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CCCCCCCCCNCCNC(=O)C AIFCHEM-5954428782 [0,2,0,0,0,0|1,0,0]=3 278 B15R0.164 CCCCCCCCCNCCNC(=O)O AIFCHEM-94535743837 [0,2,0,0,0,0|2,0,0]=4 279 B15R0.164 CCCCCCCCCNCCOC(=O)C AIFCHEM-5671960250 [0,2,0,0,0,0|0,0,0]=2 280 B15R0.164 CCCCCCCCCNCCOC(C)C AIFCHEM-6271182097 [0,2,0,0,0,0|1,0,1]=4 281 B15R0.164 CCCCCCCCNCCCCC(=O)N AIFCHEM-5922473638 [0,2,0,0,0,0|2,0,0]=4 282 B15R0.164 CCCCCCCCNCCCCC(=O)O AIFCHEM-5628750668 [0,2,0,0,0,0|2,0,0]=4 283 B15R0.164 CCCCCCCCNCCCNC(=O)C AIFCHEM-94531732281 [0,2,0,0,0,0|1,0,0]=3 284 B15R0.164 CCCCCCCCNCCCSC(=O)C AIFCHEM-94560857865 [0,2,0,0,0,0|0,1,0]=3 285 B15R0.164 CCCCCCCCNCCOCC(=O)O AIFCHEM-6211656324 [0,2,0,0,0,0|1,0,0]=3 286 B15R0.164 CCCCCCCNCCCCCC(=O)O AIFCHEM-94589460859 [0,2,0,0,0,0|2,0,0]=4 287 B15R0.164 CCCCCCCNCCCCNC(=O)C AIFCHEM-94585131238 [0,2,0,0,0,0|1,0,0]=3 288 B15R0.164 CCCCCCCNCCOCCC(=O)O AIFCHEM-94589453077 [0,2,0,0,0,0|2,0,0]=4 289 B15R0.164 CCCCCNCCCCCCCC(=O)O AIFCHEM-94552823787 [0,2,0,0,0,0|2,0,0]=4 290 B15R0.164 CCCCCNCCCCCCNC(=O)O AIFCHEM-94538178983 [0,2,0,0,0,0|2,0,0]=4 291 B15R0.164 CCCCCNCCCCCCSC(=O)C AIFCHEM-94551439258 [0,2,0,0,0,0|0,1,0]=3 292 B15R0.164 CCCCCNCCOCCOCC(=O)O AIFCHEM-94551426202 [0,2,0,0,0,0|2,0,0]=4 293 B15R0.164 CCCCNCCCCCCCCC(=O)O AIFCHEM-94570972244 [0,2,0,0,0,0|2,0,0]=4 294 B15R0.164 CCCCOCCCNCCCSC(=O)C AIFCHEM-94560862158 [0,2,0,0,0,0|0,1,0]=3 295 B15R0.164 CCCNCCCCCCCCCC(=O)O AIFCHEM-5875365059 [0,2,0,0,0,0|2,0,0]=4 296 B15R0.164 CCNCCCCCCCCCCC(=O)O AIFCHEM-94537419056 [0,2,0,0,0,0|2,0,0]=4 297 B15R0.164 CCOCCNCCCCCCCC(=O)O AIFCHEM-94548608846 [0,2,0,0,0,0|2,0,0]=4 298 B15R0.164 CCSCCNCCCCCCCC(=O)O AIFCHEM-6081816444 [0,2,0,0,0,0|2,0,0]=4 299 B15R0.164 COCCCNCCCCCCCC(=O)O AIFCHEM-94598891953 [0,2,0,0,0,0|2,0,0]=4 300 B15R0.164 COCCNCCCCCCCCC(=O)O AIFCHEM-6038678637 [0,2,0,0,0,0|2,0,0]=4 301 B15R0.164 COCCOCCNCCCCOC(=O)C AIFCHEM-5796915891 [0,2,0,0,0,0|1,0,0]=3 302 B15R0.164 CSCCCNCCCCCCCC(=O)O AIFCHEM-94529056794 [0,2,0,0,0,0|2,0,0]=4 303 B15R0.164 CSCCCNCCCCCCNC(=O)O AIFCHEM-94546176660 [0,2,0,0,0,0|2,0,0]=4 304 B15R0.164 CSCCCNCCCCCCSC(=O)C AIFCHEM-94546193479 [0,2,0,0,0,0|0,1,0]=3 305 B15R0.164 CSCCNCCCCCCCCC(=O)O AIFCHEM-5848594551 [0,2,0,0,0,0|2,0,0]=4 306 B15R0.164 O=C(O)CCCCCCCCCNCCF AIFCHEM-5853585960 [0,2,0,0,0,0|2,0,0]=4 307 B15R0.164 O=C(O)CCCCCCCCCNCCO AIFCHEM-94577779581 [0,2,0,0,0,0|2,0,0]=4 308 B15R0.164 O=C(O)CCCCCCCCNCCCO AIFCHEM-94523162987 [0,2,0,0,0,0|2,0,0]=4 309 B15R0.164 O=C(O)CCCCCCCNCCCCO AIFCHEM-6511715173 [0,2,0,0,0,0|2,0,0]=4 310 B15R0.164 O=C(O)CCCCCCNCCCCCO AIFCHEM-94596324530 [0,2,0,0,0,0|2,0,0]=4 311 B15R0.210 CCCCC(=O)NCCCCCNC(=O)C AIFCHEM-94565858169 [0,2,0,0,0,0|1,0,1]=4 312 B15R0.210 CCCCC(C)NCCCCCCC(=O)O AIFCHEM-94596325399 [0,2,0,0,0,0|2,0,0]=4 313 B15R0.222 CC(C)CCNCCCCCCCC(=O)O AIFCHEM-6134517604 [0,2,0,0,0,0|2,0,0]=4 314 B15R0.222 CC(C)CNCCCCCCCCC(=O)O AIFCHEM-94572971589 [0,2,0,0,0,0|2,0,0]=4 315 B15R0.222 CC(O)CCNCCCCCCCC(=O)O AIFCHEM-94577738317 [0,2,0,0,0,0|2,0,0]=4 316 B15R0.222 CC(O)CNCCCCCCCCC(=O)O AIFCHEM-6417139548 [0,2,0,0,0,0|2,0,0]=4 317 B15R0.222 C[C@@H](O)CNCCCCCCCCC(=O)O AIFCHEM-6498934013 [0,2,0,0,0,0|2,0,0]=4 318 B15R0.222 C[C@H](O)CCNCCCCCCCC(=O)O AIFCHEM-94544716583 [0,2,0,0,0,0|2,0,0]=4 319 B15R0.222 C[C@H](O)CNCCCCCCCCC(=O)O AIFCHEM-6500576160 [0,2,0,0,0,0|2,0,0]=4 320 B13R1.119 CCCCCCCNC1CCOC1 AIFCHEM-94589464061 [1,0,0,1,0,0|1,0,1]=4 321 B13R1.119 CCCCCCCN[C@@H]1CCOC1 AIFCHEM-94589449443 [1,0,0,1,0,0|1,0,1]=4 322 B13R1.119 CCCCCCCN[C@H]1CCOC1 AIFCHEM-94589455469 [1,0,0,1,0,0|1,0,1]=4 323 B13R1.137 CCOCCNC1CCCC1CC AIFCHEM-94548606558 [1,0,0,1,0,0|1,0,1]=4 324 B13R1.555 CCOCCNC1CCCCC1C AIFCHEM-94548607122 [1,0,0,1,0,0|1,0,1]=4 325 B13R1.654 CCCCCCNC1CCOC1C AIFCHEM-94571764482 [1,0,0,1,0,0|1,0,1]=4 326 B13R1.1150 O=COCNC1CCCCCCC1 AIFCHEM-94595107191 [1,0,0,1,0,0|1,0,0]=3 327 B13R1.27 CCCCCNCC1CNC(=O)C1 AIFCHEM-94551426681 [1,0,0,1,0,0|2,0,0]=4 328 B13R1.27 O=C1C[C@@H](CO1)NCCCCCO AIFCHEM-6093010925 [1,0,0,1,0,0|2,0,0]=4 329 B13R1.27 O=C1C[C@H](CO1)NCCCCCO 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CC(=O)OCCCCN1CC[C@H]1C AIFCHEM-6261243735 [1,0,0,1,0,0|1,0,0]=3 343 B13R1.337 CC(=O)NCCCN1CCCCC1 AIFCHEM-94605352404 [1,0,0,1,0,0|2,0,0]=4 344 B13R1.337 CC(=O)OCCNC1CCCOC1 AIFCHEM-5640739178 [1,0,0,1,0,0|2,0,0]=4 345 B13R1.343 CC(=O)NCCCNC1CCCC1 AIFCHEM-94531732127 [1,0,0,1,0,0|2,0,0]=4 346 B13R1.380 CCCN1CCCCC1CC(=O)O AIFCHEM-94569014773 [1,0,0,1,0,0|2,0,0]=4 347 B13R1.392 CCCN1CCCC1CCC(=O)O AIFCHEM-94600406476 [1,0,0,1,0,0|2,0,0]=4 348 B13R1.586 CC(=O)OCCCCNC1CCC1 AIFCHEM-94537767266 [1,0,0,1,0,0|1,0,0]=3 349 B13R1.586 CC(=O)OCCCCNC1CSC1 AIFCHEM-5920308646 [1,0,0,1,0,0|2,0,0]=4 350 B13R1.670 CCCCCN1CCCC1C(=O)N AIFCHEM-94551431197 [1,0,0,1,0,0|2,0,0]=4 351 B13R1.670 CCCCCN1CCCC1C(=O)O AIFCHEM-94551435008 [1,0,0,1,0,0|2,0,0]=4 352 B13R1.670 CCCCCN1CCC[C@@H]1C(=O)N AIFCHEM-94551435294 [1,0,0,1,0,0|2,0,0]=4 353 B13R1.670 CCCCCN1CCC[C@@H]1C(=O)O AIFCHEM-94551432018 [1,0,0,1,0,0|2,0,0]=4 354 B13R1.670 CCCCCN1CCC[C@H]1C(=O)N AIFCHEM-94551433074 [1,0,0,1,0,0|2,0,0]=4 355 B13R1.670 CCCCCN1CCC[C@H]1C(=O)O AIFCHEM-94551427202 [1,0,0,1,0,0|2,0,0]=4 356 B13R1.1988 NC(=O)CCNC1CCCCCC1 AIFCHEM-94529615285 [1,0,0,1,0,0|2,0,0]=4 357 B13R1.2852 CCCCNC1CCC1OC(=O)C AIFCHEM-5745237493 [1,0,0,1,0,0|1,0,0]=3 358 B15R1.503 CC(=O)OCCC(C)NCC1CCOC1 AIFCHEM-5916239714 [0,1,0,1,0,0|2,0,0]=4 359 B15R1.503 CC(=O)OCCC(C)NC[C@@H]1CCOC1 AIFCHEM-94530315844 [0,1,0,1,0,0|2,0,0]=4 360 B15R1.503 CC(=O)OCCC(C)NC[C@H]1CCOC1 AIFCHEM-5992964139 [0,1,0,1,0,0|2,0,0]=4 361 B15R1.1081 CC(=O)OCCC(C)NC1CCOCC1 AIFCHEM-5611858884 [0,1,0,1,0,0|2,0,0]=4 362 B15R1.1950 CCCCCCCN1CCNC(=O)CC1 AIFCHEM-94519745005 [0,1,0,1,0,0|2,0,0]=4 363 B15R1.5876 CC(=O)OCCC(C)NC1CCCC1O AIFCHEM-94581020335 [0,1,0,1,0,0|2,0,0]=4 364 B15R1.5876 CC(=O)OCCC(C)N[C@@H]1CCC[C@H]1O AIFCHEM-94519721699 [0,1,0,1,0,0|2,0,0]=4 365 B15R1.5876 CC(=O)OCCC(C)N[C@H]1CCC[C@@H]1O AIFCHEM-6505107339 [0,1,0,1,0,0|2,0,0]=4 366 B15R1.5876 CC(=O)OCCC(C)N[C@H]1CCC[C@H]1O AIFCHEM-6456511883 [0,1,0,1,0,0|2,0,0]=4 367 B15R1.119 CC(=O)OCCCCN1CCCC(C1)C AIFCHEM-94534150850 [0,1,0,1,0,0|1,0,0]=3 368 B15R1.119 CC(=O)OCCCCN1CCCC(C1)F AIFCHEM-5704642961 [0,1,0,1,0,0|1,0,0]=3 369 B15R1.119 CC(=O)OCCCCN1CCC[C@@H](C1)C AIFCHEM-5940856947 [0,1,0,1,0,0|1,0,0]=3 370 B15R1.119 CC(=O)OCCCCN1CCOC(C1)O AIFCHEM-6462164128 [0,1,0,1,0,0|2,0,0]=4 371 B15R1.119 CC(=O)SCCCNC1CCCC(C1)C AIFCHEM-94560870058 [0,1,0,1,0,0|1,1,0]=4 372 B15R1.119 CC(=O)SCCCNC1CCCC(C1)O AIFCHEM-94599815379 [0,1,0,1,0,0|1,1,0]=4 373 B15R1.119 CC(=O)SCCCN[C@@H]1CCC[C@@H](C1)O AIFCHEM-94560864540 [0,1,0,1,0,0|1,1,0]=4 374 B15R1.119 CC(=O)SCCCN[C@@H]1CCC[C@H](C1)O AIFCHEM-94560862823 [0,1,0,1,0,0|1,1,0]=4 375 B15R1.119 CC(=O)SCCCN[C@H]1CCC[C@@H](C1)O AIFCHEM-94549108349 [0,1,0,1,0,0|1,1,0]=4 376 B15R1.119 CC(=O)SCCCN[C@H]1CCC[C@H](C1)O AIFCHEM-94560859451 [0,1,0,1,0,0|1,1,0]=4 377 B15R1.8900 O=C(O)NCCCCCCNCC1CC1 AIFCHEM-94538180165 [0,1,0,1,0,0|2,0,0]=4 378 B15R1.8918 CC(=O)OC1CCC1NCCOC(C)C AIFCHEM-6253591964 [0,1,0,1,0,0|2,0,0]=4 379 B15R1.8943 CC(=O)OCCNC1CCCCC1(C)C AIFCHEM-5620956722 [0,1,0,1,0,0|1,0,0]=3 380 B15R1.8972 CC(=O)OCCCCN1COCC1(C)C AIFCHEM-5710174690 [0,1,0,1,0,0|2,0,0]=4 381 B15R1.131 CC(=O)OCCCCN1CCCC[C@@H]1C AIFCHEM-94588086739 [0,1,0,1,0,0|0,0,0]=2 382 B15R1.131 CC(=O)OCCCCN1CCCC[C@H]1C AIFCHEM-5759741999 [0,1,0,1,0,0|0,0,0]=2 383 B15R1.131 CC(=O)OCCCCN1CCOCC1C AIFCHEM-94530732728 [0,1,0,1,0,0|1,0,0]=3 384 B15R1.131 CC(=O)OCCCCN1CCOC[C@@H]1C AIFCHEM-5720503809 [0,1,0,1,0,0|1,0,0]=3 385 B15R1.131 CC(=O)OCCCCN1CCOC[C@H]1C AIFCHEM-5612053725 [0,1,0,1,0,0|1,0,0]=3 386 B15R1.131 CC(=O)SCCCNC1CCCCC1C AIFCHEM-94560870251 [0,1,0,1,0,0|0,1,0]=3 387 B15R1.131 CC(=O)SCCCN[C@@H]1CCCC[C@@H]1C AIFCHEM-94605785679 [0,1,0,1,0,0|0,1,0]=3 388 B15R1.131 CC(=O)SCCCN[C@@H]1CCCC[C@H]1C AIFCHEM-94560866804 [0,1,0,1,0,0|0,1,0]=3 389 B15R1.131 CC(=O)SCCCN[C@H]1CCCC[C@H]1C AIFCHEM-94560871182 [0,1,0,1,0,0|0,1,0]=3 390 B15R1.131 CC1CCCCC1NCCCCC(=O)N AIFCHEM-5923172067 [0,1,0,1,0,0|2,0,0]=4 391 B15R1.504 CC(=O)NCCCCNC1CCCOC1 AIFCHEM-94585137925 [0,1,0,1,0,0|2,0,0]=4 392 B15R1.504 CC(=O)NCCCCNC1CCCSC1 AIFCHEM-94585136932 [0,1,0,1,0,0|2,0,0]=4 393 B15R1.504 CC(=O)NCCCCNC1CCOCC1 AIFCHEM-94585138946 [0,1,0,1,0,0|2,0,0]=4 394 B15R1.504 CC(=O)NCCCNCC1CCOCC1 AIFCHEM-94531735643 [0,1,0,1,0,0|2,0,0]=4 395 B15R1.504 CC(=O)NCCNCCC1CCCCC1 AIFCHEM-5976377805 [0,1,0,1,0,0|1,0,0]=3 396 B15R1.504 CC(=O)OCCCCNC1CCCCC1 AIFCHEM-94551500743 [0,1,0,1,0,0|0,0,0]=2 397 B15R1.504 CC(=O)OCCCCNC1CCSCC1 AIFCHEM-94574184175 [0,1,0,1,0,0|1,0,0]=3 398 B15R1.504 NC(=O)CCCCNCC1CCCCC1 AIFCHEM-5964713570 [0,1,0,1,0,0|2,0,0]=4 399 B15R1.504 O=C(O)CCCCNCC1CCCCC1 AIFCHEM-94585279871 [0,1,0,1,0,0|2,0,0]=4 400 B15R1.504 O=C(O)NCCNCCC1CCCCC1 AIFCHEM-94535747578 [0,1,0,1,0,0|2,0,0]=4 401 B15R1.2192 CC(=O)OC1CCC1NC(C)CCCO AIFCHEM-94575406529 [0,1,0,1,0,0|2,0,0]=4 402 B15R1.9080 CC(=O)NCCCCNC(C)C1CCC1 AIFCHEM-94585138982 [0,1,0,1,0,0|2,0,0]=4 403 B15R1.506 CC(=O)OCCCCN(C)C1CCOC1 AIFCHEM-6228603010 [0,1,0,1,0,0|2,0,0]=4 404 B15R1.506 CC(=O)OCCCCN(C)[C@@H]1CCOC1 AIFCHEM-5952111634 [0,1,0,1,0,0|2,0,0]=4 405 B15R1.506 CC(=O)SCCCNC(C)C1CCCC1 AIFCHEM-94560861513 [0,1,0,1,0,0|1,1,0]=4 406 B15R1.506 CC(=O)SCCCN[C@H](C)C1CCCC1 AIFCHEM-94560861022 [0,1,0,1,0,0|1,1,0]=4 407 B15R1.8958 CC(=O)NCCCNC1CCCCCC1 AIFCHEM-94531735605 [0,1,0,1,0,0|1,0,0]=3 408 B15R1.871 CC(=O)NCCCNC1CCC(CC1)C AIFCHEM-94531736180 [0,1,0,1,0,0|2,0,0]=4 409 B15R1.871 CC(=O)NCCCNC1CCC(CC1)O AIFCHEM-94531732622 [0,1,0,1,0,0|2,0,0]=4 410 B15R1.871 CC(=O)OCCCCN1CCC(CC1)O AIFCHEM-6510276836 [0,1,0,1,0,0|1,0,0]=3 411 B15R1.8881 CC(=O)SCCCCCCNC1COC1 AIFCHEM-6278767403 [0,1,0,1,0,0|1,1,0]=4 412 B15R1.8881 O=C(O)NCCCCCCNC1CCC1 AIFCHEM-94576047692 [0,1,0,1,0,0|2,0,0]=4 413 B15R1.34 O=C1CC(CN1)NCCCCCCCO AIFCHEM-6469402868 [0,1,0,1,0,0|2,0,0]=4 414 B15R1.251 CCCCCNC1CCCC1C(=O)OC AIFCHEM-94522649979 [0,1,0,1,0,0|2,0,0]=4 415 B15R1.251 CCCCCN[C@H]1CCC[C@H]1C(=O)OC AIFCHEM-94551424630 [0,1,0,1,0,0|2,0,0]=4 416 B15R1.1091 CCC(=O)NCCNC1CCCCC1C AIFCHEM-94532526775 [0,1,0,1,0,0|2,0,0]=4 417 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[0,1,0,1,0,0|2,0,0]=4 442 B15R1.82 CCCCCCC(C)N[C@H]1CNC(=O)C1 AIFCHEM-6087774382 [0,1,0,1,0,0|2,0,0]=4 443 B15R1.82 CCCCCC[C@@H](C)NC1CNC(=O)C1 AIFCHEM-6155223240 [0,1,0,1,0,0|2,0,0]=4 444 B15R1.82 CCCCCC[C@H](C)NC1CNC(=O)C1 AIFCHEM-5877493990 [0,1,0,1,0,0|2,0,0]=4 445 B15R1.497 CC(=O)NCCNC(C)C1CCCCC1 AIFCHEM-5921093088 [0,1,0,1,0,0|2,0,0]=4 446 B15R1.497 CC(=O)OCCCC(C)N1CCCOC1 AIFCHEM-5688404277 [0,1,0,1,0,0|2,0,0]=4 447 B15R1.497 CC(=O)OCCCC(C)N1CCSCC1 AIFCHEM-6085833918 [0,1,0,1,0,0|2,0,0]=4 448 B15R1.507 CC(=O)OCCCC(C)NC1CCCC1 AIFCHEM-94542377062 [0,1,0,1,0,0|1,0,0]=3 449 B15R1.1651 CC(=O)OCCCC(C)N1CC[C@@H]1CO AIFCHEM-94554358179 [0,1,0,1,0,0|2,0,0]=4 450 B15R1.1651 CC(=O)OCCCC(C)N1CC[C@H]1CO AIFCHEM-94538003043 [0,1,0,1,0,0|2,0,0]=4 451 B15R2.31 O=C1CN(CCN1)CC2CCCCC2 AIFCHEM-5764655742 [0,0,0,2,0,0|2,0,0]=4 452 B15R2.119 CCC1CCCC1NC2CNC(=O)C2 AIFCHEM-5691056128 [0,0,0,2,0,0|2,0,0]=4 453 B15R2.16181 CC(=O)SCCCN1C2CCC1CC2 AIFCHEM-94560865246 [0,0,0,2,0,0|1,1,0]=4 454 B15R2.283 O=C1C[C@H](CO1)NCC2CCCCC2 AIFCHEM-5599159341 [0,0,0,2,0,0|1,0,0]=3 455 B15R2.6962 O=C1CC(CN1)NC2CCCCCC2 AIFCHEM-5613926991 [0,0,0,2,0,0|2,0,0]=4 456 B15R2.6962 O=C1C[C@H](CN1)NC2CCCCCC2 AIFCHEM-94529608337 [0,0,0,2,0,0|2,0,0]=4 457 B15R2.68399 CC(=O)OCCNC1CCCC2C1C2 AIFCHEM-5621008652 [0,0,0,2,0,0|1,0,0]=3 458 B15R2.8461 CC(=O)OC1CCC1N2CCCC2C AIFCHEM-5762940675 [0,0,0,2,0,0|1,0,0]=3 459 B15R2.8461 CC(=O)OC1CCC1N2CCC[C@@H]2C AIFCHEM-5642284677 [0,0,0,2,0,0|1,0,0]=3 460 B15R2.8461 CC(=O)OC1CCC1N2CCC[C@H]2C AIFCHEM-6077847654 [0,0,0,2,0,0|1,0,0]=3 461 B15R2.68602 CC(=O)NCCCNC1CCC2C1C2 AIFCHEM-94531735293 [0,0,0,2,0,0|2,0,0]=4 462 B15R2.14858 CC(=O)OC1CCC1NC[C@@H]2C[C@H]2C AIFCHEM-94599415286 [0,0,0,2,0,0|1,0,0]=3 463 B15R2.68401 CC(=O)SCCCN1CCC12CCC2 AIFCHEM-94560861585 [0,0,0,2,0,0|1,1,0]=4 464 B15R2.1223 CC(=O)OC1CCC1N2CCCOC2 AIFCHEM-5765949965 [0,0,0,2,0,0|2,0,0]=4 465 B15R2.1254 CC(=O)OC1CCC1NC2CCCC2 AIFCHEM-94542374702 [0,0,0,2,0,0|1,0,0]=3 466 B15R2.7273 O=C1CN(CCCN1)CC2CCCC2 AIFCHEM-5698508622 [0,0,0,2,0,0|2,0,0]=4