4__158181__2990870 [0,1,0,1,0,0|2,0,0]=4 3607 B13R1.579 CCCCC1CCCC1NCCO m_2230__8740342__6165700 [0,1,0,1,0,0|0,0,2]=4 3608 B13R1.579 CCCCC1CCCN1CCCO m_2230__15143778__680950 [0,1,0,1,0,0|0,0,2]=4 3609 B13R1.579 CCCCC1CCCN1CCOC m_2230__15143778__666874 [0,1,0,1,0,0|1,0,1]=4 3610 B13R1.579 CCCCN1CCCC1CCCO m_2230__2783860__22993830 [0,1,0,1,0,0|0,0,2]=4 3611 B13R1.579 CCOCC1CCCC1NCCO m_270004__8349608__9480092 [0,1,0,1,0,0|1,0,1]=4 3612 B13R1.579 COCCC1CCCC1NCCO m_269862__7193048__9817838 [0,1,0,1,0,0|1,0,1]=4 3613 B13R1.579 OCCNC1CCCC1CCCF m_269862__7193048__9870388 [0,1,0,1,0,0|1,0,1]=4 3614 B13R1.655 C=CC=CCCNC1CCC1CC m_269862__12896184__10177948 [0,1,0,1,0,0|1,0,1]=4 3615 B13R1.655 CC/C=C\CCCN1CCC1CC m_270004__10437848__24594278 [0,1,0,1,0,0|1,0,0]=3 3616 B13R1.655 CC/C=C\CCCN1CCC1CF m_270004__17655284__24594278 [0,1,0,1,0,0|2,0,0]=4 3617 B13R1.655 CC/C=C\CCCN1CCC1CO m_270004__24176176__24594278 [0,1,0,1,0,0|2,0,0]=4 3618 B13R1.655 CCC1CCC1NCC=CCOC m_270004__24044358__10177950 [0,1,0,1,0,0|1,0,0]=3 3619 B13R1.655 CCC1CCC1NCC=CCSC m_269862__23005650__10177948 [0,1,0,1,0,0|1,1,0]=4 3620 B13R1.655 CCC1CCC1NCCC#CCO m_269862__21537560__10177948 [0,1,0,1,0,0|0,0,2]=4 3621 B13R1.655 CCC1CCC1NCCCCCO m_269862__9456966__10177948 [0,1,0,1,0,0|0,0,2]=4 3622 B13R1.655 CCC1CCC1NCCOCCO m_269862__7193024__10177948 [0,1,0,1,0,0|1,0,1]=4 3623 B13R1.655 CCC1CCC1NCCSCCO m_269862__21508856__10177948 [0,1,0,1,0,0|1,0,1]=4 3624 B13R1.655 CCCC=CCNC1CCC1CC m_269862__14718656__10177948 [0,1,0,1,0,0|2,0,0]=4 3625 B13R1.655 CCCCCCCN1CCC1CO m_270004__24176176__24715022 [0,1,0,1,0,0|0,0,2]=4 3626 B13R1.655 CCCCCCNC1CCC1CO m_269862__7192686__17047872 [0,1,0,1,0,0|0,0,2]=4 3627 B13R1.655 CCCCCCN[C@H]1CC[C@H]1CO m_270004__23853202__24715030 [0,1,0,1,0,0|0,0,2]=4 3628 B13R1.659 C=CC=CCCSCCCC1CC1 m_62__12907966__12641598 [0,1,0,1,0,0|1,0,1]=4 3629 B13R1.659 CC/C=C\CCCNCCC1CC1 m_270004__8297762__24594278 [0,1,0,1,0,0|1,0,0]=3 3630 B13R1.659 CCC=CCCSCCCC1CC1 m_62__8859720__12641598 [0,1,0,1,0,0|1,0,0]=3 3631 B13R1.659 CCC=CCCSCCOC1CC1 m_62__8859720__13445166 [0,1,0,1,0,0|2,0,0]=4 3632 B13R1.659 CCC=NOCCCCCC1CC1 m_34__17309904__13582076 [0,1,0,1,0,0|2,0,0]=4 3633 B13R1.659 CCCC=CCCNCCC1CC1 m_270004__23849914__13455800 [0,1,0,1,0,0|2,0,0]=4 3634 B13R1.659 CCCC=CCCSCCC1CC1 m_62__9143160__7875324 [0,1,0,1,0,0|2,0,0]=4 3635 B13R1.659 COCCNCCCCCC1CC1 m_270004__8288600__24715076 [0,1,0,1,0,0|1,0,1]=4 3636 B13R1.659 COCCSCCCCCC1CC1 m_62__524272__13582082 [0,1,0,1,0,0|1,0,1]=4 3637 B13R1.659 OCC#CCSCCCCC1CC1 m_62__13763130__15141012 [0,1,0,1,0,0|0,0,2]=4 3638 B13R1.659 OCCCCCCCCSC1CC1 m_7__22987858__22787460 [0,1,0,1,0,0|0,0,2]=4 3639 B13R1.659 OCCCCCCCNCC1CC1 m_207__13810894__2989440 [0,1,0,1,0,0|0,0,2]=4 3640 B13R1.659 OCCCCCCCSCC1CC1 m_7__10390288__6174984 [0,1,0,1,0,0|0,0,2]=4 3641 B13R1.659 OCCCCCCNCCC1CC1 m_270004__8300498__13455800 [0,1,0,1,0,0|0,0,2]=4 3642 B13R1.659 OCCCCCCSCCC1CC1 m_7__18798568__6673274 [0,1,0,1,0,0|0,0,2]=4 3643 B13R1.659 OCCCCCSCCCC1CC1 m_7__22987332__6079158 [0,1,0,1,0,0|0,0,2]=4 3644 B13R1.659 OCCCCSCCCCC1CC1 m_7__22849690__13763124 [0,1,0,1,0,0|0,0,2]=4 3645 B13R1.659 OCCCNCCCCCC1CC1 m_270004__8288584__24715076 [0,1,0,1,0,0|0,0,2]=4 3646 B13R1.659 OCCCSCCCCCC1CC1 m_7__22988058__6354 [0,1,0,1,0,0|0,0,2]=4 3647 B13R1.659 OCCOCCCNCCC1CC1 m_270004__8602160__13455800 [0,1,0,1,0,0|1,0,1]=4 3648 B13R1.659 OCCOCCSCCCC1CC1 m_62__12641596__8799516 [0,1,0,1,0,0|1,0,1]=4 3649 B13R1.659 OCCSCCCCNCC1CC1 m_270004__23843874__7548776 [0,1,0,1,0,0|1,0,1]=4 3650 B13R1.659 OCCSCCCNCCC1CC1 m_270004__23851182__13455800 [0,1,0,1,0,0|1,0,1]=4 3651 B13R1.667 C=CC=CCCSC[C@H]1CC[C@H]1C m_62__21674490__12907968 [0,1,0,1,0,0|1,0,1]=4 3652 B13R1.667 CC/C=C\CCCNC1CCC1C m_270004__10158636__24594278 [0,1,0,1,0,0|1,0,0]=3 3653 B13R1.667 CC/C=C\CCCN[C@H]1CC[C@H]1F m_270004__16535300__24594278 [0,1,0,1,0,0|2,0,0]=4 3654 B13R1.667 CC/C=C\CCCN[C@H]1CC[C@H]1O m_270004__20353356__24594278 [0,1,0,1,0,0|2,0,0]=4 3655 B13R1.667 CC1CCC1NCCCCCCO m_269862__8283026__9109936 [0,1,0,1,0,0|0,0,2]=4 3656 B13R1.667 CC1CCC1NCCCOCCO m_269862__8602158__9109936 [0,1,0,1,0,0|1,0,1]=4 3657 B13R1.667 CCC=CCCSC[C@@H]1CC[C@H]1O m_62__8859720__23862058 [0,1,0,1,0,0|2,0,0]=4 3658 B13R1.667 CCC=CCCSC[C@H]1CC[C@H]1C m_62__8859720__21674492 [0,1,0,1,0,0|1,0,0]=3 3659 B13R1.667 CCCCCCCN[C@H]1CC[C@H]1O m_270004__20353356__24715022 [0,1,0,1,0,0|0,0,2]=4 3660 B13R1.667 CCCCCCCSC1CCC1O m_7__22986908__7284628 [0,1,0,1,0,0|0,0,2]=4 3661 B13R1.667 CCCCCCNC[C@@H]1CC[C@H]1O m_270004__21537060__24715030 [0,1,0,1,0,0|0,0,2]=4 3662 B13R1.667 CCCCCCSC[C@@H]1CC[C@H]1O m_62__8854732__23862058 [0,1,0,1,0,0|0,0,2]=4 3663 B13R1.667 C[C@H]1CC[C@H]1CSCCOCCO m_62__21674490__8799516 [0,1,0,1,0,0|1,0,1]=4 3664 B13R1.671 CCCC1CCCC1NCCCO m_269862__7192678__9452584 [0,1,0,1,0,0|0,0,2]=4 3665 B13R1.671 CCCC1CCCC1NCCOC m_269862__7192698__9452584 [0,1,0,1,0,0|1,0,1]=4 3666 B13R1.671 CCCC1CCCN1CC#CCO m_2230__13579908__15141016 [0,1,0,1,0,0|0,0,2]=4 3667 B13R1.671 CCCC1CCCN1CC=CC#N m_2230__13579908__16945818 [0,1,0,1,0,0|1,0,1]=4 3668 B13R1.671 CCCC1CCCN1CC=CCO m_2230__13579908__16809276 [0,1,0,1,0,0|0,0,0]=2 3669 B13R1.671 CCCC1CCCN1CCCCO m_2230__13579908__3191342 [0,1,0,1,0,0|0,0,2]=4 3670 B13R1.671 CCCCCN1CCCC1CCO m_2230__10893840__5063396 [0,1,0,1,0,0|0,0,2]=4 3671 B13R1.671 CNCC1CCCN1C/C=C/CN m_269982__7368852__22485940 [0,1,0,1,0,0|2,0,0]=4 3672 B13R1.671 CNCC1CCCN1CC=CCO m_269982__7368852__16809282 [0,1,0,1,0,0|1,0,0]=3 3673 B13R1.671 COCC1CCCN1CC=CCO m_2230__16794284__16809276 [0,1,0,1,0,0|1,0,0]=3 3674 B13R1.671 COC[C@H]1CCCN1CC=CCO m_2230__22392084__16809276 [0,1,0,1,0,0|1,0,0]=3 3675 B13R1.671 CSCC1CCCN1CC=CCO m_2230__7345896__16809276 [0,1,0,1,0,0|1,0,0]=3 3676 B13R1.671 N#CC[C@@H]1CCCN1CC=CCO m_2230__20820756__16809276 [0,1,0,1,0,0|1,0,1]=4 3677 B13R1.671 OCC=CCN1CCCC1CCO m_2230__10893840__16809276 [0,1,0,1,0,0|1,0,0]=3 3678 B13R1.1150 CCCSCC1CCC=CCCC1 m_62__875778__15780340 [0,1,0,1,0,0|1,0,0]=3 3679 B13R1.1150 CCON=CC1CCCCCCC1 m_4__158181__7831728 [0,1,0,1,0,0|2,0,0]=4 3680 B13R1.1150 COCC=CC1=CCCCCCC1 m_271570__13967852__15765696 [0,1,0,1,0,0|0,0,2]=4 3681 B13R1.1150 COCCNC1CCCCCCC1 m_269862__7192698__7200188 [0,1,0,1,0,0|1,0,1]=4 3682 B13R1.1150 N#CC=CCN1CCCCCCC1 m_2230__665322__16945818 [0,1,0,1,0,0|1,0,1]=4 3683 B13R1.1150 NC/C=C/CN1CCCCCCC1 m_269982__7368966__22485940 [0,1,0,1,0,0|1,0,0]=3 3684 B13R1.1150 NCCSCC1CCC=CCCC1 m_7__20871276__15780332 [0,1,0,1,0,0|2,0,0]=4 3685 B13R1.1150 OCC#CCN1CCCCCCC1 m_2230__665322__15141016 [0,1,0,1,0,0|0,0,2]=4 3686 B13R1.1150 OCC=CCN1CCCCCCC1 m_2230__665322__16809276 [0,1,0,1,0,0|0,0,0]=2 3687 B13R1.1150 OCCC=CC1=CCCCCCC1 m_271570__18671968__15765696 [0,1,0,1,0,0|0,0,2]=4 3688 B13R1.1150 OCCCCN1CCCCCCC1 m_2230__665322__3191342 [0,1,0,1,0,0|0,0,2]=4 3689 B13R1.1150 OCCCNC1CCCCCCC1 m_269862__7192678__7200188 [0,1,0,1,0,0|0,0,2]=4 3690 B13R1.1150 OCCNCC1CCCCCCC1 m_207__121484__6388778 [0,1,0,1,0,0|0,0,2]=4 3691 B13R1.1150 OCCSCC1CCC=CCCC1 m_62__15780338__10178562 [0,1,0,1,0,0|2,0,0]=4 3692 B13R1.1887 C=CC=CCCN1CCCCCC1 m_2230__678972__12907972 [0,1,0,1,0,0|1,0,1]=4 3693 B13R1.1887 CCC=CCCN1CCCCCC1 m_2230__678972__8859726 [0,1,0,1,0,0|1,0,0]=3 3694 B13R1.1887 CCC=CCCN1CCCOCC1 m_2230__6727026__8859726 [0,1,0,1,0,0|2,0,0]=4 3695 B13R1.1887 CCC=CCCN1CCCSCC1 m_2230__7912842__8859726 [0,1,0,1,0,0|2,0,0]=4 3696 B13R1.1887 CCC=CCNC1CCCCCC1 m_207__17312546__121595 [0,1,0,1,0,0|1,0,0]=3 3697 B13R1.1887 CCC=CCNC1CCCSCC1 m_269862__17312576__11947008 [0,1,0,1,0,0|2,0,0]=4 3698 B13R1.1887 CCC=NOCC1CCCCCC1 m_34__17309904__8627276 [0,1,0,1,0,0|2,0,0]=4 3699 B13R1.1887 CCCC=CCN1CCCCCC1 m_2230__678972__22993520 [0,1,0,1,0,0|2,0,0]=4 3700 B13R1.1887 CCCCCCN1CCC=CCC1 m_2230__22406010__5530588 [0,1,0,1,0,0|1,0,0]=3 3701 B13R1.1887 CCCCCNC1CCC=CCC1 m_207__109488__17656400 [0,1,0,1,0,0|1,0,0]=3 3702 B13R1.1887 CCCCSCC1CCC=CCC1 m_62__875776__13460552 [0,1,0,1,0,0|1,0,0]=3 3703 B13R1.1887 CCCOCCN1CCC=CCC1 m_2230__22406010__15503596 [0,1,0,1,0,0|2,0,0]=4 3704 B13R1.1887 CCOCCCN1CCC=CCC1 m_2230__22406010__5730886 [0,1,0,1,0,0|2,0,0]=4 3705 B13R1.1887 CCOCCNC1CCC=CCC1 m_207__872232__17656400 [0,1,0,1,0,0|2,0,0]=4 3706 B13R1.1887 CCON=CCC1CCCCCC1 m_4__158181__9736608 [0,1,0,1,0,0|2,0,0]=4 3707 B13R1.1887 CCSCCCN1CCC=CCC1 m_2230__22406010__6165712 [0,1,0,1,0,0|2,0,0]=4 3708 B13R1.1887 CCSCCNC1CCC=CCC1 m_207__13975948__17656400 [0,1,0,1,0,0|2,0,0]=4 3709 B13R1.1887 CNCCCNC1CCC=CCC1 m_272690__11349204__17656416 [0,1,0,1,0,0|2,0,0]=4 3710 B13R1.1887 CNCCSCC1CCC=CCC1 m_7__22986920__13460544 [0,1,0,1,0,0|2,0,0]=4 3711 B13R1.1887 COCCCCN1CCC=CCC1 m_2230__22406010__5062388 [0,1,0,1,0,0|2,0,0]=4 3712 B13R1.1887 COCCCNC1CCC=CCC1 m_207__109474__17656400 [0,1,0,1,0,0|2,0,0]=4 3713 B13R1.1887 COCCNCC1CCCCCC1 m_207__109486__6005054 [0,1,0,1,0,0|1,0,1]=4 3714 B13R1.1887 COCCSCC1CCC=CCC1 m_62__524272__13460552 [0,1,0,1,0,0|2,0,0]=4 3715 B13R1.1887 COCCSCC1CCCCCC1 m_62__524272__8761748 [0,1,0,1,0,0|1,0,1]=4 3716 B13R1.1887 COCSCCC1CCCCCC1 m_7__22987866__6762 [0,1,0,1,0,0|1,0,1]=4 3717 B13R1.1887 CSCCCNC1CCC=CCC1 m_207__5135872__17656400 [0,1,0,1,0,0|2,0,0]=4 3718 B13R1.1887 CSCCSCC1CCC=CCC1 m_62__13460550__8268572 [0,1,0,1,0,0|2,0,0]=4 3719 B13R1.1887 ClCCCCCN1CCC=CCC1 m_270004__24150684__24721510 [0,1,0,1,0,0|2,0,0]=4 3720 B13R1.1887 ClCCCCNC1CCC=CCC1 m_270004__13040102__24721168 [0,1,0,1,0,0|2,0,0]=4 3721 B13R1.1887 FCCCCCN1CCC=CCC1 m_2230__22406010__9984638 [0,1,0,1,0,0|2,0,0]=4 3722 B13R1.1887 FCCCCNC1CCC=CCC1 m_207__10390152__17656400 [0,1,0,1,0,0|2,0,0]=4 3723 B13R1.1887 N#CC=CCSC1CCCCCC1 m_7__17653480__7140602 [0,1,0,1,0,0|1,0,1]=4 3724 B13R1.1887 NC/C=C\CNC1CCCCCC1 m_272690__21478164__11345950 [0,1,0,1,0,0|1,0,0]=3 3725 B13R1.1887 NCCCCCN1CCC=CCC1 m_269982__22514450__22485950 [0,1,0,1,0,0|2,0,0]=4 3726 B13R1.1887 NCCCCNC1CCC=CCC1 m_272690__11349314__17656416 [0,1,0,1,0,0|2,0,0]=4 3727 B13R1.1887 NCCCSCC1CCC=CCC1 m_7__20871288__13460544 [0,1,0,1,0,0|2,0,0]=4 3728 B13R1.1887 OCC#CCSC1CCCCCC1 m_7__17653480__15141006 [0,1,0,1,0,0|0,0,2]=4 3729 B13R1.1887 OCC=CCNC1CCC=CCC1 m_207__11971532__17656400 [0,1,0,1,0,0|0,0,2]=4 3730 B13R1.1887 OCC=CCNC1CCCCCC1 m_207__11971532__121595 [0,1,0,1,0,0|0,0,0]=2 3731 B13R1.1887 OCC=CCNC1CCCOCC1 m_270004__11971554__8798398 [0,1,0,1,0,0|1,0,0]=3 3732 B13R1.1887 OCC=CCNC1CCCSCC1 m_270004__11971554__11947010 [0,1,0,1,0,0|1,0,0]=3 3733 B13R1.1887 OCC=CCNC1COCCOC1 m_270004__11971554__13287008 [0,1,0,1,0,0|2,0,0]=4 3734 B13R1.1887 OCC=CCNC1CSCCSC1 m_270004__11971554__24722590 [0,1,0,1,0,0|2,0,0]=4 3735 B13R1.1887 OCC=CCSC1CCCCCC1 m_7__17653480__16809272 [0,1,0,1,0,0|0,0,0]=2 3736 B13R1.1887 OCC=CCSC1CCCNCC1 m_7__22988076__16809272 [0,1,0,1,0,0|1,0,0]=3 3737 B13R1.1887 OCCCCCN1CCC=CCC1 m_2230__22406010__6079162 [0,1,0,1,0,0|2,0,0]=4 3738 B13R1.1887 OCCCCCN1CCCCCC1 m_2230__678972__6079162 [0,1,0,1,0,0|0,0,2]=4 3739 B13R1.1887 OCCCCNC1CCC=CCC1 m_207__9433150__17656400 [0,1,0,1,0,0|2,0,0]=4 3740 B13R1.1887 OCCCCNC1CCCCCC1 m_207__9433150__121595 [0,1,0,1,0,0|0,0,2]=4 3741 B13R1.1887 OCCCCSC1CCCCCC1 m_7__17653480__3191338 [0,1,0,1,0,0|0,0,2]=4 3742 B13R1.1887 OCCCNCC1CCCCCC1 m_207__109475__6005054 [0,1,0,1,0,0|0,0,2]=4 3743 B13R1.1887 OCCCSCC1CCC=CCC1 m_7__10972294__13460544 [0,1,0,1,0,0|2,0,0]=4 3744 B13R1.1887 OCCCSCC1CCCCCC1 m_7__18682412__6354 [0,1,0,1,0,0|0,0,2]=4 3745 B13R1.1887 OCCNCCC1CCCCCC1 m_270004__8349608__9736042 [0,1,0,1,0,0|0,0,2]=4 3746 B13R1.1887 OCCOCCN1CCCCCC1 m_2230__678972__11974698 [0,1,0,1,0,0|1,0,1]=4 3747 B13R1.1887 OCCSCCC1CCCCCC1 m_7__22987866__102708 [0,1,0,1,0,0|0,0,2]=4 3748 B13R1.24 CC(CNCCO)C1CCCCC1 m_270004__8349608__10542782 [0,1,0,1,0,0|1,0,1]=4 3749 B13R1.24 CC(CSCCO)C1CCCCC1 m_62__10545004__10178562 [0,1,0,1,0,0|1,0,1]=4 3750 B13R1.24 CCCCCC(=O)N1CC=CCO1 m_22__21005142__294124 [0,1,0,1,0,0|1,0,1]=4 3751 B13R1.24 CCCCNC(=O)C1CC=CCO1 m_527__154443__13948616 [0,1,0,1,0,0|1,0,1]=4 3752 B13R1.24 CCCCOC(=O)C1CC=CCO1 m_276436__14076536__14110038 [0,1,0,1,0,0|1,0,1]=4 3753 B13R1.24 CN(CC=CCO)C1CCCCC1 m_2230__678724__16809276 [0,1,0,1,0,0|1,0,0]=3 3754 B13R1.24 CN(CC=CCO)C1CCCNC1 m_269982__13764260__16809282 [0,1,0,1,0,0|2,0,0]=4 3755 B13R1.24 CN(CC=CCO)C1CCCOC1 m_2230__10122300__16809276 [0,1,0,1,0,0|2,0,0]=4 3756 B13R1.24 CN(CC=CCO)C1CCNCC1 m_269982__7368774__16809282 [0,1,0,1,0,0|2,0,0]=4 3757 B13R1.24 CN(CC=CCO)C1CCOCC1 m_2230__13612652__16809276 [0,1,0,1,0,0|2,0,0]=4 3758 B13R1.24 CN(CC=CCO)C1CCSCC1 m_2230__14592456__16809276 [0,1,0,1,0,0|2,0,0]=4 3759 B13R1.48 CC(NC/C=C\CN)C1CCCC1 m_272690__21478164__11346748 [0,1,0,1,0,0|2,0,0]=4 3760 B13R1.48 CC(NCC=CCO)C1CCCC1 m_2230__24567160__16809276 [0,1,0,1,0,0|1,0,0]=3 3761 B13R1.48 CC(NCC=CCO)C1CCCO1 m_2230__8740286__16809276 [0,1,0,1,0,0|2,0,0]=4 3762 B13R1.48 CC(NCC=CCO)C1CCCS1 m_270004__11971554__24722780 [0,1,0,1,0,0|2,0,0]=4 3763 B13R1.48 CC(NCC=CCO)C1CCNC1 m_269982__22505398__16809282 [0,1,0,1,0,0|2,0,0]=4 3764 B13R1.48 CC(NCC=CCO)C1CCOC1 m_270004__11971554__9608772 [0,1,0,1,0,0|2,0,0]=4 3765 B13R1.48 CC(NCC=CCO)[C@@H]1CCCN1 m_269982__22505388__16809282 [0,1,0,1,0,0|2,0,0]=4 3766 B13R1.48 CC(NCC=CCO)[C@H]1CCCO1 m_270004__11971554__15703616 [0,1,0,1,0,0|2,0,0]=4 3767 B13R1.48 CCC=CCCN(C)C1CCCC1 m_2230__774386__8859726 [0,1,0,1,0,0|2,0,0]=4 3768 B13R1.48 CCC=CCNC(C)C1CCCC1 m_269862__17312576__7201132 [0,1,0,1,0,0|2,0,0]=4 3769 B13R1.48 O=C(NCC=CCO)C1CCCC1 m_527__11971536__156231 [0,1,0,1,0,0|1,0,1]=4 3770 B13R1.48 O=C(OCC=CCO)C1CCCC1 m_1458__473282__16809274 [0,1,0,1,0,0|1,0,1]=4 3771 B13R1.156 CC(CNCCO)CC1CCCC1 m_270004__8349608__24715054 [0,1,0,1,0,0|1,0,1]=4 3772 B13R1.156 CCCCCC(C)NC1C=CCC1 m_269862__11972752__7200472 [0,1,0,1,0,0|2,0,0]=4 3773 B13R1.156 CCCCCC(C)N[C@H]1C=CCC1 m_270004__24793796__8844946 [0,1,0,1,0,0|2,0,0]=4 3774 B13R1.156 CCCCCN(C)CC1C=CCC1 m_2230__22407254__14322924 [0,1,0,1,0,0|2,0,0]=4 3775 B13R1.156 CCCCNC(C)CC1C=CCC1 m_270004__8289202__14159882 [0,1,0,1,0,0|2,0,0]=4 3776 B13R1.156 CN(C/C=C/CN)CC1CCCC1 m_269982__7371974__22485940 [0,1,0,1,0,0|2,0,0]=4 3777 B13R1.156 CN(CC=CCO)CC1CCCC1 m_2230__2263906__16809276 [0,1,0,1,0,0|1,0,0]=3 3778 B13R1.156 CN(CC=CCO)CC1CCCN1 m_269982__15779686__16809282 [0,1,0,1,0,0|2,0,0]=4 3779 B13R1.156 CN(CC=CCO)CC1CCCS1 m_2230__17653682__16809276 [0,1,0,1,0,0|2,0,0]=4 3780 B13R1.156 CN(CC=CCO)CC1CCOC1 m_2230__6582616__16809276 [0,1,0,1,0,0|2,0,0]=4 3781 B13R1.156 CN(CC=CCO)C[C@@H]1CCCO1 m_2230__8963526__16809276 [0,1,0,1,0,0|2,0,0]=4 3782 B13R1.156 CN(CC=CCO)C[C@H]1CCNC1 m_269982__22504882__16809282 [0,1,0,1,0,0|2,0,0]=4 3783 B13R1.156 OCCNCC(O)CC1CCCC1 m_273610__11554104__11516290 [0,1,0,1,0,0|1,0,1]=4 3784 B13R1.189 CCC1CC(CO1)NCC=CCO m_270004__11971554__12059364 [0,1,0,1,0,0|2,0,0]=4 3785 B13R1.189 CCC1CCC(C1)NC/C=C\CN m_272690__21478164__11346476 [0,1,0,1,0,0|2,0,0]=4 3786 B13R1.189 CCC1CCC(C1)NCC=CCO m_270004__11971554__8157362 [0,1,0,1,0,0|1,0,0]=3 3787 B13R1.189 CCC=CCCN1CCC(C1)CC m_2230__6954978__8859726 [0,1,0,1,0,0|2,0,0]=4 3788 B13R1.189 CCC=CCNC1CCC(C1)CC m_207__17312546__5575402 [0,1,0,1,0,0|2,0,0]=4 3789 B13R1.189 CCCCCCN1C=C(C=N1)CO m_34__12129404__9139750 [0,1,0,1,0,0|2,0,0]=4 3790 B13R1.189 CSC1CCC(C1)NCC=CCO m_270004__11971554__15266872 [0,1,0,1,0,0|2,0,0]=4 3791 B13R1.189 OCC=CCNC1CCC(C1)CO m_270004__11971554__24722568 [0,1,0,1,0,0|2,0,0]=4 3792 B13R1.556 CCC1CCC(CC1NCCO)C m_270004__8349608__24722456 [0,1,0,1,0,0|1,0,1]=4 3793 B13R1.666 CCC1CCCC(C1)CNCCO m_207__121484__8694860 [0,1,0,1,0,0|1,0,1]=4 3794 B13R1.666 CCC1CCCN(C1)C/C=C/CN m_269982__7371010__22485940 [0,1,0,1,0,0|2,0,0]=4 3795 B13R1.666 CCC1CCCN(C1)CC=CCO m_2230__678580__16809276 [0,1,0,1,0,0|1,0,0]=3 3796 B13R1.666 CCC1CN(CCN1)CC=CCO m_269982__16886878__16809282 [0,1,0,1,0,0|2,0,0]=4 3797 B13R1.666 CCC1CN(CCO1)CC=CCO m_2230__702680__16809276 [0,1,0,1,0,0|2,0,0]=4 3798 B13R1.666 CCC1CN(CCS1)CC=CCO m_2230__6287584__16809276 [0,1,0,1,0,0|2,0,0]=4 3799 B13R1.666 CNC1CCCN(C1)CC=CCO m_269982__7368798__16809282 [0,1,0,1,0,0|2,0,0]=4 3800 B13R1.666 COC1CCCN(C1)CC=CCO m_2230__7974910__16809276 [0,1,0,1,0,0|2,0,0]=4 3801 B13R1.666 NCC1CCCN(C1)CC=CCO m_269982__7368786__16809282 [0,1,0,1,0,0|2,0,0]=4 3802 B13R1.666 OCC=CCN1CCCC(C1)CF m_2230__12896608__16809276 [0,1,0,1,0,0|2,0,0]=4 3803 B13R1.666 OCC=CCN1CCCC(C1)CO m_2230__678750__16809276 [0,1,0,1,0,0|2,0,0]=4 3804 B13R1.725 CC1CCCC1N(C)CC=CCO m_2230__22409488__16809276 [0,1,0,1,0,0|1,0,0]=3 3805 B13R1.725 CN(CC=CCO)[C@@H]1CCC[C@H]1O m_2230__13027130__16809276 [0,1,0,1,0,0|2,0,0]=4 3806 B13R1.726 COC1CCC1N(C)CC=CCO m_2230__13429728__16809276 [0,1,0,1,0,0|2,0,0]=4 3807 B13R1.728 CN(CC=CCO)CCC1CNC1 m_269982__22504906__16809282 [0,1,0,1,0,0|2,0,0]=4 3808 B13R1.729 CN(CC=CCO)CCOC1CC1 m_2230__14597450__16809276 [0,1,0,1,0,0|2,0,0]=4 3809 B13R1.1148 CC1CCCCN(C1)C/C=C/CN m_269982__10882202__22485940 [0,1,0,1,0,0|2,0,0]=4 3810 B13R1.1148 CC1CCCCN(C1)CC=CCO m_2230__8964262__16809276 [0,1,0,1,0,0|1,0,0]=3 3811 B13R1.1148 CC1CN(CCCN1)CC=CCO m_269982__22504972__16809282 [0,1,0,1,0,0|2,0,0]=4 3812 B13R1.1148 CC1CN(CCCO1)CC=CCO m_2230__3001124__16809276 [0,1,0,1,0,0|2,0,0]=4 3813 B13R1.1148 CC1CNCCN(C1)CC=CCO m_269982__22599508__16809282 [0,1,0,1,0,0|2,0,0]=4 3814 B13R1.1148 CC1COCCN(C1)CC=CCO m_2230__13161110__16809276 [0,1,0,1,0,0|2,0,0]=4 3815 B13R1.1148 CC1CSCCN(C1)CC=CCO m_2230__9293708__16809276 [0,1,0,1,0,0|2,0,0]=4 3816 B13R1.1148 NC/C=C/CN1CCCCC(C1)N m_269982__15734008__22485940 [0,1,0,1,0,0|2,0,0]=4 3817 B13R1.1148 NC/C=C/CN1CCCCC(C1)O m_269982__22516904__22485940 [0,1,0,1,0,0|2,0,0]=4 3818 B13R1.1148 NC1CCCCN(C1)CC=CCO m_269982__15734008__16809282 [0,1,0,1,0,0|1,0,0]=3 3819 B13R1.1148 OCC=CCN1CCNCC(C1)O m_269982__13586758__16809282 [0,1,0,1,0,0|2,0,0]=4 3820 B13R1.1148 OCC=CCN1CCOCC(C1)F m_2230__20275084__16809276 [0,1,0,1,0,0|2,0,0]=4 3821 B13R1.1148 OCC=CCN1CCOCC(C1)O m_2230__14795914__16809276 [0,1,0,1,0,0|2,0,0]=4 3822 B13R1.1156 CCCCCC1CC(C1)NCCO m_269862__7193048__16976464 [0,1,0,1,0,0|1,0,1]=4 3823 B13R1.2457 CC1CCCCC1(O)CNCCO m_273610__11554104__20064460 [0,1,0,1,0,0|1,0,1]=4 3824 B13R1.2457 CC1CCCCC1(O)CSCCO m_7__128807__22788580 [0,1,0,1,0,0|1,0,1]=4 3825 B13R1.2465 CC1(CCCCCC1)CNCCO m_270004__8349608__8601266 [0,1,0,1,0,0|1,0,1]=4 3826 B13R1.2465 OCCSCC1(CCCCCC1)O m_7__128807__22788508 [0,1,0,1,0,0|1,0,1]=4 3827 B13R1.2914 CC[C@@H]1C[C@H]1C(=O)NCC=CCO m_527__11971536__16716088 [0,1,0,1,0,0|1,0,1]=4 3828 B13R1.2914 CC[C@@H]1C[C@H]1C(=O)OCC=CCO m_1458__16716090__16809274 [0,1,0,1,0,0|1,0,1]=4 3829 B13R1.2914 CC[C@H]1C[C@@H]1C(=O)NCC=CCO m_527__11971536__10743056 [0,1,0,1,0,0|1,0,1]=4 3830 B13R1.2914 CC[C@H]1C[C@@H]1C(=O)OCC=CCO m_1458__10743062__16809274 [0,1,0,1,0,0|1,0,1]=4 3831 B13R1.2915 CC1CC1CC(=O)NCC=CCO m_527__11971536__10301896 [0,1,0,1,0,0|1,0,1]=4 3832 B13R1.2915 CC1CC1CC(=O)OCC=CCO m_1458__10301902__16809274 [0,1,0,1,0,0|1,0,1]=4 3833 B13R1.2915 CCC=CCCC(C)N[C@@H]1C[C@H]1C m_269862__12364724__17320678 [0,1,0,1,0,0|2,0,0]=4 3834 B13R1.2915 CCC=CCCN(C)CC1CC1C m_2230__16620044__8859726 [0,1,0,1,0,0|2,0,0]=4 3835 B13R1.2916 CC(CC1CCC1)NC/C=C\CN m_272690__21478164__11347158 [0,1,0,1,0,0|2,0,0]=4 3836 B13R1.2916 CC(CC1CCC1)NCC=CCO m_270004__11971554__8845100 [0,1,0,1,0,0|1,0,0]=3 3837 B13R1.2916 CC(CC1CNC1)NCC=CCO m_269982__22505360__16809282 [0,1,0,1,0,0|2,0,0]=4 3838 B13R1.2916 CCC=CCCC(C)NC1CCC1 m_269862__10892244__17320678 [0,1,0,1,0,0|2,0,0]=4 3839 B13R1.2916 CCC=CCCN(C)CC1CCC1 m_2230__4603152__8859726 [0,1,0,1,0,0|2,0,0]=4 3840 B13R1.2916 CCC=CCNC(C)CC1CCC1 m_269862__17312576__7201654 [0,1,0,1,0,0|2,0,0]=4 3841 B13R1.2916 O=C(CC1CCC1)NCC=CCO m_527__11971536__6200666 [0,1,0,1,0,0|1,0,1]=4 3842 B13R1.2916 O=C(CC1CCC1)OCC=CCO m_1458__6200672__16809274 [0,1,0,1,0,0|1,0,1]=4 3843 B13R1.2917 CC(CCC1CC1)NC/C=C\CN m_272690__21478164__11348324 [0,1,0,1,0,0|2,0,0]=4 3844 B13R1.2917 CC(CCC1CC1)NCC=CCO m_270004__11971554__8901782 [0,1,0,1,0,0|1,0,0]=3 3845 B13R1.2917 CCC=CCCC(C)NCC1CC1 m_270004__8289750__17320680 [0,1,0,1,0,0|2,0,0]=4 3846 B13R1.2917 CCC=CCCN(C)CCC1CC1 m_2230__7633868__8859726 [0,1,0,1,0,0|2,0,0]=4 3847 B13R1.2917 CCC=CCNC(C)CCC1CC1 m_269862__17312576__8901780 [0,1,0,1,0,0|2,0,0]=4 3848 B13R1.2917 O=C(CCC1CC1)NCC=CCO m_527__11971536__4970172 [0,1,0,1,0,0|1,0,1]=4 3849 B13R1.2917 O=C(CCC1CC1)OCC=CCO m_1458__4970176__16809274 [0,1,0,1,0,0|1,0,1]=4 3850 B13R1.2918 CC1CCC1C(=O)NCC=CCO m_22__11971526__20826640 [0,1,0,1,0,0|1,0,1]=4 3851 B13R1.2918 C[C@H]1CC[C@@H]1C(=O)NCC=CCO m_22__11971526__24594086 [0,1,0,1,0,0|1,0,1]=4 3852 B13R1.2923 CC[C@@H]1CC[C@@H](N1CC=CCO)C m_2230__18628608__16809276 [0,1,0,1,0,0|1,0,0]=3 3853 B13R1.2923 C[C@H]1CC[C@H](N1CC=CCO)CO m_2230__12910002__16809276 [0,1,0,1,0,0|2,0,0]=4 3854 B13R1.3674 CC1(CC=CCO1)CNCCCF m_270004__17065596__24710792 [0,1,0,1,0,0|2,0,0]=4 3855 B13R1.3674 CC1(CC=CCO1)CNCCCO m_270004__8288584__24710792 [0,1,0,1,0,0|2,0,0]=4 3856 B13R1.3674 CC1(CCCCC1)NCC=CCO m_2230__22397374__16809276 [0,1,0,1,0,0|1,0,0]=3 3857 B13R1.3674 CC1(CCCNC1)NCC=CCO m_269982__22505410__16809282 [0,1,0,1,0,0|2,0,0]=4 3858 B13R1.3674 CC1(CCCOC1)NCC=CCO m_2230__22404548__16809276 [0,1,0,1,0,0|2,0,0]=4 3859 B13R1.3674 CC1(CCNCC1)NCC=CCO m_269982__22505468__16809282 [0,1,0,1,0,0|2,0,0]=4 3860 B13R1.3674 CC1(CCOCC1)NCC=CCO m_2230__22397534__16809276 [0,1,0,1,0,0|2,0,0]=4 3861 B13R1.3674 CC1(CCSCC1)NCC=CCO m_2230__22397090__16809276 [0,1,0,1,0,0|2,0,0]=4 3862 B13R1.3674 CCCCCNC1(CC=CCC1)C m_2230__22399114__5063396 [0,1,0,1,0,0|2,0,0]=4 3863 B13R1.3674 CCCCNCC1(CC=CCO1)C m_270004__8289202__24710792 [0,1,0,1,0,0|1,0,0]=3 3864 B13R1.3674 COCCNCC1(CC=CCO1)C m_270004__8288600__24710792 [0,1,0,1,0,0|2,0,0]=4 3865 B13R1.3674 CSCCNCC1(CC=CCO1)C m_270004__11963796__24710792 [0,1,0,1,0,0|2,0,0]=4 3866 B13R1.4964 CC1(CCCC1O)NCC=CCO m_2230__17523550__16809276 [0,1,0,1,0,0|2,0,0]=4 3867 B13R1.4964 CC1CCCC1(C)NCC=CCO m_2230__22403824__16809276 [0,1,0,1,0,0|1,0,0]=3 3868 B13R1.4964 CC1OCCC1(C)NCC=CCO m_2230__9296262__16809276 [0,1,0,1,0,0|2,0,0]=4 3869 B13R1.8919 CC1CCCC(N1CC=CCO)C m_2230__4351604__16809276 [0,1,0,1,0,0|1,0,0]=3 3870 B13R1.8919 CC1COCC(N1CC=CCO)C m_2230__12911698__16809276 [0,1,0,1,0,0|2,0,0]=4 3871 B13R1.8919 CC1CSCC(N1CC=CCO)C m_2230__22407894__16809276 [0,1,0,1,0,0|2,0,0]=4 3872 B13R1.27 CC/C=C\CCCN1CCC(C1)C m_270004__8137774__24594278 [0,1,0,1,0,0|2,0,0]=4 3873 B13R1.27 CC/C=C\CCCN1CC[C@@H](C1)O m_270004__8131000__24594278 [0,1,0,1,0,0|2,0,0]=4 3874 B13R1.27 CC/C=C\CCCN1CC[C@H](C1)F m_270004__10719382__24594278 [0,1,0,1,0,0|2,0,0]=4 3875 B13R1.27 CC1CCC(C1)CSCC=CCO m_7__22987782__16809272 [0,1,0,1,0,0|1,0,0]=3 3876 B13R1.27 CCC=CCCSC1CCC(C1)C m_62__8859720__10549956 [0,1,0,1,0,0|2,0,0]=4 3877 B13R1.27 CCC=CCCSC1CCC(C1)O m_7__17795750__8859716 [0,1,0,1,0,0|2,0,0]=4 3878 B13R1.44 CC(CC1CCCCC1)NCCO m_207__121484__14027842 [0,1,0,1,0,0|1,0,1]=4 3879 B13R1.44 CCCCC(C)CN1CC=CCC1 m_2230__8375936__22993834 [0,1,0,1,0,0|2,0,0]=4 3880 B13R1.44 CCCCC(C)NC1CC=CCC1 m_269862__8258698__7200136 [0,1,0,1,0,0|2,0,0]=4 3881 B13R1.44 CCCCC(C)N[C@H]1CC=CCC1 m_269862__17838454__7200136 [0,1,0,1,0,0|2,0,0]=4 3882 B13R1.44 CCCCC(O)CN1CC=CCC1 m_2230__8375936__14593732 [0,1,0,1,0,0|2,0,0]=4 3883 B13R1.44 CCCCN(C)CC1CC=CCC1 m_270004__8127976__8127716 [0,1,0,1,0,0|2,0,0]=4 3884 B13R1.44 CCCCN(C)C[C@@H]1CC=CCC1 m_2230__665312__23045126 [0,1,0,1,0,0|2,0,0]=4 3885 B13R1.44 C[C@H](CC1CCCCC1)NCCO m_2230__22399864__6165700 [0,1,0,1,0,0|1,0,1]=4 3886 B13R1.44 O=C(C=CCO)NC1CCCCC1 m_22__374718__13570734 [0,1,0,1,0,0|1,0,1]=4 3887 B13R1.73 CCC1CC(CCC1NCCO)C m_270004__8349608__24722368 [0,1,0,1,0,0|1,0,1]=4 3888 B13R1.153 CC(CCC1CCCC1)NCCO m_2230__22400878__6165700 [0,1,0,1,0,0|1,0,1]=4 3889 B13R1.153 CCCCC(C)CN[C@H]1C=CCC1 m_270004__24793796__24715008 [0,1,0,1,0,0|2,0,0]=4 3890 B13R1.153 CCCCC(C)NCC1C=CCC1 m_2230__22399858__14322924 [0,1,0,1,0,0|2,0,0]=4 3891 B13R1.153 CCCCC(C)NCC1C=CCN1 m_272690__18688988__11345926 [0,1,0,1,0,0|2,0,0]=4 3892 B13R1.153 CCCCN(C)CCC1C=CCC1 m_270004__8127976__24714984 [0,1,0,1,0,0|2,0,0]=4 3893 B13R1.153 O=C(C=CCO)NCC1CCCC1 m_22__587016__13570734 [0,1,0,1,0,0|1,0,1]=4 3894 B13R1.656 CC1CCC(=O)CN1CC=CCO m_2230__13225824__16809276 [0,1,0,1,0,0|1,0,1]=4 3895 B13R1.656 CC1CCC(CN1CC=CCO)O m_2230__11353782__16809276 [0,1,0,1,0,0|1,0,0]=3 3896 B13R1.656 CC1CCC(N(C1)CC=CCO)C m_2230__6362936__16809276 [0,1,0,1,0,0|1,0,0]=3 3897 B13R1.656 C[C@@H]1CC[C@H](CN1CC=CCO)O m_2230__9581864__16809276 [0,1,0,1,0,0|1,0,0]=3 3898 B13R1.656 C[C@@H]1CN([C@H](CN1)C)CC=CCO m_269982__23860934__16809282 [0,1,0,1,0,0|2,0,0]=4 3899 B13R1.656 C[C@H]1CC[C@@H](CN1CC=CCO)O m_2230__11621032__16809276 [0,1,0,1,0,0|1,0,0]=3 3900 B13R1.656 C[C@H]1CC[C@@H](N(C1)CC=CCO)C m_2230__13944542__16809276 [0,1,0,1,0,0|1,0,0]=3 3901 B13R1.656 C[C@H]1CN([C@H](CO1)C)CC=CCO m_2230__22407874__16809276 [0,1,0,1,0,0|2,0,0]=4 3902 B13R1.660 CCC1CC(CN1CC=CCO)C m_2230__24550682__16809276 [0,1,0,1,0,0|1,0,0]=3 3903 B13R1.660 NC[C@@H]1C[C@@H](CN1CC=CCO)O m_269982__21847670__16809282 [0,1,0,1,0,0|2,0,0]=4 3904 B13R1.660 OCC=CCN1C[C@H](C[C@H]1CO)F m_2230__10058990__16809276 [0,1,0,1,0,0|2,0,0]=4 3905 B13R1.660 OCC=CCN1C[C@H](C[C@H]1CO)O m_2230__8976674__16809276 [0,1,0,1,0,0|2,0,0]=4 3906 B13R1.674 CC1CCCCN1C(=O)C=CCO m_22__58071__13570734 [0,1,0,1,0,0|1,0,1]=4 3907 B13R1.674 C[C@H]1CCCCN1C(=O)C=CCO m_22__24029706__13570734 [0,1,0,1,0,0|1,0,1]=4 3908 B13R1.675 CC[C@H]1C[C@@H]1CNC(=O)C=CCO m_22__10740846__13570734 [0,1,0,1,0,0|1,0,1]=4 3909 B13R1.676 O=C(C=CCO)NCCCC1CC1 m_22__11760166__13570734 [0,1,0,1,0,0|1,0,1]=4 3910 B13R1.677 CC1CCC1CNC(=O)C=CCO m_22__22618710__13570734 [0,1,0,1,0,0|1,0,1]=4 3911 B13R1.677 C[C@H]1CC[C@H]1CNC(=O)C=CCO m_22__21813106__13570734 [0,1,0,1,0,0|1,0,1]=4 3912 B13R1.683 O=C(C=CCO)NCCC1CCC1 m_22__6955686__13570734 [0,1,0,1,0,0|1,0,1]=4 3913 B13R1.684 CCC1CCCN1C(=O)C=CCO m_22__4599910__13570734 [0,1,0,1,0,0|1,0,1]=4 3914 B13R1.684 CC[C@@H]1CCCN1C(=O)C=CCO m_22__24630048__13570734 [0,1,0,1,0,0|1,0,1]=4 3915 B13R1.686 CC1CCCC1NC(=O)C=CCO m_22__3490462__13570734 [0,1,0,1,0,0|1,0,1]=4 3916 B13R1.686 C[C@H]1CCC[C@H]1NC(=O)C=CCO m_22__20901866__13570734 [0,1,0,1,0,0|1,0,1]=4 3917 B13R1.1133 CC1CCC(C1NCC=CCO)C m_2230__24397098__16809276 [0,1,0,1,0,0|1,0,0]=3 3918 B13R1.1133 CCC=CCCN1C(CCC1C)C m_2230__7045078__8859726 [0,1,0,1,0,0|2,0,0]=4 3919 B13R1.1133 CCC=CCNC1C(CCC1C)C m_269862__17312576__11349608 [0,1,0,1,0,0|2,0,0]=4 3920 B13R1.2436 CC1(CCOC1)CSCC=CCO m_7__22986858__16809272 [0,1,0,1,0,0|2,0,0]=4 3921 B13R1.2436 CCC=CCCNC1(CCCC1)C m_2230__22397380__8859726 [0,1,0,1,0,0|2,0,0]=4 3922 B13R1.2436 CCC=CCNCC1(CCCC1)O m_273610__17312600__11516236 [0,1,0,1,0,0|2,0,0]=4 3923 B13R1.2436 OCC=CCNCC1(CCCC1)O m_273610__13857830__11516236 [0,1,0,1,0,0|1,0,0]=3 3924 B13R1.2439 CC/C=C\CCCN1CC(C1)CC m_270004__10893736__24594278 [0,1,0,1,0,0|2,0,0]=4 3925 B13R1.2488 CC(NCCO)C1CCCCCC1 m_269862__7193048__8698554 [0,1,0,1,0,0|1,0,1]=4 3926 B13R1.2488 C[C@H](NCCO)C1CCCCCC1 m_2230__8749752__6165700 [0,1,0,1,0,0|1,0,1]=4 3927 B13R1.2488 O=C(C=CCO)N1CCCCCC1 m_22__57673__13570734 [0,1,0,1,0,0|1,0,1]=4 3928 B13R1.3572 CC/C=C\CCCN(C)C1CCC1 m_270004__8138430__24594278 [0,1,0,1,0,0|2,0,0]=4 3929 B13R1.3572 CCC=CCCNC(C)C1CCC1 m_2230__22399912__8859726 [0,1,0,1,0,0|2,0,0]=4 3930 B13R1.3572 CCC=CCNCC(O)C1CCC1 m_273610__17312600__14523626 [0,1,0,1,0,0|2,0,0]=4 3931 B13R1.3572 OCC=CCNCC(O)C1CCC1 m_273610__13857830__14523626 [0,1,0,1,0,0|1,0,0]=3 3932 B13R1.3574 CC/C=C\CCCN(C)CC1CC1 m_270004__8133270__24594278 [0,1,0,1,0,0|2,0,0]=4 3933 B13R1.3574 CCC=CCCNC(C)CC1CC1 m_2230__22397024__8859726 [0,1,0,1,0,0|2,0,0]=4 3934 B13R1.3580 CC1CC1CCNC(=O)C=CCO m_22__20616642__13570734 [0,1,0,1,0,0|1,0,1]=4 3935 B13R1.3581 CCC[C@H]1C[C@@H]1NC(=O)C=CCO m_22__13712002__13570734 [0,1,0,1,0,0|1,0,1]=4 3936 B13R1.3910 CCCC1C(CCCN1CCO)C m_2230__7463380__6165700 [0,1,0,1,0,0|1,0,1]=4 3937 B13R1.6366 CC/C=C\CCCN(C)C1CC1C m_270004__16770478__24594278 [0,1,0,1,0,0|2,0,0]=4 3938 B13R1.6366 CC/C=C\CCCN(C)[C@@H]1C[C@H]1C m_270004__22537872__24594278 [0,1,0,1,0,0|2,0,0]=4 3939 B13R1.90 CCC1CCCCC1NCC(C)O m_270004__8288774__24722330 [0,1,0,1,0,0|1,0,1]=4 3940 B13R1.193 CC1(CCCC1NC/C=C\CN)C m_272690__21478164__11346924 [0,1,0,1,0,0|2,0,0]=4 3941 B13R1.193 CC1(CCCC1NCC=CCO)C m_270004__11971554__8334538 [0,1,0,1,0,0|1,0,0]=3 3942 B13R1.193 CC1(CCCC1NCC=CCO)O m_2230__13973604__16809276 [0,1,0,1,0,0|1,0,0]=3 3943 B13R1.193 CC1(CNCC1NCC=CCO)C m_269982__13314946__16809282 [0,1,0,1,0,0|2,0,0]=4 3944 B13R1.193 CC1(COCC1NCC=CCO)C m_2230__10812810__16809276 [0,1,0,1,0,0|2,0,0]=4 3945 B13R1.193 CC1(NCCC1NCC=CCO)C m_269982__13074884__16809282 [0,1,0,1,0,0|2,0,0]=4 3946 B13R1.193 CC1(OCCC1NCC=CCO)C m_2230__10688090__16809276 [0,1,0,1,0,0|2,0,0]=4 3947 B13R1.193 CCC=CCCN1CCCC1(C)C m_2230__5789082__8859726 [0,1,0,1,0,0|2,0,0]=4 3948 B13R1.193 CCC=CCNC1CCCC1(C)C m_269862__17312576__7201352 [0,1,0,1,0,0|2,0,0]=4 3949 B13R1.193 CCCCCCN1CC=CC1(C)C m_270004__24170150__24715030 [0,1,0,1,0,0|2,0,0]=4 3950 B13R1.198 CC(O)CNCCCCC1CC1C m_270004__8288774__24715066 [0,1,0,1,0,0|1,0,1]=4 3951 B13R1.283 CC(O)CN1CCCCCCC1C m_2230__16908182__9736146 [0,1,0,1,0,0|1,0,1]=4 3952 B13R1.337 CC(C)CCCCN1CC=CCC1 m_2230__8375936__22384278 [0,1,0,1,0,0|2,0,0]=4 3953 B13R1.337 CC(C)CCCNC1CC=CCC1 m_207__5137566__7912414 [0,1,0,1,0,0|2,0,0]=4 3954 B13R1.337 CC(C)CCNCC1CC=CCC1 m_207__2054746__134014 [0,1,0,1,0,0|2,0,0]=4 3955 B13R1.337 CC(C)CCNCC1CC=CCO1 m_207__14050636__134014 [0,1,0,1,0,0|1,0,0]=3 3956 B13R1.337 CC(C)CCSC[C@@H]1CC=CCC1 m_62__7021584__23045122 [0,1,0,1,0,0|2,0,0]=4 3957 B13R1.337 CC(C)CNCCC1CC=CCC1 m_207__12299588__121216 [0,1,0,1,0,0|2,0,0]=4 3958 B13R1.337 CC(C)NCCCC1CC=CCC1 m_270004__23845338__24594658 [0,1,0,1,0,0|2,0,0]=4 3959 B13R1.337 CC(F)CCNCC1CC=CCC1 m_207__10546022__121213 [0,1,0,1,0,0|2,0,0]=4 3960 B13R1.337 CC(F)CCSC[C@@H]1CC=CCC1 m_62__13165346__23045122 [0,1,0,1,0,0|2,0,0]=4 3961 B13R1.337 CC(N)CCSC[C@@H]1CC=CCC1 m_34__20871470__23045118 [0,1,0,1,0,0|2,0,0]=4 3962 B13R1.337 CC(O)CCNCC1CC=CCC1 m_207__4933440__121213 [0,1,0,1,0,0|2,0,0]=4 3963 B13R1.337 CC(O)CCSC[C@@H]1CC=CCC1 m_62__12057938__23045122 [0,1,0,1,0,0|2,0,0]=4 3964 B13R1.337 CC(O)CNCCC1CC=CCC1 m_273610__12299636__11516404 [0,1,0,1,0,0|2,0,0]=4 3965 B13R1.337 CC(O)CNCCC1CCCCC1 m_273610__11517976__11516404 [0,1,0,1,0,0|1,0,1]=4 3966 B13R1.337 CC(O)CSCCC1CCCCC1 m_7__10953796__21208850 [0,1,0,1,0,0|1,0,1]=4 3967 B13R1.337 O=C(O)C=CCNC1CCCCC1 m_271304__15608264__16762514 [0,1,0,1,0,0|1,0,1]=4 3968 B13R1.343 CC(C)CCCCN[C@H]1C=CCC1 m_270004__24793796__12202092 [0,1,0,1,0,0|2,0,0]=4 3969 B13R1.343 CC(C)CCCNCC1C=CCC1 m_207__12894010__7912414 [0,1,0,1,0,0|2,0,0]=4 3970 B13R1.343 CC(C)CCCSCC1C=CCC1 m_62__10892842__14322920 [0,1,0,1,0,0|2,0,0]=4 3971 B13R1.343 CC(C)CCNCCC1C=CCC1 m_270004__8288586__24714984 [0,1,0,1,0,0|2,0,0]=4 3972 B13R1.343 CC(C)CNCCCC1C=CCC1 m_207__12854898__121216 [0,1,0,1,0,0|2,0,0]=4 3973 B13R1.343 CC(F)CCNCCC1C=CCC1 m_270004__10546066__24714984 [0,1,0,1,0,0|2,0,0]=4 3974 B13R1.343 CC(O)CCNCCC1C=CCC1 m_270004__8296476__24714984 [0,1,0,1,0,0|2,0,0]=4 3975 B13R1.343 CC(O)CNCCCC1C=CCC1 m_273610__12854946__11516404 [0,1,0,1,0,0|2,0,0]=4 3976 B13R1.343 CC(O)CNCCCC1CCCC1 m_273610__11517584__11516404 [0,1,0,1,0,0|1,0,1]=4 3977 B13R1.343 CC(O)CSCCCC1CCCC1 m_7__10953796__15113686 [0,1,0,1,0,0|1,0,1]=4 3978 B13R1.380 CC(C)CC1CCCCN1CCO m_2230__7463748__6165700 [0,1,0,1,0,0|1,0,1]=4 3979 B13R1.380 CC(O)CC1CCCCN1CCO m_2230__9457328__6165700 [0,1,0,1,0,0|1,0,1]=4 3980 B13R1.380 CCCC1CCCCN1CC(C)O m_2230__8750840__9736146 [0,1,0,1,0,0|1,0,1]=4 3981 B13R1.392 CC(C)CCC1CCCN1CCO m_2230__7345378__6165700 [0,1,0,1,0,0|1,0,1]=4 3982 B13R1.392 CCCC1CCCC1NCC(C)O m_270004__8288774__24722530 [0,1,0,1,0,0|1,0,1]=4 3983 B13R1.572 CC(C)C1CCCCC1NCCO m_2230__8740352__6165700 [0,1,0,1,0,0|1,0,1]=4 3984 B13R1.578 CC(C)CC1CCCC1NCCO m_269862__7193048__13611510 [0,1,0,1,0,0|1,0,1]=4 3985 B13R1.578 CCCCC1CCCN1CC(C)O m_2230__15143778__9736146 [0,1,0,1,0,0|1,0,1]=4 3986 B13R1.610 CCC1CCCCCN1CC(C)O m_2230__5454866__9736146 [0,1,0,1,0,0|1,0,1]=4 3987 B13R1.668 CC1(CCCCC1CSCCO)C m_62__12130596__10178562 [0,1,0,1,0,0|1,0,1]=4 3988 B13R1.668 CC1(CCCCN1CC=CCO)C m_2230__14596350__16809276 [0,1,0,1,0,0|1,0,0]=3 3989 B13R1.668 CC1(CNCCN1CC=CCO)C m_269982__7368842__16809282 [0,1,0,1,0,0|2,0,0]=4 3990 B13R1.668 CC1(COCCN1CC=CCO)C m_2230__1950868__16809276 [0,1,0,1,0,0|2,0,0]=4 3991 B13R1.668 CC1(CSCCN1CC=CCO)C m_2230__9155842__16809276 [0,1,0,1,0,0|2,0,0]=4 3992 B13R1.670 CC(C)C1CCCN1CC=CCO m_2230__5826484__16809276 [0,1,0,1,0,0|1,0,0]=3 3993 B13R1.670 CC(F)C1CCCN1CC=CCO m_2230__17056172__16809276 [0,1,0,1,0,0|1,0,0]=3 3994 B13R1.670 CC(O)[C@H]1CCCN1CC=CCO m_2230__12057664__16809276 [0,1,0,1,0,0|1,0,0]=3 3995 B13R1.1022 CC(C)CNC1CCC=CCCC1 m_207__13462436__121216 [0,1,0,1,0,0|2,0,0]=4 3996 B13R1.1022 CC(C)NCC1CCC=CCCC1 m_269862__13433634__7204804 [0,1,0,1,0,0|2,0,0]=4 3997 B13R1.1022 CC(C)SCC1CCC=CCCC1 m_62__2390328__15780340 [0,1,0,1,0,0|2,0,0]=4 3998 B13R1.1022 CC(O)CNC1CCC=CCCC1 m_273610__13462476__11516404 [0,1,0,1,0,0|2,0,0]=4 3999 B13R1.1022 CC(O)CNC1CCCCCCC1 m_273610__11516478__11516404 [0,1,0,1,0,0|1,0,1]=4 4000 B13R1.1052 CC(O)CNCCCCCC1CC1 m_273610__15723044__11516404 [0,1,0,1,0,0|1,0,1]=4 4001 B13R1.1052 CC(O)CSCCCCCC1CC1 m_7__10953796__13582074 [0,1,0,1,0,0|1,0,1]=4 4002 B13R1.1107 CC(O)CN1CCCCCCCC1 m_2230__10808630__9736146 [0,1,0,1,0,0|1,0,1]=4 4003 B13R1.1586 CC1(CCCCCC1NCCO)C m_2230__18338744__6165700 [0,1,0,1,0,0|1,0,1]=4 4004 B13R1.1586 CCCNC1CCCC=CC1(F)F m_269862__7192572__15064466 [0,1,0,1,0,0|2,0,0]=4 4005 B13R1.1988 CC(C)CCCN1CCC=CCC1 m_270004__24150684__9139706 [0,1,0,1,0,0|2,0,0]=4 4006 B13R1.1988 CC(C)CCNC1CCC=CCC1 m_207__109476__17656400 [0,1,0,1,0,0|2,0,0]=4 4007 B13R1.1988 CC(C)CNCC1CCC=CCC1 m_207__13262574__121216 [0,1,0,1,0,0|2,0,0]=4 4008 B13R1.1988 CC(C)CSCC1CCC=CCC1 m_62__1010136__13460552 [0,1,0,1,0,0|2,0,0]=4 4009 B13R1.1988 CC(F)CCNC1CCC=CCC1 m_207__10546022__17656400 [0,1,0,1,0,0|2,0,0]=4 4010 B13R1.1988 CC(F)CSCC1CCC=CCC1 m_62__13460550__16913488 [0,1,0,1,0,0|2,0,0]=4 4011 B13R1.1988 CC(O)CCCN1CCC=CCC1 m_2230__22406010__9227836 [0,1,0,1,0,0|2,0,0]=4 4012 B13R1.1988 CC(O)CCNC1CCC=CCC1 m_207__4933440__17656400 [0,1,0,1,0,0|2,0,0]=4 4013 B13R1.1988 CC(O)CNCC1CCC=CCC1 m_273610__13262624__11516404 [0,1,0,1,0,0|2,0,0]=4 4014 B13R1.1988 CC(O)CNCC1CCCCCC1 m_207__109407__6005054 [0,1,0,1,0,0|1,0,1]=4 4015 B13R1.1988 CC(O)CSCC1CCC=CCC1 m_7__10953796__13460544 [0,1,0,1,0,0|2,0,0]=4 4016 B13R1.1988 CC(O)CSCC1CCCCCC1 m_7__10953796__8761742 [0,1,0,1,0,0|1,0,1]=4 4017 B13R1.1988 C[C@H](N)CCNC1CCC=CCC1 m_272690__12628774__17656416 [0,1,0,1,0,0|2,0,0]=4 4018 B13R1.1988 C[C@H](N)CSCC1CCC=CCC1 m_7__20871336__13460544 [0,1,0,1,0,0|2,0,0]=4 4019 B13R1.2852 CCCCNC1CCC1=CC(C)C m_269862__7192636__16603984 [0,1,0,1,0,0|2,0,0]=4 4020 B13R1.2852 CN(C)C[C@H]1CCN1CC=CCO m_2230__22141774__16809276 [0,1,0,1,0,0|2,0,0]=4 4021 B13R1.2970 CCC=CCCNC1CCC1(C)C m_2230__10738242__8859726 [0,1,0,1,0,0|2,0,0]=4 4022 B13R1.2970 OCC=CCSCC1CCC1(F)F m_7__22987578__16809272 [0,1,0,1,0,0|2,0,0]=4 4023 B13R1.3435 CC(C)C1CCC1NCC=CCO m_269862__11971552__10122316 [0,1,0,1,0,0|1,0,0]=3 4024 B13R1.3435 CCC=CCNC1CCC1C(C)C m_269862__17312576__10122316 [0,1,0,1,0,0|2,0,0]=4 4025 B13R1.3435 OCC=CCN[C@H]1CC[C@@H]1C(F)F m_2230__21250014__16809276 [0,1,0,1,0,0|2,0,0]=4 4026 B13R1.9 CC1CCC(CC1)CCSCCO m_62__15267988__10178562 [0,1,0,1,0,0|1,0,1]=4 4027 B13R1.9 CC1CCC(CC1)NCC=CCO m_270004__11971554__8157298 [0,1,0,1,0,0|1,0,0]=3 4028 B13R1.9 CC1CCC(CS1)NCC=CCO m_270004__11971554__11759020 [0,1,0,1,0,0|2,0,0]=4 4029 B13R1.9 CCC=CCCN1CCC(CC1)C m_2230__678746__8859726 [0,1,0,1,0,0|2,0,0]=4 4030 B13R1.9 CCC=CCCN1CCC(CC1)F m_2230__12896702__8859726 [0,1,0,1,0,0|2,0,0]=4 4031 B13R1.9 CCC=CCCN1CCC(CC1)O m_2230__679016__8859726 [0,1,0,1,0,0|2,0,0]=4 4032 B13R1.9 CCC=CCNC1CCC(CC1)C m_207__17312546__121593 [0,1,0,1,0,0|2,0,0]=4 4033 B13R1.9 CCC=CCNC1CCC(CC1)O m_269862__17312576__9315688 [0,1,0,1,0,0|2,0,0]=4 4034 B13R1.9 CCCCCCN1CC=C(CC1)Br m_2230__13762236__5530588 [0,1,0,1,0,0|2,0,0]=4 4035 B13R1.9 CCCCCCN1CC=C(CC1)C m_2230__7832586__5530588 [0,1,0,1,0,0|2,0,0]=4 4036 B13R1.9 CN1CCC(CC1)NCC=CCO m_270004__11971554__8157304 [0,1,0,1,0,0|2,0,0]=4 4037 B13R1.9 NC/C=C\CNC1CCC(CC1)N m_272690__21478164__11349492 [0,1,0,1,0,0|2,0,0]=4 4038 B13R1.9 O=S1CCC(CC1)NCC=CCO m_270004__11971554__13397832 [0,1,0,1,0,0|2,0,0]=4 4039 B13R1.9 OCC=CCNC1CCC(CC1)F m_270004__11971554__24719094 [0,1,0,1,0,0|1,0,0]=3 4040 B13R1.9 OCC=CCNC1CCC(CC1)O m_270004__11971554__19467784 [0,1,0,1,0,0|1,0,0]=3 4041 B13R1.16 CC1C(=O)CCCN1CC=CCO m_2230__13225806__16809276 [0,1,0,1,0,0|1,0,1]=4 4042 B13R1.16 CC1C(CCCN1CC=CCO)O m_2230__10719784__16809276 [0,1,0,1,0,0|1,0,0]=3 4043 B13R1.16 CC1CCCN(C1C)CC=CCO m_2230__5635208__16809276 [0,1,0,1,0,0|1,0,0]=3 4044 B13R1.16 CC1NCCN(C1C)CC=CCO m_269982__9362036__16809282 [0,1,0,1,0,0|2,0,0]=4 4045 B13R1.16 CC1SCCN(C1C)CC=CCO m_2230__5126320__16809276 [0,1,0,1,0,0|2,0,0]=4 4046 B13R1.16 C[C@@H]1[C@@H](CCCN1CC=CCO)O m_2230__13038652__16809276 [0,1,0,1,0,0|1,0,0]=3 4047 B13R1.16 C[C@H]1OCCN([C@@H]1C)CC=CCO m_2230__22408752__16809276 [0,1,0,1,0,0|2,0,0]=4 4048 B13R1.91 C=C(CO)CN1CCCCC1CC m_2230__1722000__15422660 [0,1,0,1,0,0|1,0,1]=4 4049 B13R1.91 CCC(=O)NC1CCCCC1CC m_270062__7601140__22005658 [0,1,0,1,0,0|2,0,0]=4 4050 B13R1.91 CCC(=O)OC1CCCCC1CC m_276436__14076906__14101862 [0,1,0,1,0,0|2,0,0]=4 4051 B13R1.91 CCC1CCCCC1NC(=O)CN m_240690__7357398__3025698 [0,1,0,1,0,0|2,0,0]=4 4052 B13R1.91 CCC1CCCCC1NC(=O)CO m_22__654460__7941800 [0,1,0,1,0,0|1,0,0]=3 4053 B13R1.91 CCC1CCCCC1N[C@H](C)CO m_270004__8291226__24722330 [0,1,0,1,0,0|1,0,1]=4 4054 B13R1.91 CO[C@@H]1CCCC[C@H]1NC(=O)CO m_22__11685540__7941800 [0,1,0,1,0,0|2,0,0]=4 4055 B13R1.91 CO[C@H]1CCCC[C@H]1NC(=O)CO m_22__20901114__7941800 [0,1,0,1,0,0|2,0,0]=4 4056 B13R1.91 CS[C@@H]1CCCC[C@H]1NC(=O)CO m_22__11681892__7941800 [0,1,0,1,0,0|2,0,0]=4 4057 B13R1.91 NCC1CCCCC1NC(=O)CO m_240690__7347562__17025660 [0,1,0,1,0,0|2,0,0]=4 4058 B13R1.91 NC[C@H]1CCCC[C@H]1NC(=O)CO m_240690__13810332__17025660 [0,1,0,1,0,0|2,0,0]=4 4059 B13R1.91 O=C(CO)N[C@@H]1CCCC[C@@H]1CO m_22__23044910__7941800 [0,1,0,1,0,0|2,0,0]=4 4060 B13R1.91 O=C(CO)N[C@@H]1CCCC[C@H]1CO m_22__9438948__7941800 [0,1,0,1,0,0|2,0,0]=4 4061 B13R1.222 CCO[C@@H]1CC[C@H]1CNC(=O)CO m_22__24630522__7941800 [0,1,0,1,0,0|2,0,0]=4 4062 B13R1.382 CCC(C)C1CCCCN1CCO m_2230__5443150__6165700 [0,1,0,1,0,0|1,0,1]=4 4063 B13R1.382 CCC(O)C1CCCCN1CCO m_2230__5344560__6165700 [0,1,0,1,0,0|1,0,1]=4 4064 B13R1.382 CCCC1CCCCN1C(=O)CC m_270062__12126444__22005658 [0,1,0,1,0,0|2,0,0]=4 4065 B13R1.382 CCCC1CCCCN1C(=O)CN m_240690__10872594__3025698 [0,1,0,1,0,0|2,0,0]=4 4066 B13R1.382 CCCC1CCCCN1C(=O)CO m_22__8750828__7941800 [0,1,0,1,0,0|1,0,0]=3 4067 B13R1.382 CCCC1CNCCN1C(=O)CO m_240690__8629378__17025660 [0,1,0,1,0,0|2,0,0]=4 4068 B13R1.382 CCCC1COCCN1C(=O)CO m_22__20902278__7941800 [0,1,0,1,0,0|2,0,0]=4 4069 B13R1.382 CNC[C@H]1CCCCN1C(=O)CO m_240690__12901166__17025660 [0,1,0,1,0,0|2,0,0]=4 4070 B13R1.382 COCC1CCCCN1C(=O)CO m_22__10860856__7941800 [0,1,0,1,0,0|2,0,0]=4 4071 B13R1.382 NCCC1CCCCN1C(=O)CO m_240690__10178534__17025660 [0,1,0,1,0,0|2,0,0]=4 4072 B13R1.382 NCC[C@H]1CCCCN1C(=O)CO m_240690__23163876__17025660 [0,1,0,1,0,0|2,0,0]=4 4073 B13R1.382 O=C(CO)N1CCCCC1CCO m_22__564346__7941800 [0,1,0,1,0,0|2,0,0]=4 4074 B13R1.393 C=C(CO)CN1CCCC1CCC m_2230__13579908__15422660 [0,1,0,1,0,0|1,0,1]=4 4075 B13R1.393 CCCC1CCCC1N[C@H](C)CO m_270004__8291226__24722530 [0,1,0,1,0,0|1,0,1]=4 4076 B13R1.393 CCC[C@H]1CNC[C@H]1NC(=O)CO m_240690__23278420__17025660 [0,1,0,1,0,0|2,0,0]=4 4077 B13R1.393 CCO[C@@H]1CCC[C@H]1NC(=O)CO m_22__10860514__7941800 [0,1,0,1,0,0|2,0,0]=4 4078 B13R1.393 CCSC1CCCC1NC(=O)CO m_22__6507838__7941800 [0,1,0,1,0,0|2,0,0]=4 4079 B13R1.393 CNC[C@H]1CCC[C@H]1NC(=O)CO m_240690__24641922__17025660 [0,1,0,1,0,0|2,0,0]=4 4080 B13R1.393 O=C(CO)N[C@@H]1CCC[C@H]1CCO m_22__24036212__7941800 [0,1,0,1,0,0|2,0,0]=4 4081 B13R1.393 O=C(CO)N[C@H]1CCC[C@H]1CCO m_22__25074806__7941800 [0,1,0,1,0,0|2,0,0]=4 4082 B13R1.527 C=C(CO)CN1CCCCCC1C m_2230__9017564__15422660 [0,1,0,1,0,0|1,0,1]=4 4083 B13R1.527 CC1CCCCCC1NC(=O)CN m_240690__7364384__3025698 [0,1,0,1,0,0|2,0,0]=4 4084 B13R1.527 CC1CCCCCC1NC(=O)CO m_22__6107996__7941800 [0,1,0,1,0,0|1,0,0]=3 4085 B13R1.527 CCC(=O)NC1CCCCCC1C m_270062__7620850__22005658 [0,1,0,1,0,0|2,0,0]=4 4086 B13R1.527 N[C@H]1CCCCC[C@@H]1NC(=O)CO m_240690__21478094__17025660 [0,1,0,1,0,0|2,0,0]=4 4087 B13R1.527 O=C(CO)NC1CCCCCC1F m_22__16663958__7941800 [0,1,0,1,0,0|2,0,0]=4 4088 B13R1.527 O=C(CO)N[C@@H]1CCCCC[C@H]1O m_22__13613448__7941800 [0,1,0,1,0,0|2,0,0]=4 4089 B13R1.528 C=C(CO)CNC1CCCCC1C m_2230__8740226__15422660 [0,1,0,1,0,0|1,0,1]=4 4090 B13R1.528 CC1CCCCC1CNC(=O)CN m_270006__8387864__10128098 [0,1,0,1,0,0|2,0,0]=4 4091 B13R1.528 CC1CCCCC1CNC(=O)CO m_22__2028600__7941800 [0,1,0,1,0,0|1,0,0]=3 4092 B13R1.528 CC1CNCCC1CNC(=O)CO m_240690__13599726__17025660 [0,1,0,1,0,0|2,0,0]=4 4093 B13R1.528 CC1COCCC1CNC(=O)CO m_22__10153562__7941800 [0,1,0,1,0,0|2,0,0]=4 4094 B13R1.528 CCC(=O)NCC1CCCCC1C m_270062__7606596__22005658 [0,1,0,1,0,0|2,0,0]=4 4095 B13R1.528 CCC(=O)OCC1CCCCC1C m_1458__473508__11946502 [0,1,0,1,0,0|2,0,0]=4 4096 B13R1.528 CCC(C)CN[C@H]1CCC=C[C@H]1O m_270004__23854588__9139664 [0,1,0,1,0,0|1,0,0]=3 4097 B13R1.528 CN1CCCCC1CNC(=O)CO m_22__13596924__7941800 [0,1,0,1,0,0|2,0,0]=4 4098 B13R1.528 CN1CCCC[C@H]1CNC(=O)CO m_22__24192048__7941800 [0,1,0,1,0,0|2,0,0]=4 4099 B13R1.528 NC1CCCCC1CNC(=O)CO m_240690__16789274__17025660 [0,1,0,1,0,0|2,0,0]=4 4100 B13R1.528 O=C(CO)NCC1CCCCC1F m_22__13759604__7941800 [0,1,0,1,0,0|2,0,0]=4 4101 B13R1.528 O=C(CO)NC[C@@H]1CCCC[C@H]1O m_22__10811196__7941800 [0,1,0,1,0,0|2,0,0]=4 4102 B13R1.536 C=C(CO)CCNCC1CCCC1 m_270004__17763614__8300536 [0,1,0,1,0,0|1,0,1]=4 4103 B13R1.536 C=C(CO)CSCCC1CCCC1 m_7__22987540__15422654 [0,1,0,1,0,0|1,0,1]=4 4104 B13R1.536 CC(CO)NCCCC1CCCC1 m_269862__7193384__15157990 [0,1,0,1,0,0|1,0,1]=4 4105 B13R1.536 CC(CO)SCCCC1CCCC1 m_7__6338928__15113686 [0,1,0,1,0,0|1,0,1]=4 4106 B13R1.536 CCC(=O)NCCCC1CCCC1 m_270062__7598976__22005658 [0,1,0,1,0,0|2,0,0]=4 4107 B13R1.536 CCC(=O)OCCCC1CCCC1 m_1458__473508__15113696 [0,1,0,1,0,0|2,0,0]=4 4108 B13R1.536 CCC(C)CCSCC1C=CCC1 m_62__20058276__14322920 [0,1,0,1,0,0|2,0,0]=4 4109 B13R1.536 CCC(C)CNCCC1C=CCC1 m_270004__11352300__24714984 [0,1,0,1,0,0|2,0,0]=4 4110 B13R1.536 CCC(C)NCCCC1C=CCC1 m_269862__12854930__7200134 [0,1,0,1,0,0|2,0,0]=4 4111 B13R1.536 CCC(O)CCSCC1C=CCC1 m_62__16640708__14322920 [0,1,0,1,0,0|2,0,0]=4 4112 B13R1.536 CCC(O)CNCCC1C=CCC1 m_270004__24336106__24714984 [0,1,0,1,0,0|2,0,0]=4 4113 B13R1.536 C[C@H](CO)NCCCC1CCCC1 m_2230__22399532__15113700 [0,1,0,1,0,0|1,0,1]=4 4114 B13R1.536 N=C(CO)NOCCC1CCCC1 m_34__11944490__9139756 [0,1,0,1,0,0|2,0,0]=4 4115 B13R1.536 NCC(=O)NCCCC1CCCC1 m_270006__8382568__10128098 [0,1,0,1,0,0|2,0,0]=4 4116 B13R1.536 O=C(CO)NCCCC1CCCC1 m_22__490372__7941800 [0,1,0,1,0,0|1,0,0]=3 4117 B13R1.536 O=C(CO)NCCCC1CCCN1 m_240690__10814880__17025660 [0,1,0,1,0,0|2,0,0]=4 4118 B13R1.536 O=C(CO)NCCCC1CCOC1 m_22__10855760__7941800 [0,1,0,1,0,0|2,0,0]=4 4119 B13R1.536 O=C(CO)NCCCN1CCCC1 m_22__125628__7941800 [0,1,0,1,0,0|2,0,0]=4 4120 B13R1.536 O=C(CO)NCCNC1CCCC1 m_270004__24793754__8157302 [0,1,0,1,0,0|2,0,0]=4 4121 B13R1.536 O=C(CO)NCCOC1CCCC1 m_22__1030730__7941800 [0,1,0,1,0,0|2,0,0]=4 4122 B13R1.536 O=C(CO)NCCSC1CCCC1 m_22__3323024__7941800 [0,1,0,1,0,0|2,0,0]=4 4123 B13R1.538 C=C(CO)CSCCCC1CC1C m_7__18317424__15422654 [0,1,0,1,0,0|1,0,1]=4 4124 B13R1.538 CC1CC1CCCCNC(=O)CN m_240690__21495800__3025698 [0,1,0,1,0,0|2,0,0]=4 4125 B13R1.538 CC1CC1CCCCNC(=O)CO m_22__20613176__7941800 [0,1,0,1,0,0|1,0,0]=3 4126 B13R1.538 CC1CC1CCCCN[C@H](C)CO m_270004__8291226__24715066 [0,1,0,1,0,0|1,0,1]=4 4127 B13R1.538 CC1CC1CCCONC(=N)CO m_34__11944490__17055830 [0,1,0,1,0,0|2,0,0]=4 4128 B13R1.538 CC1CC1CNCCNC(=O)CO m_270004__24793754__9139722 [0,1,0,1,0,0|2,0,0]=4 4129 B13R1.538 CCC(=O)NCCCCC1CC1C m_270062__21499560__22005658 [0,1,0,1,0,0|2,0,0]=4 4130 B13R1.539 C=C(CO)CSCCCC1CCC1 m_7__22987742__15422654 [0,1,0,1,0,0|1,0,1]=4 4131 B13R1.539 N=C(CO)NOCCCC1CCC1 m_34__11944490__12056156 [0,1,0,1,0,0|2,0,0]=4 4132 B13R1.539 O=C(CO)NCCCCN1CCC1 m_22__20843886__7941800 [0,1,0,1,0,0|2,0,0]=4 4133 B13R1.539 O=C(CO)NCCCOC1CCC1 m_22__13572160__7941800 [0,1,0,1,0,0|2,0,0]=4 4134 B13R1.539 O=C(CO)NCCNCC1CCC1 m_270004__24793754__24715052 [0,1,0,1,0,0|2,0,0]=4 4135 B13R1.539 O=C(CO)NCCOCC1CCC1 m_22__11568328__7941800 [0,1,0,1,0,0|2,0,0]=4 4136 B13R1.546 CC1CCCCCCN1C(=O)CN m_240690__16908220__3025698 [0,1,0,1,0,0|2,0,0]=4 4137 B13R1.546 CC1CCCCCCN1C(=O)CO m_22__16908170__7941800 [0,1,0,1,0,0|1,0,0]=3 4138 B13R1.546 CCC(=O)N1CCCCCCC1C m_270062__16908194__22005658 [0,1,0,1,0,0|2,0,0]=4 4139 B13R1.581 CCCCC1CCCN1C(=O)CC m_270062__15143788__22005658 [0,1,0,1,0,0|2,0,0]=4 4140 B13R1.581 CCCCC1CCCN1C(=O)CN m_240690__15143818__3025698 [0,1,0,1,0,0|2,0,0]=4 4141 B13R1.581 CCCCC1CCCN1C(=O)CO m_22__15143764__7941800 [0,1,0,1,0,0|1,0,0]=3 4142 B13R1.581 O=C(CO)N1CCCC1CCCO m_22__7866822__7941800 [0,1,0,1,0,0|2,0,0]=4 4143 B13R1.594 CC(CO)NCCCCCC1CC1 m_269862__15723022__15157990 [0,1,0,1,0,0|1,0,1]=4 4144 B13R1.594 CC(CO)SCCCCCC1CC1 m_7__6338928__13582074 [0,1,0,1,0,0|1,0,1]=4 4145 B13R1.594 CCC(=O)NCCCCCC1CC1 m_270062__15723026__22005658 [0,1,0,1,0,0|2,0,0]=4 4146 B13R1.594 CCC(=O)OCCCCCC1CC1 m_1458__473508__13582084 [0,1,0,1,0,0|2,0,0]=4 4147 B13R1.594 C[C@H](CO)NCCCCCC1CC1 m_2230__22399532__13582088 [0,1,0,1,0,0|1,0,1]=4 4148 B13R1.594 N=C(CO)NOCCCCC1CC1 m_34__11944490__13763126 [0,1,0,1,0,0|2,0,0]=4 4149 B13R1.594 NCC(=O)NCCCCCC1CC1 m_240690__15723080__3025698 [0,1,0,1,0,0|2,0,0]=4 4150 B13R1.594 O=C(CO)NCCCCCC1CC1 m_22__15722982__7941800 [0,1,0,1,0,0|1,0,0]=3 4151 B13R1.594 O=C(CO)NCCCOCC1CC1 m_22__130233__7941800 [0,1,0,1,0,0|2,0,0]=4 4152 B13R1.594 O=C(CO)NCCNCCC1CC1 m_270004__24793754__13455800 [0,1,0,1,0,0|2,0,0]=4 4153 B13R1.594 O=C(CO)NCCOCCC1CC1 m_22__16493496__7941800 [0,1,0,1,0,0|2,0,0]=4 4154 B13R1.594 O=C(CO)NOCCCCC1CC1 m_22__20996110__7941800 [0,1,0,1,0,0|2,0,0]=4 4155 B13R1.599 C=C(CO)CCNC1CCCC1C m_207__17763592__6951098 [0,1,0,1,0,0|1,0,1]=4 4156 B13R1.599 CC1OCCC1CCNC(=O)CO m_22__16493952__7941800 [0,1,0,1,0,0|2,0,0]=4 4157 B13R1.599 CN1CCCC1CCNC(=O)CO m_22__12058018__7941800 [0,1,0,1,0,0|2,0,0]=4 4158 B13R1.599 C[C@H]1CCC[C@@H]1CONC(=N)CO m_34__11944490__13911856 [0,1,0,1,0,0|2,0,0]=4 4159 B13R1.599 C[C@H]1CCO[C@H]1CCNC(=O)CO m_22__14792486__7941800 [0,1,0,1,0,0|2,0,0]=4 4160 B13R1.599 C[C@H]1CNC[C@@H]1CCNC(=O)CO m_240690__13145160__17025660 [0,1,0,1,0,0|2,0,0]=4 4161 B13R1.599 C[C@H]1OCC[C@H]1CCNC(=O)CO m_22__16921032__7941800 [0,1,0,1,0,0|2,0,0]=4 4162 B13R1.599 O=C(CO)NCC[C@@H]1CCC[C@H]1O m_22__14730220__7941800 [0,1,0,1,0,0|2,0,0]=4 4163 B13R1.611 CCC(=O)N1CCCCCC1CC m_270062__7619402__22005658 [0,1,0,1,0,0|2,0,0]=4 4164 B13R1.611 CCC1CCCCCN1C(=O)CN m_240690__7365254__3025698 [0,1,0,1,0,0|2,0,0]=4 4165 B13R1.611 CCC1CCCCCN1C(=O)CO m_22__5454856__7941800 [0,1,0,1,0,0|1,0,0]=3 4166 B13R1.611 CCC1CCOCCN1C(=O)CO m_22__14727158__7941800 [0,1,0,1,0,0|2,0,0]=4 4167 B13R1.611 O=C(CO)N1CCCCCC1CO m_22__11757946__7941800 [0,1,0,1,0,0|2,0,0]=4 4168 B13R1.613 C=C(CO)CNC1CCCC1CC m_2230__9296238__15422660 [0,1,0,1,0,0|1,0,1]=4 4169 B13R1.613 CCC(=O)NCC1CCCC1CC m_270062__16414882__22005658 [0,1,0,1,0,0|2,0,0]=4 4170 B13R1.613 CCC1CCCC1CNC(=O)CN m_240690__21558666__3025698 [0,1,0,1,0,0|2,0,0]=4 4171 B13R1.613 CCC1CCCC1CNC(=O)CO m_22__10689724__7941800 [0,1,0,1,0,0|1,0,0]=3 4172 B13R1.613 CCC1CCNC1CNC(=O)CO m_240690__24641968__17025660 [0,1,0,1,0,0|2,0,0]=4 4173 B13R1.613 CCN1CCCC1CNC(=O)CO m_22__135472__7941800 [0,1,0,1,0,0|2,0,0]=4 4174 B13R1.613 CCN1CCC[C@H]1CNC(=O)CO m_22__24035782__7941800 [0,1,0,1,0,0|2,0,0]=4 4175 B13R1.613 COC1CCCC1CNC(=O)CO m_22__8272740__7941800 [0,1,0,1,0,0|2,0,0]=4 4176 B13R1.613 O=C(CO)NC[C@@H]1CCC[C@H]1CF m_22__20975656__7941800 [0,1,0,1,0,0|2,0,0]=4 4177 B13R1.619 C=C(CO)CCNCC1CC1CC m_270004__17763614__18234084 [0,1,0,1,0,0|1,0,1]=4 4178 B13R1.619 C=C(CO)CCNC[C@@H]1C[C@H]1CC m_270004__17763614__18897550 [0,1,0,1,0,0|1,0,1]=4 4179 B13R1.648 C=C(CO)CCNC1CCC1CC m_269862__17763612__10177948 [0,1,0,1,0,0|1,0,1]=4 4180 B13R1.672 C[C@]1(CCCN1CC=CCO)CO m_2230__16807304__16809276 [0,1,0,1,0,0|2,0,0]=4 4181 B13R1.718 C=C(CO)CCNC1CCCCC1 m_207__17763592__121598 [0,1,0,1,0,0|1,0,1]=4 4182 B13R1.718 C=C(CO)CSCC1CCCCC1 m_7__2303152__15422654 [0,1,0,1,0,0|1,0,1]=4 4183 B13R1.718 CC(CO)NCCC1CCCCC1 m_269862__8257112__15157990 [0,1,0,1,0,0|1,0,1]=4 4184 B13R1.718 CC(CO)SCCC1CCCCC1 m_7__6338928__21208850 [0,1,0,1,0,0|1,0,1]=4 4185 B13R1.718 CCC(=O)NCCC1CCCCC1 m_270062__7600656__22005658 [0,1,0,1,0,0|2,0,0]=4 4186 B13R1.718 CCC(=O)OCCC1CCCCC1 m_276436__14078434__14101862 [0,1,0,1,0,0|2,0,0]=4 4187 B13R1.718 CCC(C)CNCC1CC=CCC1 m_207__11352262__121213 [0,1,0,1,0,0|2,0,0]=4 4188 B13R1.718 CCC(C)CNCC1CC=CCO1 m_207__14050636__7687310 [0,1,0,1,0,0|1,0,0]=3 4189 B13R1.718 CCC(C)CSC[C@@H]1CC=CCC1 m_62__10709932__23045122 [0,1,0,1,0,0|2,0,0]=4 4190 B13R1.718 CCC(C)NCCC1CC=CCC1 m_269862__12299620__7200134 [0,1,0,1,0,0|2,0,0]=4 4191 B13R1.718 CCC(F)CSC[C@@H]1CC=CCC1 m_62__9787600__23045122 [0,1,0,1,0,0|2,0,0]=4 4192 B13R1.718 CCC(O)CNCC1CC=CCC1 m_273610__11520104__11516276 [0,1,0,1,0,0|2,0,0]=4 4193 B13R1.718 CCC(O)CNCC1CC=CCO1 m_273610__14050690__11516276 [0,1,0,1,0,0|1,0,0]=3 4194 B13R1.718 CCC(O)CSC[C@@H]1CC=CCC1 m_7__22988104__23045116 [0,1,0,1,0,0|2,0,0]=4 4195 B13R1.718 CC[C@H](N)CSC[C@@H]1CC=CCC1 m_7__20871354__23045116 [0,1,0,1,0,0|2,0,0]=4 4196 B13R1.718 C[C@H](CO)NCCC1CCCCC1 m_2230__22399532__21208862 [0,1,0,1,0,0|1,0,1]=4 4197 B13R1.718 N=C(CO)NOCC1CCCCC1 m_34__11944490__8627264 [0,1,0,1,0,0|2,0,0]=4 4198 B13R1.718 NCC(=O)NCCC1CCCCC1 m_270006__8383540__10128098 [0,1,0,1,0,0|2,0,0]=4 4199 B13R1.718 O=C(CCCC1CCCCC1)NO m_527__388132__281608 [0,1,0,1,0,0|1,0,1]=4 4200 B13R1.718 O=C(CO)NCCC1CCCCC1 m_22__593460__7941800 [0,1,0,1,0,0|1,0,0]=3 4201 B13R1.718 O=C(CO)NCCC1CCCCN1 m_240690__13906272__17025660 [0,1,0,1,0,0|2,0,0]=4 4202 B13R1.718 O=C(CO)NCCC1CCCCO1 m_22__8602252__7941800 [0,1,0,1,0,0|2,0,0]=4 4203 B13R1.718 O=C(CO)NCCC1CCCNC1 m_240690__7347508__17025660 [0,1,0,1,0,0|2,0,0]=4 4204 B13R1.718 O=C(CO)NCCC1CCCOC1 m_22__16920162__7941800 [0,1,0,1,0,0|2,0,0]=4 4205 B13R1.718 O=C(CO)NCCC1CCNCC1 m_240690__11734066__17025660 [0,1,0,1,0,0|2,0,0]=4 4206 B13R1.718 O=C(CO)NCCC1CCOCC1 m_22__4914392__7941800 [0,1,0,1,0,0|2,0,0]=4 4207 B13R1.718 O=C(CO)NCCN1CCCCC1 m_22__758912__7941800 [0,1,0,1,0,0|2,0,0]=4 4208 B13R1.718 O=C(CO)NOCC1CCCCC1 m_22__23378636__7941800 [0,1,0,1,0,0|2,0,0]=4 4209 B13R1.718 O[C@H](CF)CNCC1CC=CCO1 m_273610__14050690__14323916 [0,1,0,1,0,0|2,0,0]=4 4210 B13R1.1689 CCC(=O)N1CCCCCCCC1 m_270062__12127718__22005658 [0,1,0,1,0,0|2,0,0]=4 4211 B13R1.1689 NCC(=O)N1CCCCCCCC1 m_240690__15065538__3025698 [0,1,0,1,0,0|2,0,0]=4 4212 B13R1.1689 O=C(CO)N1CCCCCCCC1 m_22__10808610__7941800 [0,1,0,1,0,0|1,0,0]=3 4213 B13R1.1711 C=C(CO)CSC1CCCCCC1 m_7__17653480__15422654 [0,1,0,1,0,0|1,0,1]=4 4214 B13R1.1711 CC(CO)NCC1CCCCCC1 m_269862__24450466__15157990 [0,1,0,1,0,0|1,0,1]=4 4215 B13R1.1711 CC(CO)SCC1CCCCCC1 m_7__6338928__8761742 [0,1,0,1,0,0|1,0,1]=4 4216 B13R1.1711 CCC(=O)NCC1CCCCCC1 m_270062__24450480__22005658 [0,1,0,1,0,0|2,0,0]=4 4217 B13R1.1711 CCC(=O)OCC1CCCCCC1 m_276436__14080068__14101862 [0,1,0,1,0,0|2,0,0]=4 4218 B13R1.1711 CCC(C)CCN1CCC=CCC1 m_2230__22406010__20058362 [0,1,0,1,0,0|2,0,0]=4 4219 B13R1.1711 CCC(C)CNC1CCC=CCC1 m_207__11352262__17656400 [0,1,0,1,0,0|2,0,0]=4 4220 B13R1.1711 CCC(C)NCC1CCC=CCC1 m_269862__13262606__7200134 [0,1,0,1,0,0|2,0,0]=4 4221 B13R1.1711 CCC(N)CNC1CCC=CCC1 m_272690__11349414__17656416 [0,1,0,1,0,0|2,0,0]=4 4222 B13R1.1711 CCC(O)CCN1CCC=CCC1 m_2230__22406010__16640714 [0,1,0,1,0,0|2,0,0]=4 4223 B13R1.1711 CCC(O)CNC1CCC=CCC1 m_207__11354014__17656400 [0,1,0,1,0,0|2,0,0]=4 4224 B13R1.1711 CC[C@H](N)CCN1CCC=CCC1 m_269982__22514450__22485976 [0,1,0,1,0,0|2,0,0]=4 4225 B13R1.1711 C[C@H](CO)NCC1CCCCCC1 m_207__1299140__6005054 [0,1,0,1,0,0|1,0,1]=4 4226 B13R1.1711 NCC(=O)NCC1CCCCCC1 m_240690__24450446__3025698 [0,1,0,1,0,0|2,0,0]=4 4227 B13R1.1711 O=C(CCC1CCCCCC1)NO m_527__388132__11763670 [0,1,0,1,0,0|1,0,1]=4 4228 B13R1.1711 O=C(CO)NCC1CCCCCC1 m_22__23072894__7941800 [0,1,0,1,0,0|1,0,0]=3 4229 B13R1.1711 O=C(CO)NCC1CCCCCN1 m_240690__13437740__17025660 [0,1,0,1,0,0|2,0,0]=4 4230 B13R1.1711 O=C(CO)NCC1CCCCNC1 m_240690__15775082__17025660 [0,1,0,1,0,0|2,0,0]=4 4231 B13R1.1711 O=C(CO)NCC1CCCNCC1 m_240690__13944044__17025660 [0,1,0,1,0,0|2,0,0]=4 4232 B13R1.1711 O=C(CO)NCC1CCCOCC1 m_22__22617904__7941800 [0,1,0,1,0,0|2,0,0]=4 4233 B13R1.1711 O=C(CO)NCC1CCCSCC1 m_22__13904526__7941800 [0,1,0,1,0,0|2,0,0]=4 4234 B13R1.1870 C=C(CO)CN1CCCCCCC1 m_2230__665322__15422660 [0,1,0,1,0,0|1,0,1]=4 4235 B13R1.1870 CC(CO)NC1CCCCCCC1 m_269862__7192648__15157990 [0,1,0,1,0,0|1,0,1]=4 4236 B13R1.1870 CCC(=O)NC1CCCCCCC1 m_270062__7594990__22005658 [0,1,0,1,0,0|2,0,0]=4 4237 B13R1.1870 CCC(=O)OC1CCCCCCC1 m_276436__14076534__14101862 [0,1,0,1,0,0|2,0,0]=4 4238 B13R1.1870 C[C@H](CO)NC1CCCCCCC1 m_269862__7194864__7200188 [0,1,0,1,0,0|1,0,1]=4 4239 B13R1.1870 NCC(=O)NC1CCCCCCC1 m_270006__8379438__10128098 [0,1,0,1,0,0|2,0,0]=4 4240 B13R1.1870 O=C(CO)NC1CCCCCCC1 m_22__57934__7941800 [0,1,0,1,0,0|1,0,0]=3 4241 B13R1.2432 CCC=CCCSCC1[C@@H]([C@H]1C)C m_62__8859720__17665546 [0,1,0,1,0,0|2,0,0]=4 4242 B13R1.2437 CC/C=C\CCCN1CC(C1C)C m_270004__10547154__24594278 [0,1,0,1,0,0|2,0,0]=4 4243 B13R1.2938 CC/C=C\CCCNCC1(CC1)Br m_270004__13259310__24594278 [0,1,0,1,0,0|2,0,0]=4 4244 B13R1.2938 CC/C=C\CCCNCC1(CC1)C m_270004__8297934__24594278 [0,1,0,1,0,0|2,0,0]=4 4245 B13R1.2938 CC/C=C\CCCNCC1(CC1)F m_270004__13572724__24594278 [0,1,0,1,0,0|2,0,0]=4 4246 B13R1.2938 CC/C=C\CCCNCC1(CC1)O m_270004__20265624__24594278 [0,1,0,1,0,0|2,0,0]=4 4247 B13R1.2938 CC1(CC1)CCCSCC=CCO m_7__22988088__16809272 [0,1,0,1,0,0|1,0,0]=3 4248 B13R1.2938 CCC=CCCSCCC1(CC1)C m_62__13763162__8859722 [0,1,0,1,0,0|2,0,0]=4 4249 B13R1.2938 CCC=CCCSCCC1(CC1)O m_62__8859720__9162882 [0,1,0,1,0,0|2,0,0]=4 4250 B13R1.3436 CCC=CCCN1CCC1(C)CC m_2230__22407902__8859726 [0,1,0,1,0,0|2,0,0]=4 4251 B13R1.3440 CCC=CCCN1CCC(C1C)C m_2230__6507962__8859726 [0,1,0,1,0,0|2,0,0]=4 4252 B13R1.3440 CCC=CCCN1CC[C@@H]([C@@H]1C)O m_2230__14788854__8859726 [0,1,0,1,0,0|2,0,0]=4 4253 B13R1.3440 CCC=CCCN1CC[C@@H]([C@H]1C)O m_2230__10747766__8859726 [0,1,0,1,0,0|2,0,0]=4 4254 B13R2.1 OCCN1CCC2C1CCCC2 m_2230__15741522__6165700 [0,0,0,2,0,0|1,0,1]=4 4255 B13R2.1 OCCN1CC[C@@H]2[C@H]1CCCC2 m_2230__11566952__6165700 [0,0,0,2,0,0|1,0,1]=4 4256 B13R2.6 ON=C1CCCC12CCCCC2 m_4__388124__10857234 [0,0,0,2,0,0|1,0,1]=4 4257 B13R2.17 C[C@H]1C[C@@H]1NCC2CC=CCC2 m_207__12364696__121213 [0,0,0,2,0,0|2,0,0]=4 4258 B13R2.20 OCCN1CCC12CCCCC2 m_2230__15258862__6165700 [0,0,0,2,0,0|1,0,1]=4 4259 B13R2.27 C[C@@H]1CCN1CC2CC=CCC2 m_270004__24224170__8127716 [0,0,0,2,0,0|2,0,0]=4 4260 B13R2.27 C[C@H]1CC[C@H]1CN2CC=CCC2 m_2230__8375936__21674496 [0,0,0,2,0,0|2,0,0]=4 4261 B13R2.50 CCC1CC1CN2CC=CCC2 m_270004__8375948__18234084 [0,0,0,2,0,0|2,0,0]=4 4262 B13R2.50 CC[C@H]1C[C@@H]1CN2CC=CCC2 m_270004__8375948__18897550 [0,0,0,2,0,0|2,0,0]=4 4263 B13R2.64 C1=CC(CC1)CN2CCCCC2 m_2230__679042__14322924 [0,0,0,2,0,0|2,0,0]=4 4264 B13R2.64 C1=CC(CC1)NC2CCCCC2 m_207__11972724__121598 [0,0,0,2,0,0|2,0,0]=4 4265 B13R2.64 C1=CCC(CC1)CN2CCCC2 m_270004__8127936__8127716 [0,0,0,2,0,0|2,0,0]=4 4266 B13R2.64 C1=CCC(CC1)NC2CCCC2 m_207__5137566__121596 [0,0,0,2,0,0|2,0,0]=4 4267 B13R2.64 C1=CCN(CC1)CC2CCCC2 m_2230__8375936__783032 [0,0,0,2,0,0|2,0,0]=4 4268 B13R2.64 C1=CC[C@@H](CC1)NC2CCCC2 m_269862__17838454__7200166 [0,0,0,2,0,0|2,0,0]=4 4269 B13R2.64 C1=CC[C@H](CC1)CN2CCCC2 m_2230__678722__23045126 [0,0,0,2,0,0|2,0,0]=4 4270 B13R2.64 C1=C[C@@H](CC1)NC2CCCCC2 m_270004__24793796__8157310 [0,0,0,2,0,0|2,0,0]=4 4271 B13R2.510 OCCNC1CC2CCC1CC2 m_2230__10466606__6165700 [0,0,0,2,0,0|1,0,1]=4 4272 B13R2.745 CCC=CCCN1CC2CC2C1 m_2230__13022236__8859726 [0,0,0,2,0,0|2,0,0]=4 4273 B13R2.745 CCC=CCNC1CC2CC2C1 m_207__17312546__14423908 [0,0,0,2,0,0|2,0,0]=4 4274 B13R2.745 NC/C=C\CNC1C[C@@H]2C[C@@H]2C1 m_272690__21478164__17760102 [0,0,0,2,0,0|2,0,0]=4 4275 B13R2.745 OCC=CCNC1CC2CC2C1 m_270004__11971554__14423912 [0,0,0,2,0,0|1,0,0]=3 4276 B13R2.745 OCC=CCS[C@H]1C[C@@H]2C[C@@H]2C1 m_7__22849734__16809272 [0,0,0,2,0,0|1,0,0]=3 4277 B13R2.1028 OCCNC1C[C@@H]2[C@H]1CCCC2 m_269862__7193048__12888788 [0,0,0,2,0,0|1,0,1]=4 4278 B13R2.1224 OCC=CCN[C@]12CCC[C@H]1C2 m_2230__22403804__16809276 [0,0,0,2,0,0|1,0,0]=3 4279 B13R2.1224 OCC=CCN[C@]12CNC[C@H]1C2 m_269982__20327096__16809282 [0,0,0,2,0,0|2,0,0]=4 4280 B13R2.1224 OCCSCC[C@]12CCC[C@H]1C2 m_62__17321000__10178562 [0,0,0,2,0,0|1,0,1]=4 4281 B13R2.2382 C1=CCC(CC1)CNCC2CC2 m_207__662500__121213 [0,0,0,2,0,0|2,0,0]=4 4282 B13R2.2382 C1=CCC(CC1)NCCC2CC2 m_270004__8296840__13455800 [0,0,0,2,0,0|2,0,0]=4 4283 B13R2.2382 C1=CCC(OC1)CNCC2CC2 m_207__14050636__2989440 [0,0,0,2,0,0|1,0,0]=3 4284 B13R2.2382 C1=CCN(CC1)CCCC2CC2 m_2230__8375936__16975602 [0,0,0,2,0,0|2,0,0]=4 4285 B13R2.2382 C1=CC[C@H](CC1)CSCC2CC2 m_62__7141820__23045122 [0,0,0,2,0,0|2,0,0]=4 4286 B13R2.2383 C1=CCC(CC1)NCC2CCC2 m_270004__8296840__24715052 [0,0,0,2,0,0|2,0,0]=4 4287 B13R2.2383 C1=CCC(OC1)CNC2COC2 m_269862__14050668__7931470 [0,0,0,2,0,0|2,0,0]=4 4288 B13R2.2383 C1=CCN(CC1)CCC2CCC2 m_2230__8375936__12121638 [0,0,0,2,0,0|2,0,0]=4 4289 B13R2.2383 C1=CC[C@H](CC1)CSC2CCC2 m_7__10684076__23045116 [0,0,0,2,0,0|2,0,0]=4 4290 B13R2.2387 OCC=CCN1C2CNCC1C2 m_269982__23409054__16809282 [0,0,0,2,0,0|2,0,0]=4 4291 B13R2.2388 NC/C=C/CN1C2CCC1CC2 m_269982__22515882__22485940 [0,0,0,2,0,0|2,0,0]=4 4292 B13R2.2388 OCC=CCN1C2CCC1CC2 m_2230__679264__16809276 [0,0,0,2,0,0|1,0,0]=3 4293 B13R2.3058 CCCCN1CC2CC=CC1C2 m_2230__16649510__22993830 [0,0,0,2,0,0|2,0,0]=4 4294 B13R2.3058 OCCNC1CC2CCCC1C2 m_270004__8349608__24709420 [0,0,0,2,0,0|1,0,1]=4 4295 B13R2.3058 OCCN[C@H]1C[C@H]2CCC[C@@H]1C2 m_2230__22404066__6165700 [0,0,0,2,0,0|1,0,1]=4 4296 B13R2.3194 CCC=CCCN1CCC2C1C2 m_2230__7912980__8859726 [0,0,0,2,0,0|2,0,0]=4 4297 B13R2.3194 CCC=CCNC1CC[C@@H]2[C@H]1C2 m_269862__17312576__12805802 [0,0,0,2,0,0|2,0,0]=4 4298 B13R2.3194 OCC=CCNC1CCC2C1C2 m_2230__22403826__16809276 [0,0,0,2,0,0|1,0,0]=3 4299 B13R2.3194 OCC=CCNC1CC[C@@H]2[C@H]1C2 m_270004__11971554__24709262 [0,0,0,2,0,0|1,0,0]=3 4300 B13R2.3194 OCC=CCN[C@H]1CC[C@@H]2[C@H]1C2 m_2230__22404618__16809276 [0,0,0,2,0,0|1,0,0]=3 4301 B13R2.3194 OCCNCCC1CCC2C1C2 m_270004__8349608__24594616 [0,0,0,2,0,0|1,0,1]=4 4302 B13R2.7978 CCCNC[C@H]1[C@H]2[C@@H]1CC=CC2 m_270004__8288780__25072228 [0,0,0,2,0,0|2,0,0]=4 4303 B13R2.7978 OCCNCC1C2C1CCCC2 m_270004__8349608__13873308 [0,0,0,2,0,0|1,0,1]=4 4304 B13R2.7978 OCCSCC1C2C1CCCC2 m_7__128807__22787412 [0,0,0,2,0,0|1,0,1]=4 4305 B13R2.1243 OCCNC1CCC2CCC1C2 m_2230__14248770__6165700 [0,0,0,2,0,0|1,0,1]=4 4306 B13R2.1515 ON=C1CC2CCCCCC2C1 m_4__388124__14426332 [0,0,0,2,0,0|1,0,1]=4 4307 B13R2.5 ON=C1CCCCC12CCCC2 m_4__388124__10548206 [0,0,0,2,0,0|1,0,1]=4 4308 B13R2.29 CC1CCCC1N[C@H]2C=CCC2 m_270004__24793796__8157370 [0,0,0,2,0,0|2,0,0]=4 4309 B13R2.29 CC1CCCN1CC2C=CCC2 m_2230__6338494__14322924 [0,0,0,2,0,0|2,0,0]=4 4310 B13R2.37 OCCN1CCCC12CCCC2 m_2230__13767750__6165700 [0,0,0,2,0,0|1,0,1]=4 4311 B13R2.39 OCCNC1CCC12CCCC2 m_2230__10738194__6165700 [0,0,0,2,0,0|1,0,1]=4 4312 B13R2.47 CCC1CC1CN[C@H]2C=CCC2 m_270004__24793796__18234084 [0,0,0,2,0,0|2,0,0]=4 4313 B13R2.47 CC[C@H]1C[C@@H]1CN[C@H]2C=CCC2 m_270004__24793796__18897550 [0,0,0,2,0,0|2,0,0]=4 4314 B13R2.61 ON=C1CCCC1C2CCCC2 m_4__388124__16649204 [0,0,0,2,0,0|1,0,1]=4 4315 B13R2.62 CCC1CCC1N[C@H]2C=CCC2 m_270004__24793796__10177950 [0,0,0,2,0,0|2,0,0]=4 4316 B13R2.158 C[C@@H]1CCN1CCC2C=CCC2 m_270004__24224170__24714984 [0,0,0,2,0,0|2,0,0]=4 4317 B13R2.183 C1=CC(CC1)CCN2CCCC2 m_2230__678722__22384226 [0,0,0,2,0,0|2,0,0]=4 4318 B13R2.183 C1=CC(CC1)CNC2CCCC2 m_207__12894010__121596 [0,0,0,2,0,0|2,0,0]=4 4319 B13R2.183 C1=CC(CC1)CSC2CCCC2 m_62__14322918__10178584 [0,0,0,2,0,0|2,0,0]=4 4320 B13R2.183 C1=CC(NC1)CNC2CCCC2 m_272690__18688988__11345956 [0,0,0,2,0,0|2,0,0]=4 4321 B13R2.183 C1=C[C@@H](CC1)NCC2CCCC2 m_270004__24793796__8300536 [0,0,0,2,0,0|2,0,0]=4 4322 B13R2.196 CC1CC1NCCC2C=CCC2 m_270004__8294846__24714984 [0,0,0,2,0,0|2,0,0]=4 4323 B13R2.196 C[C@H]1C[C@@H]1CSCC2C=CCC2 m_62__23861440__14322920 [0,0,0,2,0,0|2,0,0]=4 4324 B13R2.292 OCCN1CCCC2C1CCC2 m_2230__5903408__6165700 [0,0,0,2,0,0|1,0,1]=4 4325 B13R2.468 OCCNC1CC[C@@H]2[C@H]1CCC2 m_269862__7193048__12888786 [0,0,0,2,0,0|1,0,1]=4 4326 B13R2.677 C1=CCCN(CC1)C2CCCC2 m_2230__22406010__7912662 [0,0,0,2,0,0|2,0,0]=4 4327 B13R2.701 CCCCNC1C[C@@H]2[C@H]1CC=C2 m_269862__7192636__14243578 [0,0,0,2,0,0|2,0,0]=4 4328 B13R2.701 OCC=CCN1CC2C1CCC2 m_2230__7463632__16809276 [0,0,0,2,0,0|1,0,0]=3 4329 B13R2.2380 C1=CC(CC1)CCNCC2CC2 m_270004__23847180__7548776 [0,0,0,2,0,0|2,0,0]=4 4330 B13R2.2380 C1=CC(CC1)CNCCC2CC2 m_270004__12894044__13455800 [0,0,0,2,0,0|2,0,0]=4 4331 B13R2.2380 C1=CC(CC1)CSCCC2CC2 m_62__14322918__9143162 [0,0,0,2,0,0|2,0,0]=4 4332 B13R2.2381 C1=CC(CC1)CNCC2CCC2 m_270004__12894044__24715052 [0,0,0,2,0,0|2,0,0]=4 4333 B13R2.2381 C1=CC(CC1)CSCC2CCC2 m_62__6007776__14322920 [0,0,0,2,0,0|2,0,0]=4 4334 B13R2.2520 CCCCNC1CC2C=CC1C2 m_2230__22403828__22993830 [0,0,0,2,0,0|2,0,0]=4 4335 B13R2.2520 CCCCNC1C[C@H]2C=C[C@@H]1C2 m_269862__7192636__10953898 [0,0,0,2,0,0|2,0,0]=4 4336 B13R2.2520 CCCNCC1CC2C=CC1C2 m_207__109413__134017 [0,0,0,2,0,0|2,0,0]=4 4337 B13R2.2520 CCCSC[C@H]1C[C@H]2C=C[C@@H]1C2 m_62__875778__17751844 [0,0,0,2,0,0|2,0,0]=4 4338 B13R2.2520 CCNCC[C@H]1C[C@H]2C=C[C@@H]1C2 m_270004__16488674__24715004 [0,0,0,2,0,0|2,0,0]=4 4339 B13R2.2520 NC/C=C/CN1CC2CCC1C2 m_269982__7371492__22485940 [0,0,0,2,0,0|2,0,0]=4 4340 B13R2.2520 OCC=CCN1CC2CCC1C2 m_2230__1182302__16809276 [0,0,0,2,0,0|1,0,0]=3 4341 B13R2.2520 OCC=CCN1C[C@@H]2C[C@H]1CN2 m_269982__12427338__16809282 [0,0,0,2,0,0|2,0,0]=4 4342 B13R2.2520 OCC=CCN1C[C@@H]2C[C@H]1CO2 m_2230__12343778__16809276 [0,0,0,2,0,0|2,0,0]=4 4343 B13R2.2520 OCC=CCN1C[C@@H]2C[C@H]1CS2 m_2230__10911686__16809276 [0,0,0,2,0,0|2,0,0]=4 4344 B13R2.2520 OCCNCC1CC2CCC1C2 m_207__121484__8795270 [0,0,0,2,0,0|1,0,1]=4 4345 B13R2.2520 OCCSCC1CC2CCC1C2 m_7__128807__9358724 [0,0,0,2,0,0|1,0,1]=4 4346 B13R2.2520 OCCSC[C@H]1C[C@H]2CC[C@@H]1C2 m_7__22986906__102708 [0,0,0,2,0,0|1,0,1]=4 4347 B13R2.449 OCCN1CC[C@H]2CCC[C@H]2C1 m_2230__18238996__6165700 [0,0,0,2,0,0|1,0,1]=4 4348 B13R2.673 OCC=CCN1CCCC12CC2 m_2230__14594186__16809276 [0,0,0,2,0,0|1,0,0]=3 4349 B13R2.718 OCC=CCN1CC[C@@H]2[C@H]1CC2 m_2230__20817636__16809276 [0,0,0,2,0,0|1,0,0]=3 4350 B13R2.283 C[C@@H]1C[C@@H]2CCC[C@@H]2N1CCO m_2230__20052994__6165700 [0,0,0,2,0,0|1,0,1]=4 4351 B13R2.4489 C[C@]12CCCC[C@H]1CN2CCO m_2230__12342284__6165700 [0,0,0,2,0,0|1,0,1]=4 4352 B13R2.57 ON=C1CCC2CCCCC2C1 m_4__388124__67498 [0,0,0,2,0,0|1,0,1]=4 4353 B13R2.489 OCCNC1C2CCCC1CC2 m_2230__22397408__6165700 [0,0,0,2,0,0|1,0,1]=4 4354 B13R2.502 OCCNC1CCC[C@@H]2[C@H]1CC2 m_2230__22404668__6165700 [0,0,0,2,0,0|1,0,1]=4 4355 B13R2.539 OCCNC1CCCCC12CC2 m_2230__16927124__6165700 [0,0,0,2,0,0|1,0,1]=4 4356 B13R2.268 OCCN1CCCCC1C2CC2 m_2230__16646412__6165700 [0,0,0,2,0,0|1,0,1]=4 4357 B13R2.747 OCCN1CCCCC12CCC2 m_2230__13908752__6165700 [0,0,0,2,0,0|1,0,1]=4 4358 B13R2.9743 ON=CC12CCCCC1CCC2 m_4__388124__23912850 [0,0,0,2,0,0|1,0,1]=4 4359 B13R2.26 OCCN1C[C@H]2CCCC[C@H]2C1 m_2230__10906462__6165700 [0,0,0,2,0,0|1,0,1]=4 4360 B13R2.2422 OCCN1CCCC[C@@H]2[C@H]1CC2 m_2230__22409212__6165700 [0,0,0,2,0,0|1,0,1]=4 4361 B13R2.700 OCCNCC12CCCCC1C2 m_270004__8349608__19115254 [0,0,0,2,0,0|1,0,1]=4 4362 B13R2.3587 O[C@H]1C=CCC[C@H]1NCC2CC2 m_270004__23854588__7548776 [0,0,0,2,0,0|1,0,0]=3 4363 B13R2.2188 NC/C=C/CN1CCC2CC2C1 m_269982__12116328__22485940 [0,0,0,2,0,0|2,0,0]=4 4364 B13R2.2188 OCC=CCN1CCC2CC2C1 m_2230__12103892__16809276 [0,0,0,2,0,0|1,0,0]=3 4365 B13R2.3443 CC1CC1CN2CCC=CCC2 m_2230__22406010__12216598 [0,0,0,2,0,0|2,0,0]=4 4366 B13R2.3443 CC1CC1NC2CCC=CCC2 m_207__3377454__17656400 [0,0,0,2,0,0|2,0,0]=4 4367 B13R2.3443 C[C@H]1C[C@@H]1CN2CCC=CCC2 m_2230__22406010__23861446 [0,0,0,2,0,0|2,0,0]=4 4368 B13R2.3443 C[C@H]1C[C@@H]1NC2CCC=CCC2 m_207__12364696__17656400 [0,0,0,2,0,0|2,0,0]=4 4369 B13R2.775 OCCN1CCCC1C2CCC2 m_2230__3124024__6165700 [0,0,0,2,0,0|1,0,1]=4 4370 B13R2.934 OCCNC1CCC1C2CCC2 m_269862__7193048__9869184 [0,0,0,2,0,0|1,0,1]=4 4371 B13R2.1227 CCC=CCCN1CC2CC1C2 m_2230__14057288__8859726 [0,0,0,2,0,0|2,0,0]=4 4372 B13R2.1261 OCCNC1CCCC12CCC2 m_2230__14594934__6165700 [0,0,0,2,0,0|1,0,1]=4 4373 B13R2.6840 C1=CCCC(CC1)NC2CCC2 m_269862__10892244__17656402 [0,0,0,2,0,0|2,0,0]=4 4374 B13R2.6840 C1=CCCN(CC1)CC2CCC2 m_2230__22406010__6007782 [0,0,0,2,0,0|2,0,0]=4 4375 B13R2.7982 OCC=CCN1CCC12CNC2 m_269982__22505006__16809282 [0,0,0,2,0,0|2,0,0]=4 4376 B13R2.2993 OCCSCC[C@H]1C[C@@H]1C2CC2 m_62__13036054__10178562 [0,0,0,2,0,0|1,0,1]=4 4377 B13R2.281 OCCN1CCCC1CC2CC2 m_2230__18719106__6165700 [0,0,0,2,0,0|1,0,1]=4 4378 B13R2.2441 OCCNC1CCCC1C2CC2 m_2230__22403234__6165700 [0,0,0,2,0,0|1,0,1]=4 4379 B13R2.2441 OCCN[C@H]1CCC[C@H]1C2CC2 m_2230__13972086__6165700 [0,0,0,2,0,0|1,0,1]=4 4380 B13R2.164 OCCNC1C[C@H]2CCC[C@H]2C1 m_269862__7193048__18189354 [0,0,0,2,0,0|1,0,1]=4 4381 B13R2.6841 C1=CCCC(CC1)CSC2CC2 m_7__22987858__13460544 [0,0,0,2,0,0|2,0,0]=4 4382 B13R2.6841 C1=CCCC(CC1)NCC2CC2 m_207__13040076__2989440 [0,0,0,2,0,0|2,0,0]=4 4383 B13R2.6841 C1=CCCN(CC1)CCC2CC2 m_2230__22406010__6109134 [0,0,0,2,0,0|2,0,0]=4 4384 B13R2.2514 CCCCCN1C[C@H]2C=C[C@H]2C1 m_2230__23818650__5063396 [0,0,0,2,0,0|2,0,0]=4 4385 B13R2.2514 NC/C=C/CN1C[C@H]2CC[C@H]2C1 m_269982__13316312__22485940 [0,0,0,2,0,0|2,0,0]=4 4386 B13R2.2514 OCC=CCN1C[C@H]2CC[C@H]2C1 m_2230__13316264__16809276 [0,0,0,2,0,0|1,0,0]=3 4387 B13R2.2514 OCCNCC1C[C@H]2CC[C@H]2C1 m_270004__8349608__18757950 [0,0,0,2,0,0|1,0,1]=4 4388 B13R2.2514 OCCSCC1C[C@H]2CC[C@H]2C1 m_62__17837780__10178562 [0,0,0,2,0,0|1,0,1]=4