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m_7__5819074__102708 [0,1,0,0,0,0|1,1,0]=3 214 B8R0.1 CC=CCN(C)CCO m_2230__679202__681024 [0,1,0,0,0,0|1,0,2]=4 215 B8R0.1 CC=CCS(=O)CCO m_265282__7088216__4272774 [0,1,0,0,0,0|0,1,2]=4 216 B8R0.1 CCCC(=O)CSCC m_7__22987770__22788358 [0,1,0,0,0,0|3,0,0]=4 217 B8R0.1 CCCC(=O)NCCF m_270062__12127092__17814498 [0,1,0,0,0,0|2,0,1]=4 218 B8R0.1 CCCC(=O)NCCN m_270006__11615266__8405102 [0,1,0,0,0,0|2,0,1]=4 219 B8R0.1 CCCC(=O)NCCO m_270062__7594790__17814498 [0,1,0,0,0,0|1,0,1]=3 220 B8R0.1 CCCC(=O)OCC#N m_1458__473330__483934 [0,1,0,0,0,0|1,0,2]=4 221 B8R0.1 CCCC(=O)OCCF m_276436__14078274__14088342 [0,1,0,0,0,0|1,0,1]=3 222 B8R0.1 CCCC(=O)OCCO m_1458__473330__485506 [0,1,0,0,0,0|0,0,1]=2 223 B8R0.1 CCCC(=O)OCOC m_1458__473330__484704 [0,1,0,0,0,0|2,0,1]=4 224 B8R0.1 CCCC(C)CNCC m_270004__18902466__24715004 [0,1,0,0,0,0|3,0,0]=4 225 B8R0.1 CCCC(C)NCC#N m_2230__22397382__680932 [0,1,0,0,0,0|2,0,1]=4 226 B8R0.1 CCCC(C)NCCF m_2230__22397382__22320836 [0,1,0,0,0,0|2,0,0]=3 227 B8R0.1 CCCC(C)NCCN m_272690__11349186__11346328 [0,1,0,0,0,0|2,0,0]=3 228 B8R0.1 CCCC(C)NCCO m_2230__22397382__6165700 [0,1,0,0,0,0|1,0,0]=2 229 B8R0.1 CCCC(C)SCC#N m_7__14428530__5055 [0,1,0,0,0,0|1,1,1]=4 230 B8R0.1 CCCC(C)SCCF m_7__14428530__22320828 [0,1,0,0,0,0|1,1,0]=3 231 B8R0.1 CCCC(C)SCCN m_7__20871276__6493860 [0,1,0,0,0,0|1,1,0]=3 232 B8R0.1 CCCC(C)SCCO m_7__14428530__102708 [0,1,0,0,0,0|0,1,0]=2 233 B8R0.1 CCCC(C)SCOC m_7__14428530__6762 [0,1,0,0,0,0|2,1,0]=4 234 B8R0.1 CCCC(C)SCSC m_7__14428530__10542644 [0,1,0,0,0,0|2,1,0]=4 235 B8R0.1 CCCC(O)CSCC m_7__22987770__15745978 [0,1,0,0,0,0|3,0,0]=4 236 B8R0.1 CCCCC(=O)NCC m_22__57815__303718 [0,1,0,0,0,0|3,0,0]=4 237 B8R0.1 CCCCC(=O)OCC m_1458__473328__1327610 [0,1,0,0,0,0|3,0,0]=4 238 B8R0.1 CCCCC(C)NCC m_2230__22399858__22383854 [0,1,0,0,0,0|3,0,0]=4 239 B8R0.1 CCCCN(C)CC#N m_2230__3014482__22993830 [0,1,0,0,0,0|2,0,1]=4 240 B8R0.1 CCCCN(C)CCC m_2230__2261920__22993830 [0,1,0,0,0,0|2,0,0]=3 241 B8R0.1 CCCCN(C)CCF m_2230__665312__22320836 [0,1,0,0,0,0|2,0,0]=3 242 B8R0.1 CCCCN(C)CCN m_269982__7368932__14439794 [0,1,0,0,0,0|2,0,0]=3 243 B8R0.1 CCCCN(C)CCO m_2230__3225028__2463448 [0,1,0,0,0,0|1,0,0]=2 244 B8R0.1 CCCN(C)CCCF m_2230__2261920__16896936 [0,1,0,0,0,0|3,0,0]=4 245 B8R0.1 CCCN(C)CCCN m_269982__11965286__13271120 [0,1,0,0,0,0|3,0,0]=4 246 B8R0.1 CCCN(C)CCCO m_2230__2261920__680950 [0,1,0,0,0,0|2,0,0]=3 247 B8R0.1 CCCN(C)CCNC m_269982__10880304__13271120 [0,1,0,0,0,0|3,0,0]=4 248 B8R0.1 CCCN(C)CCOC m_2230__2261920__666874 [0,1,0,0,0,0|3,0,0]=4 249 B8R0.1 CCCN(C)CCSC m_2230__2261920__681390 [0,1,0,0,0,0|3,0,0]=4 250 B8R0.1 CCCNC(=O)CCBr m_270062__7595096__20844442 [0,1,0,0,0,0|3,0,0]=4 251 B8R0.1 CCCNC(=O)CCC m_270062__7595096__17814498 [0,1,0,0,0,0|2,0,1]=4 252 B8R0.1 CCCNC(=O)CCN m_270006__8378850__10478302 [0,1,0,0,0,0|3,0,0]=4 253 B8R0.1 CCCNC(=O)CCO m_487__150753__12879784 [0,1,0,0,0,0|2,0,0]=3 254 B8R0.1 CCCNC(C)CCC m_269862__7192572__7200560 [0,1,0,0,0,0|2,0,0]=3 255 B8R0.1 CCCNC(C)CCN m_269982__22505446__13271120 [0,1,0,0,0,0|3,0,0]=4 256 B8R0.1 CCCNC(C)CCO m_2230__22400640__13271112 [0,1,0,0,0,0|2,0,0]=3 257 B8R0.1 CCCNC(C)CNC m_269982__22505308__13271120 [0,1,0,0,0,0|3,0,0]=4 258 B8R0.1 CCCNC(C)COC m_270004__8288780__8844972 [0,1,0,0,0,0|3,0,0]=4 259 B8R0.1 CCCNC(C)CSC m_269862__7192572__16464016 [0,1,0,0,0,0|3,0,0]=4 260 B8R0.1 CCCN[C@H](C)CCF m_2230__22404666__13271112 [0,1,0,0,0,0|3,0,0]=4 261 B8R0.1 CCCN[C@H](C)COC m_2230__22399844__13271112 [0,1,0,0,0,0|3,0,0]=4 262 B8R0.1 CCCOC(=O)CCC m_276436__14076550__14088342 [0,1,0,0,0,0|1,0,1]=3 263 B8R0.1 CCCOC(=O)CCF m_276436__14076550__14107760 [0,1,0,0,0,0|2,0,1]=4 264 B8R0.1 CCCOC(=O)COC m_1458__473580__13271110 [0,1,0,0,0,0|2,0,1]=4 265 B8R0.1 CCCOC(=O)NCC m_282070__22190848__22151414 [0,1,0,0,0,0|2,0,1]=4 266 B8R0.1 CCCSC(C)CCC m_62__875778__10638528 [0,1,0,0,0,0|1,1,0]=3 267 B8R0.1 CCCSC(C)CCO m_7__22986886__14772890 [0,1,0,0,0,0|2,0,0]=3 268 B8R0.1 CCCSC(C)COC m_7__22986886__6339266 [0,1,0,0,0,0|2,1,0]=4 269 B8R0.1 CCCSC(C)OCC m_7__22986886__13420948 [0,1,0,0,0,0|2,1,0]=4 270 B8R0.1 CCNC(=NCCO)N m_264822__3499788__3499528 [0,1,0,0,0,0|2,0,1]=4 271 B8R0.1 CCNC(=O)NCCO m_487__150669__16733542 [0,1,0,0,0,0|2,0,1]=4 272 B8R0.1 CCNC(=O)OCCF m_282070__22190848__22151794 [0,1,0,0,0,0|2,0,1]=4 273 B8R0.1 CCNC(C)CCCCl m_270004__8160850__24722580 [0,1,0,0,0,0|3,0,0]=4 274 B8R0.1 CCNC(C)CCCN m_269982__22505332__7393392 [0,1,0,0,0,0|3,0,0]=4 275 B8R0.1 CCNC(C)CCCO m_2230__22399382__22383854 [0,1,0,0,0,0|2,0,0]=3 276 B8R0.1 CCNCC(C)CCO m_270004__8297522__24715004 [0,1,0,0,0,0|2,0,0]=3 277 B8R0.1 CCOC(=O)NCCO m_282070__22205922__22150950 [0,1,0,0,0,0|2,0,1]=4 278 B8R0.1 CCOC(C)SCCN m_7__20871276__13420948 [0,1,0,0,0,0|2,1,0]=4 279 B8R0.1 CCOC(C)SCCO m_7__128807__13420948 [0,1,0,0,0,0|1,1,0]=3 280 B8R0.1 CCON=C(C)CCO m_4__158181__6671990 [0,1,0,0,0,0|3,0,0]=4 281 B8R0.1 CCON=C(N)CCO m_34__8845210__7791662 [0,1,0,0,0,0|3,0,0]=4 282 B8R0.1 CCONC(=O)CCO m_487__219588__12879784 [0,1,0,0,0,0|3,0,0]=4 283 B8R0.1 CCSC(C)CCCF m_7__22987770__19259364 [0,1,0,0,0,0|3,0,0]=4 284 B8R0.1 CCSC(C)CCCO m_7__22987770__10804146 [0,1,0,0,0,0|2,0,0]=3 285 B8R0.1 CCSC(Cl)CCCBr m_62__23915478__6469026 [0,1,0,0,0,0|3,0,0]=4 286 B8R0.1 CCSCC(=CCO)C m_7__22987770__20765532 [0,1,0,0,0,0|2,0,1]=4 287 B8R0.1 CN(CCF)CCCF m_2230__13040470__22320836 [0,1,0,0,0,0|3,0,0]=4 288 B8R0.1 CN(CCF)CCCN m_269982__11965286__22320816 [0,1,0,0,0,0|3,0,0]=4 289 B8R0.1 CN(CCF)CCCO m_2230__9787816__22320836 [0,1,0,0,0,0|3,0,0]=4 290 B8R0.1 CN(CCN)CCCF m_269982__10894792__16896944 [0,1,0,0,0,0|3,0,0]=4 291 B8R0.1 CN(CCN)CCCN m_269982__11965286__14439794 [0,1,0,0,0,0|3,0,0]=4 292 B8R0.1 CN(CCN)CCCO m_269982__17669188__14439794 [0,1,0,0,0,0|3,0,0]=4 293 B8R0.1 CN(CCO)CCC#N m_2230__6737726__6165700 [0,1,0,0,0,0|2,0,1]=4 294 B8R0.1 CN(CCO)CCCF m_2230__13040470__6165700 [0,1,0,0,0,0|2,0,0]=3 295 B8R0.1 CN(CCO)CCCN m_269982__22515300__10880302 [0,1,0,0,0,0|2,0,0]=3 296 B8R0.1 CN(CCO)CCCO 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[0,1,0,0,0,0|3,0,0]=4 730 B8R0.6 CON(C)CCCCO m_2230__679026__3191342 [0,1,0,0,0,0|3,0,0]=4 731 B8R0.6 CSC(=O)CSCCO m_7__128807__19493736 [0,1,0,0,0,0|1,1,1]=4 732 B8R0.6 CSCCNC(=O)CO m_22__11946668__7941800 [0,1,0,0,0,0|2,0,1]=4 733 B8R0.6 CSCCNC(C)CCl m_2230__22399894__681390 [0,1,0,0,0,0|3,0,0]=4 734 B8R0.6 CSCCNC(C)CO m_269862__11963794__15157990 [0,1,0,0,0,0|2,0,0]=3 735 B8R0.6 CSCCN[C@H](C)CF m_2230__22399906__681390 [0,1,0,0,0,0|3,0,0]=4 736 B8R0.6 CSCCN[C@H](C)CO m_2230__22399532__681390 [0,1,0,0,0,0|2,0,0]=3 737 B8R0.6 CSCCSC(C)CO m_7__6338928__7912552 [0,1,0,0,0,0|1,1,0]=3 738 B8R0.6 CSCCS[C@@H](C)CN m_7__20871330__7912552 [0,1,0,0,0,0|2,1,0]=4 739 B8R0.6 CSCSCC(C)CO m_7__6078536__10542644 [0,1,0,0,0,0|3,0,0]=4 740 B8R0.6 CSCSCC(O)CO m_7__6554250__10542644 [0,1,0,0,0,0|3,0,0]=4 741 B8R0.6 C[C@@H](CN)SCCCF m_7__20871330__16896928 [0,1,0,0,0,0|2,1,0]=4 742 B8R0.6 C[C@@H](CN)SCCCO m_7__20871330__6354 [0,1,0,0,0,0|2,1,0]=4 743 B8R0.6 C[C@H](CF)NCCCF m_2230__22399906__16896936 [0,1,0,0,0,0|3,0,0]=4 744 B8R0.6 C[C@H](CF)NCCCO m_2230__22399906__680950 [0,1,0,0,0,0|3,0,0]=4 745 B8R0.6 C[C@H](CN)NCCCF m_269982__22505378__16896944 [0,1,0,0,0,0|3,0,0]=4 746 B8R0.6 C[C@H](CN)NCCCN m_269982__22505378__10880302 [0,1,0,0,0,0|3,0,0]=4 747 B8R0.6 C[C@H](CN)NCCCO m_269982__22505378__22497532 [0,1,0,0,0,0|3,0,0]=4 748 B8R0.6 C[C@H](CO)NCCC#N m_273610__11554128__11515974 [0,1,0,0,0,0|2,0,1]=4 749 B8R0.6 C[C@H](CO)NCCCF m_2230__22399532__16896936 [0,1,0,0,0,0|2,0,0]=3 750 B8R0.6 C[C@H](CO)NCCCO m_2230__22399532__680950 [0,1,0,0,0,0|2,0,0]=3 751 B8R0.6 N#CC(Br)CSCCO m_7__128807__22787952 [0,1,0,0,0,0|1,1,1]=4 752 B8R0.6 N#CC(Cl)CSCCO m_7__128807__22787506 [0,1,0,0,0,0|1,1,1]=4 753 B8R0.6 NCC(=O)NOCCO m_240690__17027340__3025698 [0,1,0,0,0,0|2,0,1]=4 754 B8R0.6 NCCCNC(=O)CO m_240690__7347332__17025660 [0,1,0,0,0,0|2,0,1]=4 755 B8R0.6 NCCSCC(O)CF m_7__20871276__13890448 [0,1,0,0,0,0|2,1,0]=4 756 B8R0.6 NCCSCC(O)CO m_7__20871276__22141028 [0,1,0,0,0,0|2,1,0]=4 757 B8R0.6 O=C(CO)NCCCF m_22__17065554__7941800 [0,1,0,0,0,0|2,0,1]=4 758 B8R0.6 O=C(CO)NCCCO m_22__564320__7941800 [0,1,0,0,0,0|2,0,1]=4 759 B8R0.6 O=C(CO)NOCCO m_22__8989546__7941800 [0,1,0,0,0,0|2,0,1]=4 760 B8R0.6 OCC(O)CSCCF m_7__6554250__22320828 [0,1,0,0,0,0|2,1,0]=4 761 B8R0.6 OCCNC[C@H](O)CF m_273610__11554104__14323916 [0,1,0,0,0,0|2,0,0]=3 762 B8R0.6 OCCSCC(O)CF m_7__128807__13890448 [0,1,0,0,0,0|1,1,0]=3 763 B8R0.6 OCCSCC(O)CO m_7__6554250__102708 [0,1,0,0,0,0|1,1,0]=3 764 B8R0.6 O[C@H](CF)CNCCF m_273610__13857118__14323916 [0,1,0,0,0,0|3,0,0]=4 765 B8R0.7 C#CCCNCC(C)O m_273610__13857716__11516404 [0,1,0,0,0,0|1,0,2]=4 766 B8R0.7 C#CCCSCC(C)O m_7__10953796__18060656 [0,1,0,0,0,0|0,1,2]=4 767 B8R0.7 C#CCOCCN(C)C m_2230__7913120__2463448 [0,1,0,0,0,0|2,0,1]=4 768 B8R0.7 C#CCSCCC(C)C m_7__22987856__6266 [0,1,0,0,0,0|1,1,1]=4 769 B8R0.7 C#CCSCCC(C)N m_7__20871360__6266 [0,1,0,0,0,0|1,1,1]=4 770 B8R0.7 C=C(Br)CCSCCO m_62__15782476__10178562 [0,1,0,0,0,0|0,1,2]=4 771 B8R0.7 C=C(Br)CSCCCC m_7__22602174__131272 [0,1,0,0,0,0|1,1,1]=4 772 B8R0.7 C=C(C)CCSCCC m_62__10158742__875868 [0,1,0,0,0,0|1,1,1]=4 773 B8R0.7 C=C(C)CCSCCN m_7__20871276__10158738 [0,1,0,0,0,0|1,1,1]=4 774 B8R0.7 C=C(C)CCSCCO m_62__10158742__10178562 [0,1,0,0,0,0|0,1,1]=3 775 B8R0.7 C=C(C)CSCCCC m_62__6464432__7021588 [0,1,0,0,0,0|1,1,1]=4 776 B8R0.7 C=C(C)CSCCCO m_7__10972294__5949 [0,1,0,0,0,0|2,0,1]=4 777 B8R0.7 C=C(Cl)CSCCCC m_62__875776__11986396 [0,1,0,0,0,0|1,1,1]=4 778 B8R0.7 C=C(F)CSCCCC m_62__875776__17849118 [0,1,0,0,0,0|1,1,1]=4 779 B8R0.7 C=C(I)CSCCCC m_62__875776__18682540 [0,1,0,0,0,0|1,1,1]=4 780 B8R0.7 C=CCCNCC(C)O m_273610__12100308__11516404 [0,1,0,0,0,0|1,0,2]=4 781 B8R0.7 C=CCCSCC(C)O m_7__10953796__8929468 [0,1,0,0,0,0|0,1,2]=4 782 B8R0.7 C=CCNCCC(C)C m_207__109489__134014 [0,1,0,0,0,0|2,0,1]=4 783 B8R0.7 C=CCOCCN(C)C m_2230__17631526__2463448 [0,1,0,0,0,0|2,0,1]=4 784 B8R0.7 C=CCONCC(C)O m_273610__11530144__11516404 [0,1,0,0,0,0|2,0,1]=4 785 B8R0.7 C=CCSCCC(C)C m_62__7021584__8363982 [0,1,0,0,0,0|1,1,1]=4 786 B8R0.7 C=CCSCCC(C)F m_62__13165346__8363982 [0,1,0,0,0,0|1,1,1]=4 787 B8R0.7 C=CCSCCC(C)N m_34__20871470__7343510 [0,1,0,0,0,0|1,1,1]=4 788 B8R0.7 C=CCSCCC(C)O m_62__12057938__8363982 [0,1,0,0,0,0|1,1,1]=4 789 B8R0.7 CC#CCNCC(C)O m_273610__13857826__11516404 [0,1,0,0,0,0|1,0,2]=4 790 B8R0.7 CC#CCSCC(C)O m_7__10953796__5631254 [0,1,0,0,0,0|0,1,2]=4 791 B8R0.7 CC(=CCSCCO)C m_62__12201838__10178562 [0,1,0,0,0,0|0,1,2]=4 792 B8R0.7 CC(=CCSCCO)Cl m_7__128807__12215356 [0,1,0,0,0,0|0,1,2]=4 793 B8R0.7 CC(=O)CCSCCN m_7__20871276__107330 [0,1,0,0,0,0|1,1,1]=4 794 B8R0.7 CC(=O)CCSCCO m_7__128807__107330 [0,1,0,0,0,0|0,1,1]=3 795 B8R0.7 CC(=O)CSCCCO m_7__10972294__5065 [0,1,0,0,0,0|2,0,1]=4 796 B8R0.7 CC(=O)NCCCCO m_270062__16411702__15585492 [0,1,0,0,0,0|2,0,1]=4 797 B8R0.7 CC(=O)OCCCCO m_1458__473186__4858290 [0,1,0,0,0,0|2,0,1]=4 798 B8R0.7 CC(=O)OCSCCO m_7__128807__20618926 [0,1,0,0,0,0|1,1,1]=4 799 B8R0.7 CC(C)C=NOCCF m_34__19446766__22320830 [0,1,0,0,0,0|2,0,1]=4 800 B8R0.7 CC(C)CCCC=NO m_4__388124__12206620 [0,1,0,0,0,0|2,0,1]=4 801 B8R0.7 CC(C)CCNCCF m_207__18491578__134014 [0,1,0,0,0,0|2,0,0]=3 802 B8R0.7 CC(C)CCNCCO m_207__121484__134014 [0,1,0,0,0,0|1,0,0]=2 803 B8R0.7 CC(C)CCSCC#N m_7__22987856__5055 [0,1,0,0,0,0|1,1,1]=4 804 B8R0.7 CC(C)CCSCCF m_7__22987856__22320828 [0,1,0,0,0,0|1,1,0]=3 805 B8R0.7 CC(C)CCSCCN m_7__20871276__102951 [0,1,0,0,0,0|1,1,0]=3 806 B8R0.7 CC(C)CCSCCO m_7__22987856__102708 [0,1,0,0,0,0|0,1,0]=2 807 B8R0.7 CC(C)CNCCCF m_207__17065564__121216 [0,1,0,0,0,0|3,0,0]=4 808 B8R0.7 CC(C)CNCCCO m_207__109475__121216 [0,1,0,0,0,0|2,0,0]=3 809 B8R0.7 CC(C)CSCCCF m_7__27301__16896928 [0,1,0,0,0,0|2,1,0]=4 810 B8R0.7 CC(C)CSCCCN m_7__20871288__1010132 [0,1,0,0,0,0|2,1,0]=4 811 B8R0.7 CC(C)CSCCCO m_7__27301__6354 [0,1,0,0,0,0|2,0,0]=3 812 B8R0.7 CC(C)NCC=CCO m_269862__11971552__7204804 [0,1,0,0,0,0|2,0,1]=4 813 B8R0.7 CC(C)NCCCCCl m_270004__23845338__24721168 [0,1,0,0,0,0|3,0,0]=4 814 B8R0.7 CC(C)NCCCCF m_269862__10390194__7204804 [0,1,0,0,0,0|3,0,0]=4 815 B8R0.7 CC(C)NCCCCO m_269862__9433176__7204804 [0,1,0,0,0,0|2,0,0]=3 816 B8R0.7 CC(C)SCC#CCO m_62__2390328__15141012 [0,1,0,0,0,0|2,0,1]=4 817 B8R0.7 CC(C)SCCCCF m_62__2390328__10157916 [0,1,0,0,0,0|3,0,0]=4 818 B8R0.7 CC(C)SCCCCN m_34__20871448__6950544 [0,1,0,0,0,0|3,0,0]=4 819 B8R0.7 CC(C)SCCCCO m_7__22849690__5048 [0,1,0,0,0,0|2,0,0]=3 820 B8R0.7 CC(C)SCSCCN m_7__20871276__12306378 [0,1,0,0,0,0|2,1,0]=4 821 B8R0.7 CC(C)SCSCCO m_7__128807__12306378 [0,1,0,0,0,0|1,1,0]=3 822 B8R0.7 CC(F)CCSCCN m_7__20871276__13165340 [0,1,0,0,0,0|1,1,0]=3 823 B8R0.7 CC(F)CCSCCO m_62__13165346__10178562 [0,1,0,0,0,0|0,1,0]=2 824 B8R0.7 CC(F)CSCCCN m_7__20871288__16970746 [0,1,0,0,0,0|2,1,0]=4 825 B8R0.7 CC(F)CSCCCO m_7__10972294__16970746 [0,1,0,0,0,0|2,0,0]=3 826 B8R0.7 CC(N)CCSCC#N m_7__20871360__5055 [0,1,0,0,0,0|1,1,1]=4 827 B8R0.7 CC(N)CCSCCF m_34__20871470__22320830 [0,1,0,0,0,0|1,1,0]=3 828 B8R0.7 CC(N)CCSCCO m_7__20871360__102708 [0,1,0,0,0,0|0,1,0]=2 829 B8R0.7 CC(O)CCSCCN m_7__20871276__12057932 [0,1,0,0,0,0|1,1,0]=3 830 B8R0.7 CC(O)CCSCCO m_62__12057938__10178562 [0,1,0,0,0,0|0,1,0]=2 831 B8R0.7 CC(O)CNCCC#N m_273610__11554114__11515974 [0,1,0,0,0,0|2,0,1]=4 832 B8R0.7 CC(O)CNCCCF m_273610__17065614__11516404 [0,1,0,0,0,0|2,0,0]=3 833 B8R0.7 CC(O)CNCCCO m_273610__11554108__11516404 [0,1,0,0,0,0|2,0,0]=3 834 B8R0.7 CC(O)CSCCC#N m_7__10953802__10902704 [0,1,0,0,0,0|1,1,1]=4 835 B8R0.7 CC(O)CSCCCF m_63__17315394__10903854 [0,1,0,0,0,0|1,1,0]=3 836 B8R0.7 CC(O)CSCCCN m_7__20871288__10902704 [0,1,0,0,0,0|1,1,0]=3 837 B8R0.7 CC(O)CSCCCO m_7__10953796__6354 [0,1,0,0,0,0|1,1,0]=3 838 B8R0.7 CC=CCNCC(C)O m_273610__14317906__11516404 [0,1,0,0,0,0|1,0,2]=4 839 B8R0.7 CCC=NOCC(C)C m_34__17309904__6894142 [0,1,0,0,0,0|2,0,1]=4 840 B8R0.7 CCC=NOCC(C)F m_34__17309904__16970748 [0,1,0,0,0,0|2,0,1]=4 841 B8R0.7 CCCCCCC(=O)N m_22__58357__335768 [0,1,0,0,0,0|1,0,2]=4 842 B8R0.7 CCCCCCN(C)C m_2230__22406770__2463448 [0,1,0,0,0,0|3,0,0]=4 843 B8R0.7 CCCCCCS(=O)C m_265282__18991470__4273530 [0,1,0,0,0,0|2,0,1]=4 844 B8R0.7 CCCCCNC(C)C m_269862__7192702__7204804 [0,1,0,0,0,0|3,0,0]=4 845 B8R0.7 CCCCCSC(C)C m_62__2390328__5063392 [0,1,0,0,0,0|3,0,0]=4 846 B8R0.7 CCCCNCC(C)C m_207__109452__121216 [0,1,0,0,0,0|2,0,0]=3 847 B8R0.7 CCCCNCC(C)O m_273610__13857014__11516404 [0,1,0,0,0,0|1,0,0]=2 848 B8R0.7 CCCCOCC(=O)N m_22__58357__5125250 [0,1,0,0,0,0|0,0,2]=3 849 B8R0.7 CCCCONC(=O)C m_270062__21889570__15585492 [0,1,0,0,0,0|1,0,2]=4 850 B8R0.7 CCCCSCC(=O)N m_7__10975714__131272 [0,1,0,0,0,0|0,1,2]=4 851 B8R0.7 CCCCSCC(=O)O m_7__26823__131272 [0,1,0,0,0,0|0,1,1]=3 852 B8R0.7 CCCCSCC(C)C m_7__27301__770176 [0,1,0,0,0,0|1,1,0]=3 853 B8R0.7 CCCCSCC(C)F m_62__875776__16913488 [0,1,0,0,0,0|1,1,0]=3 854 B8R0.7 CCCCSCC(C)O m_7__10953796__770176 [0,1,0,0,0,0|0,1,0]=2 855 B8R0.7 CCCCSCC(F)F m_7__22987700__770176 [0,1,0,0,0,0|1,1,0]=3 856 B8R0.7 CCCCSC[C@H](C)N m_7__20871336__131272 [0,1,0,0,0,0|1,1,0]=3 857 B8R0.7 CCCNCCC(C)C m_207__109413__134014 [0,1,0,0,0,0|2,0,0]=3 858 B8R0.7 CCCOCCC(=O)N m_22__58357__16471828 [0,1,0,0,0,0|2,0,1]=4 859 B8R0.7 CCCON=CC(C)C m_4__11573770__7831602 [0,1,0,0,0,0|2,0,1]=4 860 B8R0.7 CCCSCCC(=O)C m_7__22986886__107330 [0,1,0,0,0,0|1,1,1]=4 861 B8R0.7 CCCSCCC(C)C m_62__7021584__875868 [0,1,0,0,0,0|1,1,0]=3 862 B8R0.7 CCCSCCC(C)F m_62__13165346__875868 [0,1,0,0,0,0|1,1,0]=3 863 B8R0.7 CCCSCCC(C)N m_34__20871470__13271108 [0,1,0,0,0,0|1,1,0]=3 864 B8R0.7 CCCSCCC(C)O m_62__12057938__875868 [0,1,0,0,0,0|1,1,0]=3 865 B8R0.7 CCCSCCC(F)F m_7__22986868__14390332 [0,1,0,0,0,0|2,1,0]=4 866 B8R0.7 CCCSCCN(C)C m_7__22986886__391100 [0,1,0,0,0,0|2,1,0]=4 867 B8R0.7 CCCSCCS(=O)C m_7__22986886__11566584 [0,1,0,0,0,0|2,1,0]=4 868 B8R0.7 CCCSCSC(C)C m_7__22986886__12306378 [0,1,0,0,0,0|2,1,0]=4 869 B8R0.7 CCNCCCC(C)C m_207__121480__7912414 [0,1,0,0,0,0|3,0,0]=4 870 B8R0.7 CCNCCCC(C)O m_270004__9448698__24715004 [0,1,0,0,0,0|2,0,0]=3 871 B8R0.7 CCNCCCC(F)F m_270004__13135948__24715004 [0,1,0,0,0,0|3,0,0]=4 872 B8R0.7 CCOCSCC(=O)O m_7__26823__10176980 [0,1,0,0,0,0|1,1,1]=4 873 B8R0.7 CCOCSCC(C)C m_7__27301__10176980 [0,1,0,0,0,0|2,1,0]=4 874 B8R0.7 CCOCSCC(C)O m_7__10953796__10176980 [0,1,0,0,0,0|1,1,0]=3 875 B8R0.7 CCOCSCC(F)F m_7__22987700__10176980 [0,1,0,0,0,0|2,1,0]=4 876 B8R0.7 CCOCSC[C@H](C)N m_7__20871336__10176980 [0,1,0,0,0,0|2,1,0]=4 877 B8R0.7 CCSCCCC(C)C m_62__10892842__6469026 [0,1,0,0,0,0|3,0,0]=4 878 B8R0.7 CCSCCCC(C)O m_7__22987770__10688172 [0,1,0,0,0,0|2,0,0]=3 879 B8R0.7 CCSCCCC(Cl)Cl m_62__875846__23915480 [0,1,0,0,0,0|3,0,0]=4 880 B8R0.7 CCSCCCC(F)F m_62__875846__18239798 [0,1,0,0,0,0|3,0,0]=4 881 B8R0.7 CCSCOCC(C)C m_7__22987770__12637718 [0,1,0,0,0,0|2,0,0]=3 882 B8R0.7 CCSCOCC(F)F m_7__22987770__13807872 [0,1,0,0,0,0|2,0,0]=3 883 B8R0.7 CCSCSCC(=O)O m_7__26823__9456150 [0,1,0,0,0,0|1,1,1]=4 884 B8R0.7 CCSCSCC(C)C m_7__22987770__15703842 [0,1,0,0,0,0|2,1,0]=4 885 B8R0.7 CCSCSCC(C)O m_7__10953796__9456150 [0,1,0,0,0,0|1,1,0]=3 886 B8R0.7 CCSCSCC(F)F m_7__22987700__9456150 [0,1,0,0,0,0|2,1,0]=4 887 B8R0.7 CCSCSC[C@H](C)N m_7__20871336__9456150 [0,1,0,0,0,0|2,1,0]=4 888 B8R0.7 CN(C)CCCCCN m_269982__17757614__14064228 [0,1,0,0,0,0|3,0,0]=4 889 B8R0.7 CN(C)CCCCCO m_2230__9449864__2463448 [0,1,0,0,0,0|2,0,0]=3 890 B8R0.7 CN(C)CCOCCN m_269982__12306202__14064228 [0,1,0,0,0,0|2,0,0]=3 891 B8R0.7 CN(C)CCOCCO m_2230__9824938__2463448 [0,1,0,0,0,0|1,0,0]=2 892 B8R0.7 CN(C)CCSCCF m_7__6950568__22320828 [0,1,0,0,0,0|2,1,0]=4 893 B8R0.7 CN(C)CCSCCN m_7__20871276__391100 [0,1,0,0,0,0|2,1,0]=4 894 B8R0.7 CN(C)CCSCCO m_7__6950568__102708 [0,1,0,0,0,0|1,1,0]=3 895 B8R0.7 CNCCSCC(C)C m_7__22986920__1010132 [0,1,0,0,0,0|2,1,0]=4 896 B8R0.7 CNCCSCC(C)F m_7__22986920__16970746 [0,1,0,0,0,0|2,1,0]=4 897 B8R0.7 CNCCSCC(C)O m_7__22986920__10902704 [0,1,0,0,0,0|1,1,0]=3 898 B8R0.7 CNCCSCC(F)F m_7__22986920__16886816 [0,1,0,0,0,0|2,1,0]=4 899 B8R0.7 COCCNCC(C)C m_207__109486__121216 [0,1,0,0,0,0|3,0,0]=4 900 B8R0.7 COCCNCC(C)O m_273610__13857010__11516404 [0,1,0,0,0,0|2,0,0]=3 901 B8R0.7 COCCOCC(=O)N m_22__58357__4836766 [0,1,0,0,0,0|1,0,2]=4 902 B8R0.7 COCCSCC(=O)O m_7__26823__149891 [0,1,0,0,0,0|1,1,1]=4 903 B8R0.7 COCCSCC(C)C m_62__1010136__8623480 [0,1,0,0,0,0|2,1,0]=4 904 B8R0.7 COCCSCC(C)F m_62__524272__16913488 [0,1,0,0,0,0|2,1,0]=4 905 B8R0.7 COCCSCC(C)O m_7__10953796__149891 [0,1,0,0,0,0|1,1,0]=3 906 B8R0.7 COCCSCC(F)F m_7__6362310__16886816 [0,1,0,0,0,0|2,1,0]=4 907 B8R0.7 COCCSC[C@H](C)N m_7__20871336__149891 [0,1,0,0,0,0|2,1,0]=4 908 B8R0.7 COCSCCC(C)C m_7__22987856__6762 [0,1,0,0,0,0|2,1,0]=4 909 B8R0.7 COCSCCC(C)N m_7__20871360__6762 [0,1,0,0,0,0|2,1,0]=4 910 B8R0.7 CS(=O)CCSCCN m_7__20871276__11566584 [0,1,0,0,0,0|2,1,0]=4 911 B8R0.7 CS(=O)CCSCCO m_7__128807__11566584 [0,1,0,0,0,0|1,1,0]=3 912 B8R0.7 CSCCNCC(C)C m_207__11946676__121216 [0,1,0,0,0,0|3,0,0]=4 913 B8R0.7 CSCCNCC(C)O m_273610__13857796__11516404 [0,1,0,0,0,0|2,0,0]=3 914 B8R0.7 CSCCOCC(=O)N m_22__58357__20854432 [0,1,0,0,0,0|1,0,2]=4 915 B8R0.7 CSCCOCC(C)C m_62__9820342__876088 [0,1,0,0,0,0|2,0,0]=3 916 B8R0.7 CSCCOCC(F)F m_62__875850__13615350 [0,1,0,0,0,0|2,0,0]=3 917 B8R0.7 CSCCSCC(=O)O m_7__26823__7912552 [0,1,0,0,0,0|1,1,1]=4 918 B8R0.7 CSCCSCC(C)C m_62__1010136__8268572 [0,1,0,0,0,0|2,1,0]=4 919 B8R0.7 CSCCSCC(C)O m_7__10953796__7912552 [0,1,0,0,0,0|1,1,0]=3 920 B8R0.7 CSCCSCC(F)F m_7__22987700__7912552 [0,1,0,0,0,0|2,1,0]=4 921 B8R0.7 CSCCSC[C@H](C)N m_7__20871336__7912552 [0,1,0,0,0,0|2,1,0]=4 922 B8R0.7 CSCSCCC(C)C m_7__22987856__10542644 [0,1,0,0,0,0|2,1,0]=4 923 B8R0.7 CSCSCCC(C)N m_7__20871360__10542644 [0,1,0,0,0,0|2,1,0]=4 924 B8R0.7 C[C@H](N)CSCCCF m_7__20871336__16896928 [0,1,0,0,0,0|2,1,0]=4 925 B8R0.7 C[C@H](N)CSCCCO m_7__20871336__6354 [0,1,0,0,0,0|2,0,0]=3 926 B8R0.7 FCCCSCC(F)F m_7__22987700__16896928 [0,1,0,0,0,0|2,1,0]=4 927 B8R0.7 FCCSCCC(F)F m_7__22986868__22320828 [0,1,0,0,0,0|2,1,0]=4 928 B8R0.7 NC(=O)CCCCCO m_22__58357__17833544 [0,1,0,0,0,0|2,0,1]=4 929 B8R0.7 NC(=O)CCNCCO m_273610__11554104__11515976 [0,1,0,0,0,0|2,0,1]=4 930 B8R0.7 NC(=O)CCSCCO m_7__128807__217435 [0,1,0,0,0,0|1,1,1]=4 931 B8R0.7 NC(=O)COCCCF m_22__58357__20826534 [0,1,0,0,0,0|1,0,2]=4 932 B8R0.7 NCCCSCC(F)F m_7__20871288__16886816 [0,1,0,0,0,0|2,1,0]=4 933 B8R0.7 NCCOCCC(=O)N m_240690__7368526__14476252 [0,1,0,0,0,0|2,0,1]=4 934 B8R0.7 O=C(O)CSCCCF m_7__26823__16896928 [0,1,0,0,0,0|1,1,1]=4 935 B8R0.7 O=C(O)CSCCCO m_7__26823__6354 [0,1,0,0,0,0|1,1,1]=4 936 B8R0.7 OCCCSCC(F)F m_7__22987700__6354 [0,1,0,0,0,0|2,1,0]=4 937 B8R0.7 OCCSCCC(F)F m_7__22986868__102708 [0,1,0,0,0,0|1,1,0]=3 938 B8R1.2 CCC1CNCCN1 m_269982__23917336__14064228 [0,0,0,1,0,0|2,0,0]=3 939 B8R1.2 CCN1CCCCC1 m_2230__679042__22383854 [0,0,0,1,0,0|3,0,0]=4 940 B8R1.2 CNC1CCCCC1 m_269862__7193148__7200184 [0,0,0,1,0,0|3,0,0]=4 941 B8R1.2 CNC1CCCSC1 m_269862__7193148__8157488 [0,0,0,1,0,0|2,1,0]=4 942 B8R1.2 CSC1CCCCC1 m_7__27197__5046 [0,0,0,1,0,0|3,0,0]=4 943 B8R1.2 CSC1CCCNC1 m_7__22871154__5046 [0,0,0,1,0,0|3,0,0]=4 944 B8R1.2 CSC1CCCOC1 m_7__8601826__5046 [0,0,0,1,0,0|2,0,0]=3 945 B8R1.2 ON=C1CCCCC1 m_4__388124__66784 [0,0,0,1,0,0|2,0,1]=4 946 B8R1.5 CC1CCCCN1C m_2230__678754__2463448 [0,0,0,1,0,0|3,0,0]=4 947 B8R1.5 CC1CNCCN1C m_269982__7368790__14064228 [0,0,0,1,0,0|3,0,0]=4 948 B8R1.5 CC1COCCN1C m_2230__679548__2463448 [0,0,0,1,0,0|2,0,0]=3 949 B8R1.5 CC1CSCCN1C m_2230__5359444__2463448 [0,0,0,1,0,0|2,1,0]=4 950 B8R1.5 C[C@@H]1CCCCN1C m_2230__22409340__2463448 [0,0,0,1,0,0|3,0,0]=4 951 B8R1.5 C[C@H]1COCCN1C m_2230__10745968__2463448 [0,0,0,1,0,0|2,0,0]=3 952 B8R1.8 C=CCN1CCCC1 m_2230__678722__680312 [0,0,0,1,0,0|2,0,1]=4 953 B8R1.8 CCCN1CCCC1 m_2230__678722__13271112 [0,0,0,1,0,0|2,0,0]=3 954 B8R1.8 CCNC1CCCC1 m_207__121480__121596 [0,0,0,1,0,0|3,0,0]=4 955 B8R1.8 CCSC1CCCC1 m_62__875846__10178584 [0,0,0,1,0,0|3,0,0]=4 956 B8R1.8 CSCC1CCCC1 m_62__875850__8766438 [0,0,0,1,0,0|3,0,0]=4 957 B8R1.8 CSCC1CCCN1 m_7__22987948__5046 [0,0,0,1,0,0|3,0,0]=4 958 B8R1.8 CSCC1CCCO1 m_62__875850__9419582 [0,0,0,1,0,0|2,0,0]=3 959 B8R1.8 CSCC1OCCO1 m_7__22987978__5046 [0,0,0,1,0,0|1,0,0]=2 960 B8R1.8 FCCN1CCCC1 m_2230__678722__22320836 [0,0,0,1,0,0|2,0,0]=3 961 B8R1.8 N#CCN1CCCC1 m_2230__678722__680932 [0,0,0,1,0,0|2,0,1]=4 962 B8R1.8 NCCN1CCCC1 m_269982__7368900__14439794 [0,0,0,1,0,0|2,0,0]=3 963 B8R1.8 OCCN1CCCC1 m_2230__678722__6165700 [0,0,0,1,0,0|1,0,0]=2 964 B8R1.8 ON=CC1CCCC1 m_4__388124__6007722 [0,0,0,1,0,0|2,0,1]=4 965 B8R1.9 CCNCC1CC1C m_270004__8290112__24715004 [0,0,0,1,0,0|3,0,0]=4 966 B8R1.9 CCNCC1CC1Cl m_270004__18333456__24715004 [0,0,0,1,0,0|3,0,0]=4 967 B8R1.9 CCNC[C@@H]1C[C@H]1Br m_270004__23833090__24715004 [0,0,0,1,0,0|3,0,0]=4 968 B8R1.9 CCNC[C@@H]1C[C@H]1C m_270004__16491714__24715004 [0,0,0,1,0,0|3,0,0]=4 969 B8R1.9 CCNC[C@@H]1C[C@H]1F m_270004__23817766__24715004 [0,0,0,1,0,0|3,0,0]=4 970 B8R1.9 CCNC[C@@H]1C[C@H]1O m_270004__25073046__24715004 [0,0,0,1,0,0|2,0,0]=3 971 B8R1.9 CCSCC1CC1Br m_7__22987770__15765428 [0,0,0,1,0,0|3,0,0]=4 972 B8R1.9 CCSCC1CC1C m_62__12216592__6469026 [0,0,0,1,0,0|3,0,0]=4 973 B8R1.9 CCSC[C@@H]1C[C@H]1C m_62__875846__23861442 [0,0,0,1,0,0|3,0,0]=4 974 B8R1.10 C#CCSC1CCC1 m_7__10684076__6266 [0,0,0,1,0,0|1,1,1]=4 975 B8R1.10 C=CCSC1CCC1 m_7__10684076__3427024 [0,0,0,1,0,0|1,1,1]=4 976 B8R1.10 CCCNC1COC1 m_269862__7192572__7931470 [0,0,0,1,0,0|3,0,0]=4 977 B8R1.10 CCCSC1CCC1 m_7__10684076__14390332 [0,0,0,1,0,0|1,1,0]=3 978 B8R1.10 CCCSC1CNC1 m_7__22987816__14390332 [0,0,0,1,0,0|2,1,0]=4 979 B8R1.10 CCCSC1COC1 m_7__13420946__14390332 [0,0,0,1,0,0|2,1,0]=4 980 B8R1.10 CCCSC1CSC1 m_7__20064714__14390332 [0,0,0,1,0,0|2,1,0]=4 981 B8R1.10 CCNCC1CCC1 m_270004__8160850__24715052 [0,0,0,1,0,0|3,0,0]=4 982 B8R1.10 CCNC[C@H]1CCO1 m_270004__23851266__24715004 [0,0,0,1,0,0|2,0,0]=3 983 B8R1.10 CCSCC1CCC1 m_62__875846__6007778 [0,0,0,1,0,0|3,0,0]=4 984 B8R1.10 CCSC[C@H]1CCO1 m_7__22987770__17058812 [0,0,0,1,0,0|2,0,0]=3 985 B8R1.10 CSCCC1CCC1 m_62__875850__12121634 [0,0,0,1,0,0|3,0,0]=4 986 B8R1.10 FCCNC1COC1 m_269862__9706110__7931470 [0,0,0,1,0,0|3,0,0]=4 987 B8R1.10 FCCSC1CCC1 m_7__10684076__22320828 [0,0,0,1,0,0|1,1,0]=3 988 B8R1.10 FCCSC1CNC1 m_7__22987816__22320828 [0,0,0,1,0,0|2,1,0]=4 989 B8R1.10 FCCSC1COC1 m_7__13420946__22320828 [0,0,0,1,0,0|2,1,0]=4 990 B8R1.10 FCCSC1CSC1 m_7__20064714__22320828 [0,0,0,1,0,0|2,1,0]=4 991 B8R1.10 N#CCSC1CCC1 m_7__10684076__5055 [0,0,0,1,0,0|1,1,1]=4 992 B8R1.10 NCCSC1CCC1 m_7__20871276__13420952 [0,0,0,1,0,0|1,1,0]=3 993 B8R1.10 NCCSC1COC1 m_7__20871276__10173692 [0,0,0,1,0,0|2,1,0]=4 994 B8R1.10 OCCNC1COC1 m_269862__7193048__7931470 [0,0,0,1,0,0|2,0,0]=3 995 B8R1.10 OCCSC1CCC1 m_7__10684076__6166114 [0,0,0,1,0,0|0,1,0]=2 996 B8R1.10 OCCSC1CNC1 m_7__22987816__102708 [0,0,0,1,0,0|1,1,0]=3 997 B8R1.10 OCCSC1COC1 m_7__13420946__6166114 [0,0,0,1,0,0|1,1,0]=3 998 B8R1.10 OCCSC1CSC1 m_7__20064714__6166114 [0,0,0,1,0,0|1,1,0]=3 999 B8R1.11 C=C1COCC1NC m_2230__14055376__2463448 [0,0,0,1,0,0|2,0,1]=4 1000 B8R1.11 CC1CCCC1=NO m_4__388124__3351302 [0,0,0,1,0,0|2,0,1]=4 1001 B8R1.11 CCC1CCCN1C m_2230__4599928__2463448 [0,0,0,1,0,0|3,0,0]=4 1002 B8R1.11 CCN1CCCC1C m_2230__6338494__22383854 [0,0,0,1,0,0|3,0,0]=4 1003 B8R1.11 CN1CC=CC1CO m_2230__12911330__2463448 [0,0,0,1,0,0|2,0,1]=4 1004 B8R1.11 CN1CCCC1CO m_2230__3379024__2463448 [0,0,0,1,0,0|2,0,0]=3 1005 B8R1.11 CN1CCC[C@H]1CF m_2230__17313732__2463448 [0,0,0,1,0,0|3,0,0]=4 1006 B8R1.11 CNC1CCCC1C m_2230__9296222__2463448 [0,0,0,1,0,0|3,0,0]=4 1007 B8R1.11 CNC1CCCC1O m_269862__7193148__15158002 [0,0,0,1,0,0|2,0,0]=3 1008 B8R1.11 CNC1COCC1C m_2230__13166314__2463448 [0,0,0,1,0,0|2,0,0]=3 1009 B8R1.11 CNC1CSCC1C m_2230__10125964__2463448 [0,0,0,1,0,0|2,1,0]=4 1010 B8R1.11 CN[C@@H]1CNC[C@H]1C m_269982__22505224__14064228 [0,0,0,1,0,0|3,0,0]=4 1011 B8R1.11 CN[C@H]1CCC[C@H]1C m_2230__22399140__2463448 [0,0,0,1,0,0|3,0,0]=4 1012 B8R1.11 CN[C@H]1CCC[C@H]1N m_269982__17754792__14064228 [0,0,0,1,0,0|3,0,0]=4 1013 B8R1.11 CN[C@H]1CNC[C@H]1C m_269982__22505270__14064228 [0,0,0,1,0,0|3,0,0]=4 1014 B8R1.11 CN[C@H]1COC[C@H]1C m_2230__22403954__2463448 [0,0,0,1,0,0|2,0,0]=3 1015 B8R1.11 CS[C@H]1COC[C@H]1F m_62__875850__18327624 [0,0,0,1,0,0|2,0,0]=3 1016 B8R1.12 CCC1CCC1=NO m_4__388124__10177946 [0,0,0,1,0,0|2,0,1]=4 1017 B8R1.12 CCC1CCN1CC m_270004__10437848__24715004 [0,0,0,1,0,0|3,0,0]=4 1018 B8R1.12 CCN1CCC1CF m_270004__17655284__24715004 [0,0,0,1,0,0|3,0,0]=4 1019 B8R1.12 CCN1CCC1CO m_270004__24176176__24715004 [0,0,0,1,0,0|2,0,0]=3 1020 B8R1.12 CNC1CCC1CO m_269862__7193148__17047872 [0,0,0,1,0,0|2,0,0]=3 1021 B8R1.13 CCNC1CCC1C m_269862__7865270__9109936 [0,0,0,1,0,0|3,0,0]=4 1022 B8R1.13 CCN[C@H]1CC[C@H]1F m_270004__16535300__24715004 [0,0,0,1,0,0|3,0,0]=4 1023 B8R1.13 CCN[C@H]1CC[C@H]1O m_270004__20353356__24715004 [0,0,0,1,0,0|2,0,0]=3 1024 B8R1.13 CCSC1CCC1O m_7__22986908__5047 [0,0,0,1,0,0|2,0,0]=3 1025 B8R1.13 CSC[C@@H]1CC[C@H]1O m_62__875850__23862058 [0,0,0,1,0,0|2,0,0]=3 1026 B8R1.13 CSC[C@H]1CC[C@H]1C m_62__875850__21674492 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CC(CO)SCCO m_7__6338928__102708 [1,1,0,0,0,0|1,1,0]=4 1086 B7R0.3 CCC(=O)NCCO m_270062__7594790__22005658 [1,1,0,0,0,0|1,0,1]=4 1087 B7R0.3 CCC(=O)OCCF m_276436__14078274__14101862 [1,1,0,0,0,0|1,0,1]=4 1088 B7R0.3 CCC(=O)OCCO m_1458__473508__485506 [1,1,0,0,0,0|0,0,1]=3 1089 B7R0.3 CCC(C)CCSC m_62__20058276__876088 [1,1,0,0,0,0|2,0,0]=4 1090 B7R0.3 CCC(C)NCCF m_269862__9706110__7200134 [1,1,0,0,0,0|2,0,0]=4 1091 B7R0.3 CCC(C)NCCO m_269862__7193048__7200134 [1,1,0,0,0,0|1,0,0]=3 1092 B7R0.3 CCC(C)SCCN m_7__20871276__14247828 [1,1,0,0,0,0|1,1,0]=4 1093 B7R0.3 CCC(C)SCCO m_7__128807__14247828 [1,1,0,0,0,0|0,1,0]=3 1094 B7R0.3 CCC(O)CCSC m_62__16640708__876088 [1,1,0,0,0,0|2,0,0]=4 1095 B7R0.3 CCCCC(=NO)C m_4__388124__66742 [1,1,0,0,0,0|1,0,1]=4 1096 B7R0.3 CCCCC(=O)NC m_22__387492__303718 [1,1,0,0,0,0|2,0,0]=4 1097 B7R0.3 CCCCC(=O)NO m_527__388132__156096 [1,1,0,0,0,0|1,0,1]=4 1098 B7R0.3 CCCCC(=O)OC m_276436__14076652__14088340 [1,1,0,0,0,0|2,0,0]=4 1099 B7R0.3 CCCCC(C)NC m_269862__7193148__7200136 [1,1,0,0,0,0|2,0,0]=4 1100 B7R0.3 CCCCN(C)CC m_270004__8127976__24715004 [1,1,0,0,0,0|1,0,0]=3 1101 B7R0.3 CCCCN(C)OC m_2230__679026__22993830 [1,1,0,0,0,0|2,0,0]=4 1102 B7R0.3 CCCCS(=O)CC m_265282__10638440__4273536 [1,1,0,0,0,0|0,1,0]=3 1103 B7R0.3 CCCNC(=O)CC m_270062__7595096__22005658 [1,1,0,0,0,0|2,0,0]=4 1104 B7R0.3 CCCNC(=O)CO m_22__58027__7941800 [1,1,0,0,0,0|1,0,1]=4 1105 B7R0.3 CCCNC(C)CC m_2230__22399526__13271112 [1,1,0,0,0,0|2,0,0]=4 1106 B7R0.3 CCCNC(C)CCl m_2230__22399894__13271112 [1,1,0,0,0,0|2,0,0]=4 1107 B7R0.3 CCCNC(C)CO m_269862__7192572__15157990 [1,1,0,0,0,0|1,0,0]=3 1108 B7R0.3 CCCN[C@H](C)CF m_2230__22399906__13271112 [1,1,0,0,0,0|2,0,0]=4 1109 B7R0.3 CCCN[C@H](C)CN m_269982__22505378__13271120 [1,1,0,0,0,0|2,0,0]=4 1110 B7R0.3 CCCN[C@H](C)CO m_2230__22399532__13271112 [1,1,0,0,0,0|1,0,0]=3 1111 B7R0.3 CCCOC(=O)CC m_276436__14076550__14101862 [1,1,0,0,0,0|1,0,1]=4 1112 B7R0.3 CCCSC(C)CC m_7__22986886__14247828 [1,1,0,0,0,0|1,1,0]=4 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[1,1,0,0,0,0|1,0,0]=3 1127 B7R0.3 CCNCC(O)CF m_270004__13905838__24715004 [1,1,0,0,0,0|2,0,0]=4 1128 B7R0.3 CCOCC(=O)NC m_22__387492__59118 [1,1,0,0,0,0|1,0,1]=4 1129 B7R0.3 CCOCC(=O)OC m_276436__14076652__14086082 [1,1,0,0,0,0|1,0,1]=4 1130 B7R0.3 CCOCC(C)NC m_2230__22397432__2463448 [1,1,0,0,0,0|1,0,0]=3 1131 B7R0.3 CCON=C(N)CC m_34__1129938__7791662 [1,1,0,0,0,0|1,0,1]=4 1132 B7R0.3 CCONC(=O)CC m_270062__12125898__22005658 [1,1,0,0,0,0|1,0,1]=4 1133 B7R0.3 CCS(=O)CCCF m_265282__17315398__4273536 [1,1,0,0,0,0|1,1,0]=4 1134 B7R0.3 CCS(=O)CCCO m_265282__10972298__4273536 [1,1,0,0,0,0|1,0,0]=3 1135 B7R0.3 CCSCC(=O)CC m_7__22987770__2910268 [1,1,0,0,0,0|0,1,1]=4 1136 B7R0.3 CCSCC(C)CC m_62__10709932__6469026 [1,1,0,0,0,0|0,1,0]=3 1137 B7R0.3 CCSCC(C)CO m_7__6078536__5047 [1,1,0,0,0,0|1,0,0]=3 1138 B7R0.3 CCSCC(C)OC m_62__875846__8738872 [1,1,0,0,0,0|1,1,0]=4 1139 B7R0.3 CCSCC(F)CC m_62__9787600__6469026 [1,1,0,0,0,0|0,1,0]=3 1140 B7R0.3 CCSCC(O)CC m_7__22988104__5047 [1,1,0,0,0,0|0,1,0]=3 1141 B7R0.3 CCSCC(O)CF m_7__22987770__13890448 [1,1,0,0,0,0|1,1,0]=4 1142 B7R0.3 CCSCC(O)CO m_7__22987770__3173190 [1,1,0,0,0,0|1,0,0]=3 1143 B7R0.3 CCSC[C@@H](N)CC m_7__20871354__5047 [1,1,0,0,0,0|0,1,0]=3 1144 B7R0.3 CNC(C)CCCN m_269982__22505332__14064228 [1,1,0,0,0,0|2,0,0]=4 1145 B7R0.3 CNC(C)CCCO m_2230__22399382__2463448 [1,1,0,0,0,0|1,0,0]=3 1146 B7R0.3 COCSC(C)CO m_7__6338928__6762 [1,1,0,0,0,0|1,1,0]=4 1147 B7R0.3 CON(C)CCCO m_2230__679026__680950 [1,1,0,0,0,0|2,0,0]=4 1148 B7R0.3 CSC(C)CCCO m_7__22988038__5046 [1,1,0,0,0,0|1,0,0]=3 1149 B7R0.3 CSC(Cl)CCCBr m_62__23915478__876088 [1,1,0,0,0,0|2,0,0]=4 1150 B7R0.3 CSCSC(C)CO m_7__6338928__10542644 [1,1,0,0,0,0|1,1,0]=4 1151 B7R0.3 C[C@@H](CN)SCCO m_7__20871330__6166114 [1,1,0,0,0,0|1,1,0]=4 1152 B7R0.3 C[C@H](CF)NCCO m_2230__22399906__6165700 [1,1,0,0,0,0|2,0,0]=4 1153 B7R0.3 C[C@H](CN)NCCO m_269982__22505378__10880280 [1,1,0,0,0,0|2,0,0]=4 1154 B7R0.3 C[C@H](CO)NCCF m_2230__22399532__22320836 [1,1,0,0,0,0|2,0,0]=4 1155 B7R0.3 C[C@H](CO)NCCO m_2230__22399532__6165700 [1,1,0,0,0,0|2,0,0]=4 1156 B7R0.4 C=C(C)CCNCC m_270004__10740086__24715004 [1,1,0,0,0,0|1,0,1]=4 1157 B7R0.4 C=C(C)CCSCC m_62__10158742__6469026 [1,1,0,0,0,0|0,1,1]=4 1158 B7R0.4 C=C(C)CSCCO m_62__6464432__10178562 [1,1,0,0,0,0|0,1,1]=4 1159 B7R0.4 CC(=O)CSCCO m_7__128807__5065 [1,1,0,0,0,0|0,1,1]=4 1160 B7R0.4 CC(=O)NCCCO m_270062__7600302__15585492 [1,1,0,0,0,0|1,0,1]=4 1161 B7R0.4 CC(=O)NOCCO m_270062__21889572__15585492 [1,1,0,0,0,0|1,0,1]=4 1162 B7R0.4 CC(=O)OCCCF m_1458__473186__16896934 [1,1,0,0,0,0|1,0,1]=4 1163 B7R0.4 CC(=O)OCCCI m_1458__473186__8624952 [1,1,0,0,0,0|1,0,1]=4 1164 B7R0.4 CC(=O)OCCCO m_1458__473186__484772 [1,1,0,0,0,0|1,0,1]=4 1165 B7R0.4 CC(C)CCC=NO m_4__388124__10542476 [1,1,0,0,0,0|1,0,1]=4 1166 B7R0.4 CC(C)CNCCF m_207__18491578__121216 [1,1,0,0,0,0|2,0,0]=4 1167 B7R0.4 CC(C)CNCCO m_207__121484__121216 [1,1,0,0,0,0|1,0,0]=3 1168 B7R0.4 CC(C)CSCCF m_7__27301__22320828 [1,1,0,0,0,0|1,1,0]=4 1169 B7R0.4 CC(C)CSCCN m_7__20871276__1010132 [1,1,0,0,0,0|1,1,0]=4 1170 B7R0.4 CC(C)CSCCO m_7__27301__102708 [1,1,0,0,0,0|0,1,0]=3 1171 B7R0.4 CC(C)NCCCF m_269862__17065594__7204804 [1,1,0,0,0,0|2,0,0]=4 1172 B7R0.4 CC(C)NCCCO m_269862__7192678__7204804 [1,1,0,0,0,0|1,0,0]=3 1173 B7R0.4 CC(C)SCCCN m_7__20871288__5048 [1,1,0,0,0,0|1,1,0]=4 1174 B7R0.4 CC(C)SCCCO m_7__10972294__5048 [1,1,0,0,0,0|1,0,0]=3 1175 B7R0.4 CC(F)CSCCN m_7__20871276__16970746 [1,1,0,0,0,0|1,1,0]=4 1176 B7R0.4 CC(F)CSCCO m_7__128807__16970746 [1,1,0,0,0,0|0,1,0]=3 1177 B7R0.4 CC(O)CNCCF m_273610__13857118__11516404 [1,1,0,0,0,0|2,0,0]=4 1178 B7R0.4 CC(O)CNCCO m_273610__11554104__11516404 [1,1,0,0,0,0|1,0,0]=3 1179 B7R0.4 CC(O)CSCCF m_7__10953796__22320828 [1,1,0,0,0,0|1,1,0]=4 1180 B7R0.4 CC(O)CSCCN m_7__20871276__10902704 [1,1,0,0,0,0|1,1,0]=4 1181 B7R0.4 CC(O)CSCCO m_7__10953796__102708 [1,1,0,0,0,0|0,1,0]=3 1182 B7R0.4 CCC=NOC(C)C m_34__17309904__6950544 [1,1,0,0,0,0|1,0,1]=4 1183 B7R0.4 CCCCCC(=O)N m_22__58357__294124 [1,1,0,0,0,0|0,0,2]=4 1184 B7R0.4 CCCCCN(C)C m_2230__22407254__2463448 [1,1,0,0,0,0|2,0,0]=4 1185 B7R0.4 CCCCCS(=O)C m_265282__8271846__4273530 [1,1,0,0,0,0|1,0,1]=4 1186 B7R0.4 CCCCNC(=O)C m_270062__7594820__15585492 [1,1,0,0,0,0|1,0,1]=4 1187 B7R0.4 CCCCNC(C)C m_269862__7192636__7204804 [1,1,0,0,0,0|1,0,0]=3 1188 B7R0.4 CCCCOC(=O)C m_276436__14076536__14088324 [1,1,0,0,0,0|0,0,1]=3 1189 B7R0.4 CCCCOC(=O)N m_282070__22187654__22312810 [1,1,0,0,0,0|0,0,2]=4 1190 B7R0.4 CCCCSC(C)C m_62__2390328__7021588 [1,1,0,0,0,0|0,1,0]=3 1191 B7R0.4 CCCNCC(C)C m_207__109413__121216 [1,1,0,0,0,0|2,0,0]=4 1192 B7R0.4 CCCNCC(C)O m_273610__13857032__11516404 [1,1,0,0,0,0|1,0,0]=3 1193 B7R0.4 CCCOCC(=O)N m_22__58357__2009696 [1,1,0,0,0,0|0,0,2]=4 1194 B7R0.4 CCCSCC(=O)O m_7__26823__14390332 [1,1,0,0,0,0|0,1,1]=4 1195 B7R0.4 CCCSCC(C)C m_62__1010136__875868 [1,1,0,0,0,0|1,1,0]=4 1196 B7R0.4 CCCSCC(C)F m_62__875778__16913488 [1,1,0,0,0,0|1,1,0]=4 1197 B7R0.4 CCCSCC(C)O m_7__10953796__14390332 [1,1,0,0,0,0|0,1,0]=3 1198 B7R0.4 CCCSCC(F)F m_7__22986886__16886816 [1,1,0,0,0,0|1,1,0]=4 1199 B7R0.4 CCCSC[C@H](C)N m_7__20871336__14390332 [1,1,0,0,0,0|1,1,0]=4 1200 B7R0.4 CCNCCC(C)C m_207__121480__134014 [1,1,0,0,0,0|1,0,0]=3 1201 B7R0.4 CCNCCC(C)F m_270004__10546066__24715004 [1,1,0,0,0,0|1,0,0]=3 1202 B7R0.4 CCNCCC(C)O m_270004__8296476__24715004 [1,1,0,0,0,0|1,0,0]=3 1203 B7R0.4 CCNCCC(Cl)Cl m_270004__23845876__24715004 [1,1,0,0,0,0|2,0,0]=4 1204 B7R0.4 CCNCCC(F)F m_270004__13943058__24715004 [1,1,0,0,0,0|2,0,0]=4 1205 B7R0.4 CCNCCN(C)C m_270004__9143630__24715004 [1,1,0,0,0,0|2,0,0]=4 1206 B7R0.4 CCNCCS(=O)C m_270004__8296826__24715004 [1,1,0,0,0,0|2,0,0]=4 1207 B7R0.4 CCOCCC(=O)N m_22__58357__3124140 [1,1,0,0,0,0|1,0,1]=4 1208 B7R0.4 CCOCCN(C)C m_2230__8253658__2463448 [1,1,0,0,0,0|1,0,0]=3 1209 B7R0.4 CCON=CC(C)C m_4__158181__7831602 [1,1,0,0,0,0|1,0,1]=4 1210 B7R0.4 CCONCC(C)O m_273610__11517342__11516404 [1,1,0,0,0,0|1,0,0]=3 1211 B7R0.4 CCSCCC(=O)C m_7__22987770__107330 [1,1,0,0,0,0|0,1,1]=4 1212 B7R0.4 CCSCCC(C)C m_62__7021584__6469026 [1,1,0,0,0,0|0,1,0]=3 1213 B7R0.4 CCSCCC(C)F m_62__13165346__6469026 [1,1,0,0,0,0|0,1,0]=3 1214 B7R0.4 CCSCCC(C)N m_34__20871470__7791662 [1,1,0,0,0,0|0,1,0]=3 1215 B7R0.4 CCSCCC(C)O m_62__12057938__6469026 [1,1,0,0,0,0|0,1,0]=3 1216 B7R0.4 CCSCCC(F)F m_7__22986868__5047 [1,1,0,0,0,0|1,1,0]=4 1217 B7R0.4 CCSCCN(C)C m_7__22987770__391100 [1,1,0,0,0,0|1,1,0]=4 1218 B7R0.4 CCSCCS(=O)C m_7__22987770__11566584 [1,1,0,0,0,0|1,1,0]=4 1219 B7R0.4 CCSCOC(=O)C m_7__22987770__20618926 [1,1,0,0,0,0|1,0,1]=4 1220 B7R0.4 CCSCSC(C)C m_7__22987770__12306378 [1,1,0,0,0,0|1,1,0]=4 1221 B7R0.4 CN(C)CCCCO m_2230__9209606__2463448 [1,1,0,0,0,0|1,0,0]=3 1222 B7R0.4 CNCCCC(C)C m_207__134027__7912414 [1,1,0,0,0,0|2,0,0]=4 1223 B7R0.4 CNCCSC(C)C m_7__22986920__5048 [1,1,0,0,0,0|1,1,0]=4 1224 B7R0.4 COCCNC(C)C m_269862__7192698__7204804 [1,1,0,0,0,0|2,0,0]=4 1225 B7R0.4 COCCOC(=O)C m_276436__14076538__14088324 [1,1,0,0,0,0|1,0,1]=4 1226 B7R0.4 COCCSC(C)C m_62__2390328__8623480 [1,1,0,0,0,0|1,1,0]=4 1227 B7R0.4 COCSCC(C)O m_7__10953796__6762 [1,1,0,0,0,0|1,1,0]=4 1228 B7R0.4 CSCCCC(C)C m_62__10892842__876088 [1,1,0,0,0,0|2,0,0]=4 1229 B7R0.4 CSCCCC(Cl)Cl m_62__875850__23915480 [1,1,0,0,0,0|2,0,0]=4 1230 B7R0.4 CSCCCC(F)F m_62__875850__18239798 [1,1,0,0,0,0|2,0,0]=4 1231 B7R0.4 CSCCNC(C)C m_269862__11963794__7204804 [1,1,0,0,0,0|2,0,0]=4 1232 B7R0.4 CSCCOC(=O)C m_276436__14078554__14088324 [1,1,0,0,0,0|1,0,1]=4 1233 B7R0.4 CSCCOC(C)C m_62__3569224__876088 [1,1,0,0,0,0|1,0,0]=3 1234 B7R0.4 CSCCOC(F)F m_62__13445082__876088 [1,1,0,0,0,0|2,0,0]=4 1235 B7R0.4 CSCCSC(C)C m_62__2390328__8268572 [1,1,0,0,0,0|1,1,0]=4 1236 B7R0.4 CSCSCC(C)O m_7__10953796__10542644 [1,1,0,0,0,0|1,1,0]=4 1237 B7R0.4 C[C@H](N)CSCCF m_7__20871336__22320828 [1,1,0,0,0,0|1,1,0]=4 1238 B7R0.4 C[C@H](N)CSCCO m_7__20871336__6166114 [1,1,0,0,0,0|0,1,0]=3 1239 B7R0.4 OCCSCC(F)F m_7__22987700__102708 [1,1,0,0,0,0|1,1,0]=4 1240 B7R0.7 CCCC(=O)NCC m_270062__7594884__17814498 [1,1,0,0,0,0|1,0,1]=4 1241 B7R0.7 CCCC(=O)OCC m_1458__473330__1327610 [1,1,0,0,0,0|0,0,1]=3 1242 B7R0.7 CCCC(C)C=NO m_4__388124__7831624 [1,1,0,0,0,0|1,0,1]=4 1243 B7R0.7 CCCC(C)NCC m_2230__22397382__22383854 [1,1,0,0,0,0|1,0,0]=3 1244 B7R0.7 CCCC(C)SCC m_62__875846__10638528 [1,1,0,0,0,0|0,1,0]=3 1245 B7R0.7 CCCN(C)CCC m_2230__2261920__13271112 [1,1,0,0,0,0|2,0,0]=4 1246 B7R0.7 CCCN(C)CCF m_2230__2261920__22320836 [1,1,0,0,0,0|2,0,0]=4 1247 B7R0.7 CCCN(C)CCN m_269982__10894792__13271120 [1,1,0,0,0,0|2,0,0]=4 1248 B7R0.7 CCCN(C)CCO m_2230__2261920__6165700 [1,1,0,0,0,0|1,0,0]=3 1249 B7R0.7 CCNC(=O)CCO m_487__150428__12879784 [1,1,0,0,0,0|1,0,1]=4 1250 B7R0.7 CCNC(=O)OCC m_282070__22190848__22150950 [1,1,0,0,0,0|1,0,1]=4 1251 B7R0.7 CCNC(C)CCN m_269982__22505446__7393392 [1,1,0,0,0,0|2,0,0]=4 1252 B7R0.7 CCNC(C)CCO m_2230__22400640__22383854 [1,1,0,0,0,0|1,0,0]=3 1253 B7R0.7 CCNC(C)CNC m_269982__22505308__7393392 [1,1,0,0,0,0|2,0,0]=4 1254 B7R0.7 CCNC(C)COC m_270004__8160850__8844972 [1,1,0,0,0,0|2,0,0]=4 1255 B7R0.7 CCNC(C)CSC m_2230__22400632__22383854 [1,1,0,0,0,0|2,0,0]=4 1256 B7R0.7 CCN[C@@H](C)CCO m_270004__13469994__24715004 [1,1,0,0,0,0|1,0,0]=3 1257 B7R0.7 CCN[C@@H](C)CSC m_270004__23847226__24715004 [1,1,0,0,0,0|2,0,0]=4 1258 B7R0.7 CCN[C@H](C)CCF m_2230__22404666__22383854 [1,1,0,0,0,0|2,0,0]=4 1259 B7R0.7 CCN[C@H](C)COC m_2230__22399844__22383854 [1,1,0,0,0,0|2,0,0]=4 1260 B7R0.7 CCOC(=O)CCF m_276436__14076718__14107760 [1,1,0,0,0,0|1,0,1]=4 1261 B7R0.7 CCOC(=O)COC m_1458__473580__1327610 [1,1,0,0,0,0|1,0,1]=4 1262 B7R0.7 CCOC(=O)CSC m_7__27132__5046 [1,1,0,0,0,0|1,0,1]=4 1263 B7R0.7 CCOC(C)SCC m_7__22987770__13420948 [1,1,0,0,0,0|1,0,0]=3 1264 B7R0.7 CCSC(C)CCO m_7__22987770__14772890 [1,1,0,0,0,0|1,0,0]=3 1265 B7R0.7 CCSC(C)COC m_7__22987770__6339266 [1,1,0,0,0,0|1,1,0]=4 1266 B7R0.7 CN(CCN)CCO m_269982__22515300__14439794 [1,1,0,0,0,0|2,0,0]=4 1267 B7R0.7 CN(CCO)CCF m_2230__679202__22320836 [1,1,0,0,0,0|2,0,0]=4 1268 B7R0.7 CN(CCO)CCO m_2230__679202__6165700 [1,1,0,0,0,0|2,0,0]=4 1269 B9R0.4 CC(C)CC(=O)NCCO m_527__154483__156141 [0,2,0,0,0,0|1,0,1]=4 1270 B9R0.4 CC(C)CC(=O)OCCF m_276436__14078274__14085888 [0,2,0,0,0,0|1,0,1]=4 1271 B9R0.4 CC(C)CC(=O)OCCO m_1458__473118__485506 [0,2,0,0,0,0|0,0,1]=3 1272 B9R0.4 CC(C)CC(C)NCCF m_269862__9706110__7200174 [0,2,0,0,0,0|2,0,0]=4 1273 B9R0.4 CC(C)CC(C)NCCO m_269862__7193048__7200174 [0,2,0,0,0,0|1,0,0]=3 1274 B9R0.4 CC(C)CC(C)SCCN m_7__20871276__10641634 [0,2,0,0,0,0|1,1,0]=4 1275 B9R0.4 CC(C)CC(C)SCCO m_7__128807__10641634 [0,2,0,0,0,0|0,1,0]=3 1276 B9R0.4 CC(C)CN(C)CCCO m_2230__2206024__680950 [0,2,0,0,0,0|2,0,0]=4 1277 B9R0.4 CC(C)CS(=O)CCCO m_265282__10972298__14924542 [0,2,0,0,0,0|2,0,0]=4 1278 B9R0.4 CC(C)NC(C)CCCO m_269862__7199704__7204804 [0,2,0,0,0,0|2,0,0]=4 1279 B9R0.4 CC(C)SC(C)CCCO m_7__22988038__5048 [0,2,0,0,0,0|2,0,0]=4 1280 B9R0.4 CC(CC(F)F)NCCO m_2230__22400820__6165700 [0,2,0,0,0,0|2,0,0]=4 1281 B9R0.4 CC(CS(=O)C)NCCO m_2230__22399648__6165700 [0,2,0,0,0,0|2,0,0]=4 1282 B9R0.4 CC(F)CC(=O)NCCO m_527__154483__17511476 [0,2,0,0,0,0|1,0,1]=4 1283 B9R0.4 CC(F)CC(=O)OCCF m_276436__14078274__17511488 [0,2,0,0,0,0|1,0,1]=4 1284 B9R0.4 CC(F)CC(=O)OCCO m_1458__17511478__485506 [0,2,0,0,0,0|0,0,1]=3 1285 B9R0.4 CC(F)CN(C)CCCO m_2230__9787816__16970752 [0,2,0,0,0,0|2,0,0]=4 1286 B9R0.4 CC(F)CS(=O)CCCO m_265282__10972298__16913496 [0,2,0,0,0,0|2,0,0]=4 1287 B9R0.4 CC(N)CC(C)NCCN m_272690__11349186__11349484 [0,2,0,0,0,0|2,0,0]=4 1288 B9R0.4 CC(O)CC(=O)NCCO m_487__150669__23862482 [0,2,0,0,0,0|1,0,1]=4 1289 B9R0.4 CC(O)CC(C)NCCF m_2230__22399846__22320836 [0,2,0,0,0,0|2,0,0]=4 1290 B9R0.4 CC(O)CC(C)NCCO m_2230__22399846__6165700 [0,2,0,0,0,0|1,0,0]=3 1291 B9R0.4 CC(O)CN(C)CCCF m_2230__13040470__9736146 [0,2,0,0,0,0|2,0,0]=4 1292 B9R0.4 CC(O)CN(C)CCCN m_269982__17668780__10880302 [0,2,0,0,0,0|2,0,0]=4 1293 B9R0.4 CC(O)CN(C)CCCO m_2230__9787816__9736146 [0,2,0,0,0,0|2,0,0]=4 1294 B9R0.4 CCCCN(C)CC(=O)O m_270122__11723458__22563622 [0,2,0,0,0,0|1,0,1]=4 1295 B9R0.4 CCCCN(C)CC(C)C m_270004__8127976__8127718 [0,2,0,0,0,0|2,0,0]=4 1296 B9R0.4 CCCCN(C)CC(C)F m_2230__665312__16970752 [0,2,0,0,0,0|2,0,0]=4 1297 B9R0.4 CCCCN(C)CC(C)O m_2230__665312__9736146 [0,2,0,0,0,0|1,0,0]=3 1298 B9R0.4 CCCCN(C)CC(F)Cl m_2230__21676360__22993830 [0,2,0,0,0,0|2,0,0]=4 1299 B9R0.4 CCCCN(C)CC(F)F m_2230__3307464__22993830 [0,2,0,0,0,0|2,0,0]=4 1300 B9R0.4 CCCCN(C)C[C@H](C)N m_269982__7368932__25012480 [0,2,0,0,0,0|2,0,0]=4 1301 B9R0.4 CCCCS(=O)CC(C)C m_265282__10638440__14924542 [0,2,0,0,0,0|1,1,0]=4 1302 B9R0.4 CCCCS(=O)CC(C)F m_265282__10638440__16913496 [0,2,0,0,0,0|1,1,0]=4 1303 B9R0.4 CCCNC(=O)CC(C)O m_487__150753__23862482 [0,2,0,0,0,0|2,0,0]=4 1304 B9R0.4 CCCNC(C)CC(C)C m_2230__22399870__13271112 [0,2,0,0,0,0|2,0,0]=4 1305 B9R0.4 CCCNC(C)CC(C)O m_2230__22399846__13271112 [0,2,0,0,0,0|2,0,0]=4 1306 B9R0.4 CCCN[C@H](C)C[C@@H](C)N m_269982__22505384__13271120 [0,2,0,0,0,0|2,0,0]=4 1307 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[0,2,0,0,0,0|1,1,0]=4 1468 B9R0.5 CN(CCF)CCCCO m_2230__9209606__22320836 [0,2,0,0,0,0|2,0,0]=4 1469 B9R0.5 CN(CCN)CCCCF m_269982__10894792__22489398 [0,2,0,0,0,0|2,0,0]=4 1470 B9R0.5 CN(CCN)CCCCO m_269982__22515954__14439794 [0,2,0,0,0,0|2,0,0]=4 1471 B9R0.5 CN(CCO)CCCC#N m_2230__679202__680988 [0,2,0,0,0,0|1,0,1]=4 1472 B9R0.5 CN(CCO)CCCCCl m_270004__8127950__24721168 [0,2,0,0,0,0|1,0,0]=3 1473 B9R0.5 CN(CCO)CCCCF m_2230__679202__10157922 [0,2,0,0,0,0|1,0,0]=3 1474 B9R0.5 CN(CCO)CCCCO m_2230__679202__3191342 [0,2,0,0,0,0|1,0,0]=3 1475 B9R0.5 CNCC(=O)NOCCO m_240690__17027340__7368582 [0,2,0,0,0,0|1,0,1]=4 1476 B9R0.5 CNCC(C)NCCCO m_269982__22505308__22497532 [0,2,0,0,0,0|2,0,0]=4 1477 B9R0.5 CNCC(C)NCCOC m_269982__22505308__7396032 [0,2,0,0,0,0|2,0,0]=4 1478 B9R0.5 CNCCCN(C)CCF m_269982__10972426__22320816 [0,2,0,0,0,0|2,0,0]=4 1479 B9R0.5 CNCCCN(C)CCN m_269982__10972426__14439794 [0,2,0,0,0,0|2,0,0]=4 1480 B9R0.5 CNCCCN(C)CCO m_269982__22515300__9707534 [0,2,0,0,0,0|1,0,0]=3 1481 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O=C(CCBr)NOCCO m_270062__21889572__20844442 [0,2,0,0,0,0|1,0,1]=4 1536 B9R0.5 O=C(CCO)NCCCF m_487__17065568__12879784 [0,2,0,0,0,0|2,0,0]=4 1537 B9R0.5 O=C(CCO)NCCCO m_487__150630__12879784 [0,2,0,0,0,0|2,0,0]=4 1538 B9R0.5 O=C(CCO)NOCCO m_487__9273734__12879784 [0,2,0,0,0,0|1,0,1]=4 1539 B9R0.8 CC(CBr)C(=O)OCCO m_1458__22606896__485506 [0,2,0,0,0,0|1,0,1]=4 1540 B9R0.8 CC(CF)C(=O)OCCO m_1458__12111298__485506 [0,2,0,0,0,0|1,0,1]=4 1541 B9R0.8 CC(CO)C(C)NCCO m_2230__8740410__6165700 [0,2,0,0,0,0|2,0,0]=4 1542 B9R0.8 CC(CO)C(C)SCCO m_7__22987758__102708 [0,2,0,0,0,0|1,1,0]=4 1543 B9R0.8 CC(CO)N(C)CCCF m_2230__7785428__16896936 [0,2,0,0,0,0|2,0,0]=4 1544 B9R0.8 CC(CO)N(C)CCCO m_2230__7785428__680950 [0,2,0,0,0,0|2,0,0]=4 1545 B9R0.8 CCC(=O)C(C)SCCO m_7__128807__1044276 [0,2,0,0,0,0|0,1,1]=4 1546 B9R0.8 CCC(Br)C(=O)OCCF m_1458__21466842__22320834 [0,2,0,0,0,0|1,0,1]=4 1547 B9R0.8 CCC(Br)C(=O)OCCO m_1458__21466842__485506 [0,2,0,0,0,0|0,0,1]=3 1548 B9R0.8 CCC(C)C(=O)NCCO m_527__154483__244784 [0,2,0,0,0,0|1,0,1]=4 1549 B9R0.8 CCC(C)C(=O)OCCF m_276436__14078274__14090618 [0,2,0,0,0,0|1,0,1]=4 1550 B9R0.8 CCC(C)C(=O)OCCO m_1458__475836__485506 [0,2,0,0,0,0|0,0,1]=3 1551 B9R0.8 CCC(C)C(C)NCCF m_2230__8270336__22320836 [0,2,0,0,0,0|2,0,0]=4 1552 B9R0.8 CCC(C)C(C)NCCN m_272690__11349186__11345984 [0,2,0,0,0,0|2,0,0]=4 1553 B9R0.8 CCC(C)C(C)NCCO m_2230__8270336__6165700 [0,2,0,0,0,0|1,0,0]=3 1554 B9R0.8 CCC(C)C(C)SCCN m_7__20871276__10953804 [0,2,0,0,0,0|1,1,0]=4 1555 B9R0.8 CCC(C)C(C)SCCO m_7__128807__10953804 [0,2,0,0,0,0|0,1,0]=3 1556 B9R0.8 CCC(C)N(C)CCCO m_2230__7462418__680950 [0,2,0,0,0,0|2,0,0]=4 1557 B9R0.8 CCC(F)C(=O)NCCO m_527__154483__13756278 [0,2,0,0,0,0|1,0,1]=4 1558 B9R0.8 CCC(F)C(=O)OCCF m_276436__14078274__14109476 [0,2,0,0,0,0|1,0,1]=4 1559 B9R0.8 CCC(F)C(=O)OCCO m_1458__13756280__485506 [0,2,0,0,0,0|0,0,1]=3 1560 B9R0.8 CCC(O)C(C)NCCF m_2230__22403482__22320836 [0,2,0,0,0,0|2,0,0]=4 1561 B9R0.8 CCC(O)C(C)NCCO m_2230__22403482__6165700 [0,2,0,0,0,0|1,0,0]=3 1562 B9R0.8 CCCCN(C)C(=O)CO m_22__338068__7941800 [0,2,0,0,0,0|1,0,1]=4 1563 B9R0.8 CCCCN(C)C(C)CC m_2230__804418__2463448 [0,2,0,0,0,0|2,0,0]=4 1564 B9R0.8 CCCCN(C)C(C)CF m_2230__22408738__22993830 [0,2,0,0,0,0|2,0,0]=4 1565 B9R0.8 CCCCN(C)C(C)CN m_269982__7368932__13769420 [0,2,0,0,0,0|2,0,0]=4 1566 B9R0.8 CCCCN(C)C(C)CO m_2230__7785428__22993830 [0,2,0,0,0,0|1,0,0]=3 1567 B9R0.8 CCCNC(=O)C(C)CO m_22__58027__16784146 [0,2,0,0,0,0|2,0,0]=4 1568 B9R0.8 CCCNC(=O)C(N)CO m_240690__7351178__12887534 [0,2,0,0,0,0|2,0,0]=4 1569 B9R0.8 CCCNC(=O)[C@H](N)CO m_240690__7351178__12297580 [0,2,0,0,0,0|2,0,0]=4 1570 B9R0.8 CCCNC(C)C(C)CC m_269862__7192572__7200196 [0,2,0,0,0,0|2,0,0]=4 1571 B9R0.8 CCCNC(C)C(C)CO m_2230__8740410__13271112 [0,2,0,0,0,0|2,0,0]=4 1572 B9R0.8 CCCNC(C)C(O)CC m_2230__22403482__13271112 [0,2,0,0,0,0|2,0,0]=4 1573 B9R0.8 CCCN[C@@H](C)[C@H](N)CO m_269982__22505312__13271120 [0,2,0,0,0,0|2,0,0]=4 1574 B9R0.8 CCCOC(=O)C(Br)CC m_1458__21466842__13271110 [0,2,0,0,0,0|1,0,1]=4 1575 B9R0.8 CCCOC(=O)C(C)CC m_276436__14076550__14090618 [0,2,0,0,0,0|1,0,1]=4 1576 B9R0.8 CCCOC(=O)C(F)CC m_276436__14076550__14109476 [0,2,0,0,0,0|1,0,1]=4 1577 B9R0.8 CCCOC(=O)[C@H](O)CC m_1458__14760030__13271110 [0,2,0,0,0,0|1,0,1]=4 1578 B9R0.8 CCCSC(C)C(C)CC m_7__22986886__10953804 [0,2,0,0,0,0|1,1,0]=4 1579 B9R0.8 CCCSC(C)C(C)CO m_7__22987758__14390332 [0,2,0,0,0,0|2,0,0]=4 1580 B9R0.8 CCN(C)C(C)CCCO m_2230__22407882__22383854 [0,2,0,0,0,0|2,0,0]=4 1581 B9R0.8 CC[C@@H](O)C(=O)NCCO m_527__154483__14760028 [0,2,0,0,0,0|1,0,1]=4 1582 B9R0.8 CC[C@@H](O)C(=O)OCCF m_1458__14760030__22320834 [0,2,0,0,0,0|1,0,1]=4 1583 B9R0.8 CC[C@@H](O)C(=O)OCCO m_1458__14760030__485506 [0,2,0,0,0,0|0,0,1]=3 1584 B9R0.8 CC[C@H](N)C(=O)NCCO m_270006__8389422__11615836 [0,2,0,0,0,0|1,0,1]=4 1585 B9R0.8 COC(C)C(C)NCCO m_269862__7193048__7201638 [0,2,0,0,0,0|2,0,0]=4 1586 B9R0.8 COC(C)C(C)SCCO m_7__22988026__102708 [0,2,0,0,0,0|1,1,0]=4 1587 B9R0.8 COCCN(C)C(C)CO m_2230__7785428__666874 [0,2,0,0,0,0|2,0,0]=4 1588 B9R0.8 CO[C@@H](C)C(=O)OCCO m_1458__16232116__485506 [0,2,0,0,0,0|1,0,1]=4 1589 B9R0.8 CO[C@@H](C)[C@H](C)NCCO m_2230__22397856__6165700 [0,2,0,0,0,0|2,0,0]=4 1590 B9R0.8 CSCCN(C)C(C)CO m_2230__7785428__681390 [0,2,0,0,0,0|2,0,0]=4 1591 B9R0.8 C[C@H](NCCO)[C@H](N)CO m_269982__22505312__10880280 [0,2,0,0,0,0|2,0,0]=4 1592 B9R0.18 C#CCCC(=O)OCCO m_1458__10207052__485506 [0,2,0,0,0,0|0,0,2]=4 1593 B9R0.18 C#CCCC(C)NCCO m_270004__8349608__24722558 [0,2,0,0,0,0|1,0,1]=4 1594 B9R0.18 C#CCCN(C)CCCC m_2230__665312__9420240 [0,2,0,0,0,0|2,0,0]=4 1595 B9R0.18 C#CCCS(=O)CCCC m_265282__10638440__18060670 [0,2,0,0,0,0|1,1,0]=4 1596 B9R0.18 C#CCOC(=O)CCCC m_276436__14076544__14088340 [0,2,0,0,0,0|1,0,1]=4 1597 B9R0.18 C#CCOC(C)CNCC m_270004__24171852__24715004 [0,2,0,0,0,0|1,0,1]=4 1598 B9R0.18 C=CCCC(=O)OCCO m_1458__2757564__485506 [0,2,0,0,0,0|0,0,2]=4 1599 B9R0.18 C=CCCC(C)NCCO m_2230__22399608__6165700 [0,2,0,0,0,0|1,0,1]=4 1600 B9R0.18 C=CCCC(C)SCCO m_7__128807__8261220 [0,2,0,0,0,0|0,1,1]=4 1601 B9R0.18 C=CCCN(C)CCCC m_2230__665312__8929530 [0,2,0,0,0,0|2,0,0]=4 1602 B9R0.18 C=CCOC(=O)CCCC m_1458__473328__489874 [0,2,0,0,0,0|1,0,1]=4 1603 B9R0.18 C=CCOC(C)CNCC m_270004__9822796__24715004 [0,2,0,0,0,0|1,0,1]=4 1604 B9R0.18 CC#CCC(C)NCCO m_2230__22400672__6165700 [0,2,0,0,0,0|1,0,1]=4 1605 B9R0.18 CC(CCC#N)SCCO m_7__128807__9139798 [0,2,0,0,0,0|0,1,1]=4 1606 B9R0.18 CC(CCCCl)NCCO m_270004__8349608__24722580 [0,2,0,0,0,0|1,0,0]=3 1607 B9R0.18 CC(CCCF)SCCN m_7__20871276__19259364 [0,2,0,0,0,0|1,1,0]=4 1608 B9R0.18 CC(CCCF)SCCO m_7__128807__19259364 [0,2,0,0,0,0|0,1,0]=3 1609 B9R0.18 CC(CCCN)NCCF m_269982__22505332__22320816 [0,2,0,0,0,0|2,0,0]=4 1610 B9R0.18 CC(CCCN)NCCN m_272690__11349186__11349542 [0,2,0,0,0,0|2,0,0]=4 1611 B9R0.18 CC(CCCN)NCCO m_269982__22505332__10880280 [0,2,0,0,0,0|1,0,0]=3 1612 B9R0.18 CC(CCCO)NCCF m_2230__22399382__22320836 [0,2,0,0,0,0|2,0,0]=4 1613 B9R0.18 CC(CCCO)NCCO m_2230__22399382__6165700 [0,2,0,0,0,0|1,0,0]=3 1614 B9R0.18 CC(CCCO)SCCF m_7__22988038__22320828 [0,2,0,0,0,0|1,1,0]=4 1615 B9R0.18 CC(CCCO)SCCN m_7__20871276__10804146 [0,2,0,0,0,0|1,1,0]=4 1616 B9R0.18 CC(CCCO)SCCO m_7__22988038__102708 [0,2,0,0,0,0|0,1,0]=3 1617 B9R0.18 CCC=CC(=O)OCCO m_1458__478220__485506 [0,2,0,0,0,0|0,0,2]=4 1618 B9R0.18 CCCCC(=O)CSCC m_7__22987770__15609618 [0,2,0,0,0,0|2,0,0]=4 1619 B9R0.18 CCCCC(=O)NCCC m_527__154065__156096 [0,2,0,0,0,0|2,0,0]=4 1620 B9R0.18 CCCCC(=O)NCCF m_1626__22055678__515586 [0,2,0,0,0,0|2,0,0]=4 1621 B9R0.18 CCCCC(=O)NCCN m_270006__11615266__8405100 [0,2,0,0,0,0|2,0,0]=4 1622 B9R0.18 CCCCC(=O)NCCO m_527__154483__156096 [0,2,0,0,0,0|1,0,0]=3 1623 B9R0.18 CCCCC(=O)OCC#N m_1458__473328__483934 [0,2,0,0,0,0|1,0,1]=4 1624 B9R0.18 CCCCC(=O)OCCC m_276436__14076550__14088340 [0,2,0,0,0,0|1,0,0]=3 1625 B9R0.18 CCCCC(=O)OCCF m_276436__14078274__14088340 [0,2,0,0,0,0|1,0,0]=3 1626 B9R0.18 CCCCC(=O)OCCO m_1458__473328__485506 [0,2,0,0,0,0|0,0,0]=2 1627 B9R0.18 CCCCC(=O)OCOC m_1458__473328__484704 [0,2,0,0,0,0|2,0,0]=4 1628 B9R0.18 CCCCC(C)CNCC m_270004__8160850__24715008 [0,2,0,0,0,0|2,0,0]=4 1629 B9R0.18 CCCCC(C)NCCC m_269862__7192572__7200136 [0,2,0,0,0,0|2,0,0]=4 1630 B9R0.18 CCCCC(C)NCCF m_2230__22399858__22320836 [0,2,0,0,0,0|2,0,0]=4 1631 B9R0.18 CCCCC(C)NCCN m_272690__11349186__11345926 [0,2,0,0,0,0|2,0,0]=4 1632 B9R0.18 CCCCC(C)NCCO m_2230__22399858__6165700 [0,2,0,0,0,0|1,0,0]=3 1633 B9R0.18 CCCCC(O)CNCC m_270004__24336042__24715004 [0,2,0,0,0,0|2,0,0]=4 1634 B9R0.18 CCCCC(O)CSCC m_7__22987770__15431214 [0,2,0,0,0,0|2,0,0]=4 1635 B9R0.18 CCCCN(C)CCC#N m_2230__6737726__22993830 [0,2,0,0,0,0|2,0,0]=4 1636 B9R0.18 CCCCN(C)CCCC m_2230__6582778__2463448 [0,2,0,0,0,0|2,0,0]=4 1637 B9R0.18 CCCCN(C)CCCF m_2230__665312__16896936 [0,2,0,0,0,0|2,0,0]=4 1638 B9R0.18 CCCCN(C)CCCN m_269982__7368932__10880302 [0,2,0,0,0,0|2,0,0]=4 1639 B9R0.18 CCCCN(C)CCCO m_2230__8272134__2463448 [0,2,0,0,0,0|1,0,0]=3 1640 B9R0.18 CCCCN(C)CCNC m_269982__10880304__7393358 [0,2,0,0,0,0|2,0,0]=4 1641 B9R0.18 CCCCN(C)CCOC m_2230__4555052__2463448 [0,2,0,0,0,0|1,0,0]=3 1642 B9R0.18 CCCCN(C)CCSC m_2230__665312__681390 [0,2,0,0,0,0|1,1,0]=4 1643 B9R0.18 CCCCS(=O)CCOC m_265282__10638440__16982414 [0,2,0,0,0,0|0,1,0]=3 1644 B9R0.18 CCCNC(=NCCO)N m_264822__3499788__3499582 [0,2,0,0,0,0|1,0,1]=4 1645 B9R0.18 CCCNC(=O)CCNO m_240690__7351178__21394576 [0,2,0,0,0,0|2,0,0]=4 1646 B9R0.18 CCCNC(=O)CCOC m_527__154065__2909592 [0,2,0,0,0,0|2,0,0]=4 1647 B9R0.18 CCCNC(=O)NCCO m_2708__905712__908988 [0,2,0,0,0,0|1,0,1]=4 1648 B9R0.18 CCCNC(=O)OCCC m_282070__22188146__22151414 [0,2,0,0,0,0|1,0,1]=4 1649 B9R0.18 CCCNC(=O)OCCF m_282070__22188146__22151794 [0,2,0,0,0,0|1,0,1]=4 1650 B9R0.18 CCCNC(C)CCCCl m_270004__8288780__24722580 [0,2,0,0,0,0|2,0,0]=4 1651 B9R0.18 CCCNC(C)CCCN m_269982__22505332__13271120 [0,2,0,0,0,0|2,0,0]=4 1652 B9R0.18 CCCNC(C)CCCO m_2230__22399382__13271112 [0,2,0,0,0,0|1,0,0]=3 1653 B9R0.18 CCCNC(C)CCNC m_269982__22505202__13271120 [0,2,0,0,0,0|2,0,0]=4 1654 B9R0.18 CCCNC(C)CCOC m_2230__22398948__13271112 [0,2,0,0,0,0|2,0,0]=4 1655 B9R0.18 CCCNC(C)CCSC m_2230__22399620__13271112 [0,2,0,0,0,0|2,0,0]=4 1656 B9R0.18 CCCNC(C)COCC m_2230__22397432__13271112 [0,2,0,0,0,0|2,0,0]=4 1657 B9R0.18 CCCOC(=O)CCCF m_276436__14076550__14105870 [0,2,0,0,0,0|1,0,1]=4 1658 B9R0.18 CCCOC(=O)CCOC m_1458__2909598__13271110 [0,2,0,0,0,0|1,0,1]=4 1659 B9R0.18 CCCOC(=O)CCSC m_276436__14076550__14089348 [0,2,0,0,0,0|1,0,1]=4 1660 B9R0.18 CCCOC(=O)COCC m_276436__14076550__14086082 [0,2,0,0,0,0|1,0,1]=4 1661 B9R0.18 CCCOC(=O)CSCC m_276436__14076550__14930390 [0,2,0,0,0,0|1,0,1]=4 1662 B9R0.18 CCCOC(=O)NCCO m_282070__22205922__22151414 [0,2,0,0,0,0|1,0,1]=4 1663 B9R0.18 CCCSC(C)CCCF m_7__22986886__19259364 [0,2,0,0,0,0|1,1,0]=4 1664 B9R0.18 CCCSC(C)CCCO m_7__22986886__10804146 [0,2,0,0,0,0|1,0,0]=3 1665 B9R0.18 CCCSC(C)CCOC m_62__875778__6956440 [0,2,0,0,0,0|1,1,0]=4 1666 B9R0.18 CCCSC(Cl)CCCBr m_62__23915478__875868 [0,2,0,0,0,0|1,1,0]=4 1667 B9R0.18 CCNCC(=O)NCCO m_240690__14577196__7368632 [0,2,0,0,0,0|1,0,1]=4 1668 B9R0.18 CCNCC(C)CCCO m_270004__10686648__24715004 [0,2,0,0,0,0|1,0,0]=3 1669 B9R0.18 CCNCC(C)OCCO m_270004__23831956__24715004 [0,2,0,0,0,0|0,0,0]=2 1670 B9R0.18 CCNCC(O)CCOC m_270004__24793826__24715004 [0,2,0,0,0,0|2,0,0]=4 1671 B9R0.18 CCOCC(=O)NCCO m_527__154483__157857 [0,2,0,0,0,0|1,0,1]=4 1672 B9R0.18 CCOCC(=O)OCCF m_276436__14078274__14086082 [0,2,0,0,0,0|1,0,1]=4 1673 B9R0.18 CCOCC(=O)OCCO m_1458__473848__485506 [0,2,0,0,0,0|0,0,1]=3 1674 B9R0.18 CCOCC(C)NCCF m_269862__9706110__7201202 [0,2,0,0,0,0|2,0,0]=4 1675 B9R0.18 CCOCC(C)NCCO m_269862__7193048__7201202 [0,2,0,0,0,0|1,0,0]=3 1676 B9R0.18 CCSCC(=O)CCOC m_7__22987770__7116734 [0,2,0,0,0,0|2,0,0]=4 1677 B9R0.18 CCSCC(=O)NCCO m_527__154483__14930378 [0,2,0,0,0,0|1,0,1]=4 1678 B9R0.18 CCSCC(=O)OCCF m_276436__14078274__14930390 [0,2,0,0,0,0|1,0,1]=4 1679 B9R0.18 CCSCC(=O)OCCO m_1458__14930380__485506 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m_7__27301__14772890 [0,2,0,0,0,0|2,0,0]=4 1850 B9R0.48 CC(C)NCC(O)CCO m_63__8671900__16726650 [0,2,0,0,0,0|2,0,0]=4 1851 B9R0.48 CC(C)NC[C@@H](O)CCO m_269862__21538882__7204804 [0,2,0,0,0,0|2,0,0]=4 1852 B9R0.48 CC(CCO)CNC(C)C m_269862__7199086__7204804 [0,2,0,0,0,0|2,0,0]=4 1853 B9R0.48 CC(CCO)SC[C@H](C)N m_7__20871336__14772890 [0,2,0,0,0,0|2,0,0]=4 1854 B9R0.48 CC(F)CCN(C)CCN m_269982__10894792__13165362 [0,2,0,0,0,0|2,0,0]=4 1855 B9R0.48 CC(F)CCN(C)CCO m_2230__679202__13165354 [0,2,0,0,0,0|1,0,0]=3 1856 B9R0.48 CC(F)CNC(=O)CCO m_487__13461114__12879784 [0,2,0,0,0,0|2,0,0]=4 1857 B9R0.48 CC(F)CNC(C)CCO m_2230__22400640__16970752 [0,2,0,0,0,0|2,0,0]=4 1858 B9R0.48 CC(F)CSC(C)CCO m_7__5819074__16970746 [0,2,0,0,0,0|2,0,0]=4 1859 B9R0.48 CC(O)CCN(C)CCN m_269982__10894792__22488918 [0,2,0,0,0,0|2,0,0]=4 1860 B9R0.48 CC(O)CCN(C)CCO m_2230__679202__12057944 [0,2,0,0,0,0|1,0,0]=3 1861 B9R0.48 CC(O)CNC(=O)CCO m_487__150687__12879784 [0,2,0,0,0,0|2,0,0]=4 1862 B9R0.48 CC(O)CNC(C)CCN m_269982__22505446__13193380 [0,2,0,0,0,0|2,0,0]=4 1863 B9R0.48 CC(O)CNC(C)CCO m_2230__22400640__9736146 [0,2,0,0,0,0|2,0,0]=4 1864 B9R0.48 CC(O)CN[C@H](C)CCF m_2230__22404666__9736146 [0,2,0,0,0,0|2,0,0]=4 1865 B9R0.48 CC(O)CSC(C)CCO m_7__10953796__14772890 [0,2,0,0,0,0|1,1,0]=4 1866 B9R0.48 CCCC(=O)NCC(C)O m_270062__7600310__17814498 [0,2,0,0,0,0|1,0,1]=4 1867 B9R0.48 CCCC(=O)OCC(=O)O m_279392__16562886__16560928 [0,2,0,0,0,0|0,0,2]=4 1868 B9R0.48 CCCC(=O)OCC(C)C m_276436__14076548__14088342 [0,2,0,0,0,0|1,0,1]=4 1869 B9R0.48 CCCC(=O)OCC(C)F m_276436__16886366__14088342 [0,2,0,0,0,0|1,0,1]=4 1870 B9R0.48 CCCC(=O)OCC(C)O m_1458__473330__9780094 [0,2,0,0,0,0|0,0,1]=3 1871 B9R0.48 CCCC(=O)OCC(F)F m_276436__14075804__14088342 [0,2,0,0,0,0|1,0,1]=4 1872 B9R0.48 CCCC(=O)OC[C@H](C)F m_276436__21811854__14088342 [0,2,0,0,0,0|1,0,1]=4 1873 B9R0.48 CCCC(C)NCC(C)C m_207__894802__121216 [0,2,0,0,0,0|2,0,0]=4 1874 B9R0.48 CCCC(C)NCC(C)F m_2230__22397382__16970752 [0,2,0,0,0,0|2,0,0]=4 1875 B9R0.48 CCCC(C)NCC(C)N m_272690__11349360__11346328 [0,2,0,0,0,0|2,0,0]=4 1876 B9R0.48 CCCC(C)NCC(C)O m_2230__22397382__9736146 [0,2,0,0,0,0|1,0,0]=3 1877 B9R0.48 CCCC(C)NCC(F)Cl m_269862__21631480__7200560 [0,2,0,0,0,0|2,0,0]=4 1878 B9R0.48 CCCC(C)NCC(F)F m_2230__22397382__8371038 [0,2,0,0,0,0|2,0,0]=4 1879 B9R0.48 CCCC(C)SCC(=O)O m_7__26823__6493860 [0,2,0,0,0,0|0,1,1]=4 1880 B9R0.48 CCCC(C)SCC(C)C m_62__1010136__10638528 [0,2,0,0,0,0|1,1,0]=4 1881 B9R0.48 CCCC(C)SCC(C)F m_7__14428530__16970746 [0,2,0,0,0,0|1,1,0]=4 1882 B9R0.48 CCCC(C)SCC(C)O m_63__14428534__10903854 [0,2,0,0,0,0|0,1,0]=3 1883 B9R0.48 CCCC(C)SCC(F)F m_7__14428530__16886816 [0,2,0,0,0,0|1,1,0]=4 1884 B9R0.48 CCCC(C)SC[C@H](C)N m_7__20871336__6493860 [0,2,0,0,0,0|1,1,0]=4 1885 B9R0.48 CCCN(C)CCC(C)C m_2230__2261920__681192 [0,2,0,0,0,0|2,0,0]=4 1886 B9R0.48 CCCN(C)CCC(C)F m_2230__2261920__13165354 [0,2,0,0,0,0|2,0,0]=4 1887 B9R0.48 CCCN(C)CCC(C)O m_2230__2261920__12057944 [0,2,0,0,0,0|2,0,0]=4 1888 B9R0.48 CCCN(C)CC[C@H](C)O m_2230__18186218__13271112 [0,2,0,0,0,0|2,0,0]=4 1889 B9R0.48 CCOC(C)SCC(C)O m_7__10953796__13420948 [0,2,0,0,0,0|1,1,0]=4 1890 B9R0.48 CN(C)CCN(C)CCO m_2230__15141024__2463448 [0,2,0,0,0,0|2,0,0]=4 1891 B9R0.48 CN(CCO)CCS(=O)C m_2230__679202__11566586 [0,2,0,0,0,0|2,0,0]=4 1892 B9R0.48 CNCC(C)NCC(C)O m_269982__22505308__13193380 [0,2,0,0,0,0|2,0,0]=4 1893 B9R0.48 COCC(=O)OCC(C)O m_1458__473580__9780094 [0,2,0,0,0,0|1,0,1]=4 1894 B9R0.48 COCC(C)NCC(C)O m_270004__8288774__8844972 [0,2,0,0,0,0|2,0,0]=4 1895 B9R0.48 COCC(C)SCC(C)O m_7__10953796__6339266 [0,2,0,0,0,0|1,1,0]=4 1896 B9R0.48 COC[C@@H](C)NCC(C)O m_2230__22399844__9736146 [0,2,0,0,0,0|2,0,0]=4 1897 B9R0.48 CSCC(C)NCC(C)O m_2230__22400632__9736146 [0,2,0,0,0,0|2,0,0]=4 1898 B9R0.48 C[C@@H](N)CCN(C)CCN m_269982__10894792__25012466 [0,2,0,0,0,0|2,0,0]=4 1899 B9R0.48 C[C@@H](N)CCN(C)CCO m_269982__22515300__25012466 [0,2,0,0,0,0|1,0,0]=3 1900 B9R0.48 C[C@H](O)CCN(C)CCF m_2230__18186218__22320836 [0,2,0,0,0,0|2,0,0]=4 1901 B9R0.48 C[C@H](O)CCN(C)CCN m_269982__18186278__14439794 [0,2,0,0,0,0|2,0,0]=4 1902 B9R0.48 C[C@H](O)CCN(C)CCO m_2230__18186218__6165700 [0,2,0,0,0,0|1,0,0]=3 1903 B9R0.66 CC(C)(CCF)NCCO m_2230__22404530__6165700 [0,2,0,0,0,0|2,0,0]=4 1904 B9R0.66 CC(C)(CCN)NCCO m_269982__17754758__10880280 [0,2,0,0,0,0|2,0,0]=4 1905 B9R0.66 CC(C)(CCO)NCCO m_2230__22483446__6165700 [0,2,0,0,0,0|2,0,0]=4 1906 B9R0.66 CC(C)(CCO)SCCO m_7__22988032__102708 [0,2,0,0,0,0|1,1,0]=4 1907 B9R0.66 CCCCS(=O)(=O)CCC m_7__18083418__14390332 [0,2,0,0,0,0|1,1,0]=4 1908 B9R0.66 CCCCS(=O)(=O)CCF m_2714__10638524__8846984 [0,2,0,0,0,0|1,1,0]=4 1909 B9R0.66 CCCCS(=O)(=O)CCO m_2714__10638524__3173174 [0,2,0,0,0,0|0,1,0]=3 1910 B9R0.66 CCCNC(C)(C)CCO m_2230__22483446__13271112 [0,2,0,0,0,0|2,0,0]=4 1911 B9R0.66 CCCNS(=O)(=O)CCO m_40__79717__20064332 [0,2,0,0,0,0|1,1,0]=4 1912 B9R0.66 CCCS(=O)(=O)NCCO m_40__5439026__1309244 [0,2,0,0,0,0|2,0,0]=4 1913 B9R0.66 CCCSC(C)(C)CCO m_7__22988032__14390332 [0,2,0,0,0,0|2,0,0]=4 1914 B9R0.66 CCNC(C)(C)CCCO m_2230__22404324__22383854 [0,2,0,0,0,0|2,0,0]=4 1915 B9R0.66 CCNCC(C)(C)CCO m_270004__8297380__24715004 [0,2,0,0,0,0|2,0,0]=4 1916 B9R0.66 CCSCC(C)(C)CCO m_7__22987770__17549726 [0,2,0,0,0,0|2,0,0]=4 1917 B9R0.66 CCSCC(C)(O)CCO m_7__22987770__22788490 [0,2,0,0,0,0|2,0,0]=4 1918 B9R0.66 COCC(C)(C)NCCO m_2230__3081250__6165700 [0,2,0,0,0,0|2,0,0]=4 1919 B9R0.66 COCCS(=O)(=O)CCO m_2714__6283136__16982410 [0,2,0,0,0,0|1,1,0]=4 1920 B9R0.66 CSCC(C)(C)NCCO m_2230__13445220__6165700 [0,2,0,0,0,0|2,0,0]=4 1921 B9R0.66 CSCCS(=O)(=O)CCO m_62__875850__17322556 [0,2,0,0,0,0|1,1,0]=4 1922 B9R0.66 O=S(=O)(CCO)CCCF m_2714__17315396__3173174 [0,2,0,0,0,0|1,1,0]=4 1923 B9R0.66 O=S(=O)(CCO)CCCO m_2714__6283136__4903242 [0,2,0,0,0,0|1,1,0]=4 1924 B9R0.2 C#CCCCNCC(C)O m_273610__11527674__11516404 [0,2,0,0,0,0|1,0,1]=4 1925 B9R0.2 C#CCCCSCC(C)O m_7__10953796__10211628 [0,2,0,0,0,0|0,1,1]=4 1926 B9R0.2 C#CCCSCCC(C)C m_62__7021584__18060662 [0,2,0,0,0,0|1,1,0]=4 1927 B9R0.2 C#CCCSCCC(C)F m_62__13165346__18060662 [0,2,0,0,0,0|1,1,0]=4 1928 B9R0.2 C#CCCSCCC(C)N m_34__20871470__22325280 [0,2,0,0,0,0|1,1,0]=4 1929 B9R0.2 C#CCCSCCC(C)O m_62__12057938__18060662 [0,2,0,0,0,0|1,1,0]=4 1930 B9R0.2 C#CCOCCSC(C)C m_62__2390328__19973326 [0,2,0,0,0,0|1,0,1]=4 1931 B9R0.2 C#CCOCSCC(C)C m_7__27301__10548336 [0,2,0,0,0,0|1,0,1]=4 1932 B9R0.2 C#CCOCSCC(C)O m_7__10953796__10548336 [0,2,0,0,0,0|1,0,1]=4 1933 B9R0.2 C/C=C/CCSCC(C)O m_7__10953796__23858408 [0,2,0,0,0,0|0,1,1]=4 1934 B9R0.2 C=C(Br)CCCSCCO m_7__128807__22489510 [0,2,0,0,0,0|0,1,1]=4 1935 B9R0.2 C=C(Br)CCSCCCC m_62__15782476__7021588 [0,2,0,0,0,0|1,1,0]=4 1936 B9R0.2 C=C(C)CCCNCCC m_270004__8288780__23155958 [0,2,0,0,0,0|2,0,0]=4 1937 B9R0.2 C=C(C)CCCNCCO m_270004__8349608__23155958 [0,2,0,0,0,0|1,0,0]=3 1938 B9R0.2 C=C(C)CCCSCCC m_62__13608160__875868 [0,2,0,0,0,0|1,1,0]=4 1939 B9R0.2 C=C(C)CCCSCCN m_7__20871276__13608156 [0,2,0,0,0,0|1,1,0]=4 1940 B9R0.2 C=C(C)CCCSCCO m_62__13608160__10178562 [0,2,0,0,0,0|0,1,0]=3 1941 B9R0.2 C=C(C)CCSCCCC m_62__10158742__7021588 [0,2,0,0,0,0|1,1,0]=4 1942 B9R0.2 C=C(C)CCSCCCO m_7__10972294__10158738 [0,2,0,0,0,0|0,1,1]=4 1943 B9R0.2 C=C(C)CCSCCOC m_62__10158742__8623480 [0,2,0,0,0,0|0,1,1]=4 1944 B9R0.2 C=C(C)COCCNCC m_270004__8298652__24715004 [0,2,0,0,0,0|1,0,1]=4 1945 B9R0.2 C=C(C)CSCCCCO m_7__22849690__5949 [0,2,0,0,0,0|1,0,1]=4 1946 B9R0.2 C=C(Cl)CCCSCCO m_7__128807__14423954 [0,2,0,0,0,0|0,1,1]=4 1947 B9R0.2 C=CCCCNCC(C)O m_273610__16486414__11516404 [0,2,0,0,0,0|1,0,1]=4 1948 B9R0.2 C=CCCCSCC(C)O m_7__10953796__16929008 [0,2,0,0,0,0|0,1,1]=4 1949 B9R0.2 C=CCCNCCC(C)C m_207__11969928__134014 [0,2,0,0,0,0|2,0,0]=4 1950 B9R0.2 C=CCCSCCC(C)C m_62__7021584__9875548 [0,2,0,0,0,0|1,1,0]=4 1951 B9R0.2 C=CCCSCCC(C)F m_62__13165346__9875548 [0,2,0,0,0,0|1,1,0]=4 1952 B9R0.2 C=CCCSCCC(C)N m_34__20871470__9875956 [0,2,0,0,0,0|1,1,0]=4 1953 B9R0.2 C=CCCSCCC(C)O m_62__12057938__9875548 [0,2,0,0,0,0|1,1,0]=4 1954 B9R0.2 C=CCOCCNC(C)C m_269862__8601150__7204804 [0,2,0,0,0,0|1,0,1]=4 1955 B9R0.2 C=CCOCCSC(C)C m_62__2390328__13774596 [0,2,0,0,0,0|1,0,1]=4 1956 B9R0.2 C=CCOCSCC(C)C m_7__27301__12361584 [0,2,0,0,0,0|1,0,1]=4 1957 B9R0.2 C=CCOCSCC(C)O m_7__10953796__12361584 [0,2,0,0,0,0|1,0,1]=4 1958 B9R0.2 CC#CCCNCC(C)O m_273610__11526588__11516404 [0,2,0,0,0,0|1,0,1]=4 1959 B9R0.2 CC#CCCSCC(C)O m_7__10953796__8803406 [0,2,0,0,0,0|0,1,1]=4 1960 B9R0.2 CC(=CCCSCCO)C m_62__12121620__10178562 [0,2,0,0,0,0|0,1,1]=4 1961 B9R0.2 CC(=O)CCCSCCN m_7__20871276__322712 [0,2,0,0,0,0|1,1,0]=4 1962 B9R0.2 CC(=O)CCCSCCO m_7__128807__322712 [0,2,0,0,0,0|0,1,0]=3 1963 B9R0.2 CC(=O)CCSCCCO m_7__10972294__107330 [0,2,0,0,0,0|0,1,1]=4 1964 B9R0.2 CC(=O)CSCCCCO m_7__22849690__5065 [0,2,0,0,0,0|1,0,1]=4 1965 B9R0.2 CC(=O)NCCCCCO m_270062__16411460__15585492 [0,2,0,0,0,0|1,0,1]=4 1966 B9R0.2 CC(=O)NCCOCCF m_270062__12130430__15585492 [0,2,0,0,0,0|1,0,1]=4 1967 B9R0.2 CC(=O)NCCOCCN m_240690__24463340__7404532 [0,2,0,0,0,0|1,0,1]=4 1968 B9R0.2 CC(=O)NCCOCCO m_270062__7600314__15585492 [0,2,0,0,0,0|0,0,1]=3 1969 B9R0.2 CC(=O)NCCOCCS m_270062__16502908__15585492 [0,2,0,0,0,0|0,1,1]=4 1970 B9R0.2 CC(=O)NCCSCCO m_7__17756534__102708 [0,2,0,0,0,0|0,1,1]=4 1971 B9R0.2 CC(=O)OCCCCCO m_1458__473186__9435312 [0,2,0,0,0,0|1,0,1]=4 1972 B9R0.2 CC(=O)OCCOCCF m_276436__16437580__14088324 [0,2,0,0,0,0|1,0,1]=4 1973 B9R0.2 CC(=O)OCCOCCO m_1458__473186__5449384 [0,2,0,0,0,0|0,0,1]=3 1974 B9R0.2 CC(=O)OCCSCCO m_7__128807__22601252 [0,2,0,0,0,0|0,1,1]=4 1975 B9R0.2 CC(C)C=NOCCCO m_34__19446766__7931512 [0,2,0,0,0,0|1,0,1]=4 1976 B9R0.2 CC(C)CCCNCCF m_207__18491578__7912414 [0,2,0,0,0,0|2,0,0]=4 1977 B9R0.2 CC(C)CCCNCCO m_207__121484__7912414 [0,2,0,0,0,0|1,0,0]=3 1978 B9R0.2 CC(C)CCCSCCF m_7__8333108__22320828 [0,2,0,0,0,0|1,1,0]=4 1979 B9R0.2 CC(C)CCCSCCN m_7__20871276__10892836 [0,2,0,0,0,0|1,1,0]=4 1980 B9R0.2 CC(C)CCCSCCO m_7__8333108__102708 [0,2,0,0,0,0|0,1,0]=3 1981 B9R0.2 CC(C)CCNCCC#N m_207__13637936__134014 [0,2,0,0,0,0|2,0,0]=4 1982 B9R0.2 CC(C)CCNCCCF m_207__17065564__134014 [0,2,0,0,0,0|2,0,0]=4 1983 B9R0.2 CC(C)CCNCCCO m_207__109475__134014 [0,2,0,0,0,0|1,0,0]=3 1984 B9R0.2 CC(C)CCSCCC#N m_7__10953802__102951 [0,2,0,0,0,0|1,1,0]=4 1985 B9R0.2 CC(C)CCSCCCF m_7__22987856__16896928 [0,2,0,0,0,0|1,1,0]=4 1986 B9R0.2 CC(C)CCSCCCN m_7__20871288__102951 [0,2,0,0,0,0|1,1,0]=4 1987 B9R0.2 CC(C)CCSCCCO m_7__22987856__6354 [0,2,0,0,0,0|0,1,0]=3 1988 B9R0.2 CC(C)CNCC=CCO m_207__11971532__121216 [0,2,0,0,0,0|1,0,1]=4 1989 B9R0.2 CC(C)CNCCCCCl m_270004__8288546__24721168 [0,2,0,0,0,0|2,0,0]=4 1990 B9R0.2 CC(C)CNCCCCF m_207__10390152__121216 [0,2,0,0,0,0|2,0,0]=4 1991 B9R0.2 CC(C)CNCCCCO m_207__9433150__121216 [0,2,0,0,0,0|1,0,0]=3 1992 B9R0.2 CC(C)COCSCCO m_7__128807__12637718 [0,2,0,0,0,0|0,1,0]=3 1993 B9R0.2 CC(C)CSCC#CCO m_62__1010136__15141012 [0,2,0,0,0,0|1,0,1]=4 1994 B9R0.2 CC(C)CSCC=CCO m_7__27301__16809272 [0,2,0,0,0,0|1,0,1]=4 1995 B9R0.2 CC(C)CSCCCCF m_62__1010136__10157916 [0,2,0,0,0,0|1,1,0]=4 1996 B9R0.2 CC(C)CSCCCCN m_34__20871448__6894142 [0,2,0,0,0,0|1,1,0]=4 1997 B9R0.2 CC(C)CSCCCCO m_7__27301__3191338 [0,2,0,0,0,0|1,0,0]=3 1998 B9R0.2 CC(C)CSCCCON m_7__22987730__1010132 [0,2,0,0,0,0|2,0,0]=4 1999 B9R0.2 CC(C)CSCSCCO m_7__128807__15703842 [0,2,0,0,0,0|0,1,0]=3 2000 B9R0.2 CC(C)NCC#CCCO m_269862__21536040__7204804 [0,2,0,0,0,0|1,0,1]=4 2001 B9R0.2 CC(C)NCCC#CCO m_269862__21537560__7204804 [0,2,0,0,0,0|1,0,1]=4 2002 B9R0.2 CC(C)NCCCCCCl m_270004__23845338__24721510 [0,2,0,0,0,0|2,0,0]=4 2003 B9R0.2 CC(C)NCCCCCF m_269862__15773418__7204804 [0,2,0,0,0,0|2,0,0]=4 2004 B9R0.2 CC(C)NCCCCCO m_269862__9456966__7204804 [0,2,0,0,0,0|1,0,0]=3 2005 B9R0.2 CC(C)NCCOCCF m_269862__12130426__7204804 [0,2,0,0,0,0|1,0,0]=3 2006 B9R0.2 CC(C)NCCOCCO m_269862__7193024__7204804 [0,2,0,0,0,0|0,0,0]=2 2007 B9R0.2 CC(C)NCCOCCS m_269862__16502904__7204804 [0,2,0,0,0,0|0,1,0]=3 2008 B9R0.2 CC(C)NCCSCCO m_269862__21508856__7204804 [0,2,0,0,0,0|0,1,0]=3 2009 B9R0.2 CC(C)OCCSCCF m_7__22987390__22320828 [0,2,0,0,0,0|1,1,0]=4 2010 B9R0.2 CC(C)OCCSCCN m_7__20871276__6311 [0,2,0,0,0,0|1,1,0]=4 2011 B9R0.2 CC(C)OCCSCCO m_7__22987390__102708 [0,2,0,0,0,0|0,1,0]=3 2012 B9R0.2 CC(C)SCCCCCF m_62__2390328__9984634 [0,2,0,0,0,0|2,0,0]=4 2013 B9R0.2 CC(C)SCCCCCN m_34__20871474__6950544 [0,2,0,0,0,0|2,0,0]=4 2014 B9R0.2 CC(C)SCCNCCN m_34__20871452__6950544 [0,2,0,0,0,0|2,0,0]=4 2015 B9R0.2 CC(C)SCCOCCF m_7__22988070__5048 [0,2,0,0,0,0|1,0,0]=3 2016 B9R0.2 CC(C)SCCOCCN m_34__20871476__6950544 [0,2,0,0,0,0|1,0,0]=3 2017 B9R0.2 CC(C)SCCOCCO m_62__2390328__8799516 [0,2,0,0,0,0|0,0,0]=2 2018 B9R0.2 CC(C)SCCSCCN m_7__20871276__9870380 [0,2,0,0,0,0|1,1,0]=4 2019 B9R0.2 CC(C)SCCSCCO m_7__128807__9870380 [0,2,0,0,0,0|0,1,0]=3 2020 B9R0.2 CC(C)SCSCCCO m_7__10972294__12306378 [0,2,0,0,0,0|1,1,0]=4 2021 B9R0.2 CC(F)CCNCCC#N m_273610__11529660__11515974 [0,2,0,0,0,0|2,0,0]=4 2022 B9R0.2 CC(F)CCSCCC#N m_7__10953802__13165340 [0,2,0,0,0,0|1,1,0]=4 2023 B9R0.2 CC(F)CCSCCCN m_7__20871288__13165340 [0,2,0,0,0,0|1,1,0]=4 2024 B9R0.2 CC(F)CCSCCCO m_7__10972294__13165340 [0,2,0,0,0,0|0,1,0]=3 2025 B9R0.2 CC(F)CNCCCCCl m_270004__13461138__24721168 [0,2,0,0,0,0|2,0,0]=4 2026 B9R0.2 CC(F)CSCCCCF m_62__10157914__16913488 [0,2,0,0,0,0|1,1,0]=4 2027 B9R0.2 CC(F)CSCCCCN m_34__20871448__16970748 [0,2,0,0,0,0|1,1,0]=4 2028 B9R0.2 CC(F)CSCCCCO m_7__22849690__16970746 [0,2,0,0,0,0|1,0,0]=3 2029 B9R0.2 CC(F)CSCCCON m_7__22987730__16970746 [0,2,0,0,0,0|2,0,0]=4 2030 B9R0.2 CC(N)CCSCCC#N m_7__20871360__5102 [0,2,0,0,0,0|1,1,0]=4 2031 B9R0.2 CC(N)CCSCCCF m_34__20871470__16896930 [0,2,0,0,0,0|1,1,0]=4 2032 B9R0.2 CC(N)CCSCCCO m_34__20871470__7931512 [0,2,0,0,0,0|0,1,0]=3 2033 B9R0.2 CC(O)CCCSCCN m_7__20871276__10688172 [0,2,0,0,0,0|1,1,0]=4 2034 B9R0.2 CC(O)CCCSCCO m_7__128807__10688172 [0,2,0,0,0,0|0,1,0]=3 2035 B9R0.2 CC(O)CCNCCC#N m_273610__11554168__11515974 [0,2,0,0,0,0|2,0,0]=4 2036 B9R0.2 CC(O)CCSCCC#N m_7__10953802__12057932 [0,2,0,0,0,0|1,1,0]=4 2037 B9R0.2 CC(O)CCSCCCN m_7__20871288__12057932 [0,2,0,0,0,0|1,1,0]=4 2038 B9R0.2 CC(O)CCSCCCO m_7__10972294__12057932 [0,2,0,0,0,0|0,1,0]=3 2039 B9R0.2 CC(O)CNCC#CCO m_273610__11554540__11516404 [0,2,0,0,0,0|1,0,1]=4 2040 B9R0.2 CC(O)CNCC=CCO m_273610__13857830__11516404 [0,2,0,0,0,0|1,0,1]=4 2041 B9R0.2 CC(O)CNCCCC#N m_273610__11526768__11516404 [0,2,0,0,0,0|1,0,1]=4 2042 B9R0.2 CC(O)CNCCCCCl m_270004__8288774__24721168 [0,2,0,0,0,0|1,0,0]=3 2043 B9R0.2 CC(O)CNCCCCF m_273610__11529444__11516404 [0,2,0,0,0,0|1,0,0]=3 2044 B9R0.2 CC(O)CNCCCCO m_273610__11554164__11516404 [0,2,0,0,0,0|1,0,0]=3 2045 B9R0.2 CC(O)CSCC#CCO m_7__10953796__15141006 [0,2,0,0,0,0|1,0,1]=4 2046 B9R0.2 CC(O)CSCC=CCO m_7__10953796__16809272 [0,2,0,0,0,0|1,0,1]=4 2047 B9R0.2 CC(O)CSCCCC#N m_7__10953796__9281768 [0,2,0,0,0,0|0,1,1]=4 2048 B9R0.2 CC(O)CSCCCCF m_7__10953796__10157908 [0,2,0,0,0,0|0,1,0]=3 2049 B9R0.2 CC(O)CSCCCCN m_7__20871294__10902704 [0,2,0,0,0,0|0,1,0]=3 2050 B9R0.2 CC(O)CSCCCCO m_7__10953796__3191338 [0,2,0,0,0,0|0,1,0]=3 2051 B9R0.2 CC(O)CSCCCON m_7__22987730__10902704 [0,2,0,0,0,0|1,1,0]=4 2052 B9R0.2 CCC#CCSCC(C)O m_7__10953796__22599172 [0,2,0,0,0,0|0,1,1]=4 2053 B9R0.2 CCC=CCNCC(C)O m_273610__17312600__11516404 [0,2,0,0,0,0|1,0,1]=4 2054 B9R0.2 CCC=NOCCC(C)C m_34__17309904__6894144 [0,2,0,0,0,0|1,0,1]=4 2055 B9R0.2 CCC=NOCCC(C)F m_34__17309904__13165342 [0,2,0,0,0,0|1,0,1]=4 2056 B9R0.2 CCC=NOCCC(C)O m_34__17309904__12057934 [0,2,0,0,0,0|1,0,1]=4 2057 B9R0.2 CCCC=NOCC(C)C m_4__7659376__7831606 [0,2,0,0,0,0|1,0,1]=4 2058 B9R0.2 CCCC=NOCC(F)F m_4__8761828__7831606 [0,2,0,0,0,0|1,0,1]=4 2059 B9R0.2 CCCCCCCC(=O)N m_22__58357__335742 [0,2,0,0,0,0|1,0,1]=4 2060 B9R0.2 CCCCCCCN(C)C m_2230__22407266__2463448 [0,2,0,0,0,0|2,0,0]=4 2061 B9R0.2 CCCCCCNC(C)C m_269862__7192686__7204804 [0,2,0,0,0,0|2,0,0]=4 2062 B9R0.2 CCCCCCSC(C)C m_62__2390328__8854724 [0,2,0,0,0,0|2,0,0]=4 2063 B9R0.2 CCCCCNCC(C)C m_207__109488__121216 [0,2,0,0,0,0|2,0,0]=4 2064 B9R0.2 CCCCCNCC(C)O m_273610__11516430__11516404 [0,2,0,0,0,0|1,0,0]=3 2065 B9R0.2 CCCCCOCC(=O)N m_22__58357__2303698 [0,2,0,0,0,0|0,0,2]=4 2066 B9R0.2 CCCCCSCC(=O)O m_7__26823__5063386 [0,2,0,0,0,0|0,1,1]=4 2067 B9R0.2 CCCCCSCC(C)C m_62__1010136__5063392 [0,2,0,0,0,0|1,1,0]=4 2068 B9R0.2 CCCCCSCC(C)F m_62__5063390__16913488 [0,2,0,0,0,0|1,1,0]=4 2069 B9R0.2 CCCCCSCC(C)O m_63__8271842__10903854 [0,2,0,0,0,0|0,1,0]=3 2070 B9R0.2 CCCCCSCC(F)F m_7__8271838__16886816 [0,2,0,0,0,0|1,1,0]=4 2071 B9R0.2 CCCCCSC[C@H](C)N m_7__20871336__5063386 [0,2,0,0,0,0|1,1,0]=4 2072 B9R0.2 CCCCNCCC(=O)N m_273610__13857014__11515976 [0,2,0,0,0,0|1,0,1]=4 2073 B9R0.2 CCCCNCCC(C)C m_207__109452__134014 [0,2,0,0,0,0|2,0,0]=4 2074 B9R0.2 CCCCON=CC(C)C m_34__19446766__10978696 [0,2,0,0,0,0|1,0,1]=4 2075 B9R0.2 CCCCSCCC(=O)N m_62__875776__593690 [0,2,0,0,0,0|0,1,1]=4 2076 B9R0.2 CCCCSCCC(C)C m_7__22987856__770176 [0,2,0,0,0,0|1,1,0]=4 2077 B9R0.2 CCCCSCCC(C)F m_62__13165346__7021588 [0,2,0,0,0,0|1,1,0]=4 2078 B9R0.2 CCCCSCCC(C)N m_7__20871360__770176 [0,2,0,0,0,0|1,1,0]=4 2079 B9R0.2 CCCCSCCC(C)O m_62__12057938__7021588 [0,2,0,0,0,0|0,1,0]=3 2080 B9R0.2 CCCCSCCC(F)F m_7__22986868__770176 [0,2,0,0,0,0|1,1,0]=4 2081 B9R0.2 CCCCSCCN(C)C m_7__6950568__770176 [0,2,0,0,0,0|1,1,0]=4 2082 B9R0.2 CCCNCCCC(C)C m_207__109413__7912414 [0,2,0,0,0,0|2,0,0]=4 2083 B9R0.2 CCCOCCCC(=O)N m_22__58357__15260352 [0,2,0,0,0,0|1,0,1]=4 2084 B9R0.2 CCCOCCNC(=O)C m_22__22618332__58844 [0,2,0,0,0,0|1,0,1]=4 2085 B9R0.2 CCCOCCOC(=O)C m_276436__14077810__14088324 [0,2,0,0,0,0|1,0,1]=4 2086 B9R0.2 CCCOCCSC(C)C m_62__2390328__15503588 [0,2,0,0,0,0|1,0,0]=3 2087 B9R0.2 CCCOCSCC(=O)O m_7__26823__12342842 [0,2,0,0,0,0|0,1,1]=4 2088 B9R0.2 CCCOCSCC(C)C m_7__27301__12361582 [0,2,0,0,0,0|1,0,0]=3 2089 B9R0.2 CCCOCSCC(C)O m_7__10953796__12361582 [0,2,0,0,0,0|0,1,0]=3 2090 B9R0.2 CCCOCSCC(F)F m_7__22987700__12361582 [0,2,0,0,0,0|1,1,0]=4 2091 B9R0.2 CCCOCSC[C@H](C)N m_7__20871336__12342842 [0,2,0,0,0,0|1,0,0]=3 2092 B9R0.2 CCCON=CCC(C)C m_4__11573770__286510 [0,2,0,0,0,0|1,0,1]=4 2093 B9R0.2 CCCSCCCC(=O)C m_7__22986886__322712 [0,2,0,0,0,0|1,1,0]=4 2094 B9R0.2 CCCSCCCC(C)C m_62__10892842__875868 [0,2,0,0,0,0|1,1,0]=4 2095 B9R0.2 CCCSCCCC(C)O m_7__22986886__10688172 [0,2,0,0,0,0|1,0,0]=3 2096 B9R0.2 CCCSCCCC(Cl)Cl m_62__875778__23915480 [0,2,0,0,0,0|1,1,0]=4 2097 B9R0.2 CCCSCCCC(F)F m_62__875778__18239798 [0,2,0,0,0,0|1,1,0]=4 2098 B9R0.2 CCCSCCCN(C)C m_7__22986886__22787728 [0,2,0,0,0,0|1,1,0]=4 2099 B9R0.2 CCCSCCOC(C)C m_62__3569224__875868 [0,2,0,0,0,0|1,1,0]=4 2100 B9R0.2 CCCSCCSC(C)C m_62__875778__10158466 [0,2,0,0,0,0|1,1,0]=4 2101 B9R0.2 CCCSCOCC(C)C m_7__22986886__12637718 [0,2,0,0,0,0|1,0,0]=3 2102 B9R0.2 CCCSCOCC(F)F m_7__22986886__13807872 [0,2,0,0,0,0|1,0,0]=3 2103 B9R0.2 CCCSCSCC(C)C m_7__22986886__15703842 [0,2,0,0,0,0|1,1,0]=4 2104 B9R0.2 CCNCCCCC(C)C m_270004__23843868__24715004 [0,2,0,0,0,0|2,0,0]=4 2105 B9R0.2 CCNCCCCC(F)F m_270004__21500266__24715004 [0,2,0,0,0,0|2,0,0]=4 2106 B9R0.2 CCNCCOCC(=O)N m_270004__23847304__24715004 [0,2,0,0,0,0|0,0,2]=4 2107 B9R0.2 CCNCCOCC(C)C m_270004__8290642__24715004 [0,2,0,0,0,0|1,0,0]=3 2108 B9R0.2 CCNCCOCC(F)F m_270004__9208848__24715004 [0,2,0,0,0,0|1,0,0]=3 2109 B9R0.2 CCNCCSCC(C)C m_7__22986872__1010132 [0,2,0,0,0,0|1,1,0]=4 2110 B9R0.2 CCNCCSCC(C)F m_7__22986872__16970746 [0,2,0,0,0,0|1,1,0]=4 2111 B9R0.2 CCNCCSCC(C)O m_7__22986872__10902704 [0,2,0,0,0,0|0,1,0]=3 2112 B9R0.2 CCNCCSCC(F)F m_7__22986872__16886816 [0,2,0,0,0,0|1,1,0]=4 2113 B9R0.2 CCOCCNCC(C)C m_207__872232__121216 [0,2,0,0,0,0|2,0,0]=4 2114 B9R0.2 CCOCCNCC(C)O m_273610__11518832__11516404 [0,2,0,0,0,0|1,0,0]=3 2115 B9R0.2 CCOCCOCC(=O)N m_22__58357__1322832 [0,2,0,0,0,0|0,0,2]=4 2116 B9R0.2 CCOCCSCC(=O)O m_7__26823__5044 [0,2,0,0,0,0|0,1,1]=4 2117 B9R0.2 CCOCCSCC(C)C m_62__1010136__204256 [0,2,0,0,0,0|1,1,0]=4 2118 B9R0.2 CCOCCSCC(C)F m_62__204255__16913488 [0,2,0,0,0,0|1,1,0]=4 2119 B9R0.2 CCOCCSCC(C)O m_7__10953796__5044 [0,2,0,0,0,0|0,1,0]=3 2120 B9R0.2 CCOCCSCC(F)F m_7__22987700__5044 [0,2,0,0,0,0|1,1,0]=4 2121 B9R0.2 CCOCCSC[C@H](C)N m_7__20871336__5044 [0,2,0,0,0,0|1,1,0]=4 2122 B9R0.2 CCOCSCCC(C)C m_7__22987856__10176980 [0,2,0,0,0,0|1,1,0]=4 2123 B9R0.2 CCOCSCCC(C)N m_7__20871360__10176980 [0,2,0,0,0,0|1,1,0]=4 2124 B9R0.2 CCSCCNCC(C)C m_207__13975948__121216 [0,2,0,0,0,0|2,0,0]=4 2125 B9R0.2 CCSCCNCC(C)F m_270004__13461138__8765926 [0,2,0,0,0,0|2,0,0]=4 2126 B9R0.2 CCSCCNCC(C)O m_273610__13976000__11516404 [0,2,0,0,0,0|1,0,0]=3 2127 B9R0.2 CCSCCNCC(F)Br m_270004__23851146__8765926 [0,2,0,0,0,0|2,0,0]=4 2128 B9R0.2 CCSCCNCC(F)Cl m_270004__21631482__8765926 [0,2,0,0,0,0|2,0,0]=4 2129 B9R0.2 CCSCCNCC(F)F m_270004__10150310__8765926 [0,2,0,0,0,0|2,0,0]=4 2130 B9R0.2 CCSCCOCC(=O)N m_7__22987770__22786946 [0,2,0,0,0,0|0,0,2]=4 2131 B9R0.2 CCSCCOCC(C)C m_62__9820342__6469026 [0,2,0,0,0,0|1,0,0]=3 2132 B9R0.2 CCSCCOCC(F)F m_62__875846__13615350 [0,2,0,0,0,0|1,0,0]=3 2133 B9R0.2 CCSCCSCC(=O)O m_7__26823__5062078 [0,2,0,0,0,0|0,1,1]=4 2134 B9R0.2 CCSCCSCC(C)C m_7__8765656__1010132 [0,2,0,0,0,0|1,1,0]=4 2135 B9R0.2 CCSCCSCC(C)F m_7__8765656__16970746 [0,2,0,0,0,0|1,1,0]=4 2136 B9R0.2 CCSCCSCC(C)O m_7__8765656__10902704 [0,2,0,0,0,0|0,1,0]=3 2137 B9R0.2 CCSCCSCC(F)F m_7__8765656__16886816 [0,2,0,0,0,0|1,1,0]=4 2138 B9R0.2 CCSCCSC[C@H](C)N m_7__20871336__5062078 [0,2,0,0,0,0|1,1,0]=4 2139 B9R0.2 CCSCSCCC(C)C m_7__22987856__9456150 [0,2,0,0,0,0|1,1,0]=4 2140 B9R0.2 CCSCSCCC(C)N m_7__20871360__9456150 [0,2,0,0,0,0|1,1,0]=4 2141 B9R0.2 CN(C)CCCCCCN m_269982__12864432__14064228 [0,2,0,0,0,0|2,0,0]=4 2142 B9R0.2 CN(C)CCCSCCF m_7__15765946__22320828 [0,2,0,0,0,0|1,1,0]=4 2143 B9R0.2 CN(C)CCCSCCN m_7__20871276__22787728 [0,2,0,0,0,0|1,1,0]=4 2144 B9R0.2 CN(C)CCCSCCO m_7__15765946__102708 [0,2,0,0,0,0|0,1,0]=3 2145 B9R0.2 CN(C)CCOCCCN m_269982__22504818__14064228 [0,2,0,0,0,0|2,0,0]=4 2146 B9R0.2 CN(C)CCSCCCO m_7__6950568__6354 [0,2,0,0,0,0|1,1,0]=4 2147 B9R0.2 CNCCOCCC(=O)N m_240690__7368526__24777254 [0,2,0,0,0,0|1,0,1]=4 2148 B9R0.2 CNCCOCCN(C)C m_269982__12230994__14064228 [0,2,0,0,0,0|2,0,0]=4 2149 B9R0.2 CNCCSCCC(C)C m_7__22986920__102951 [0,2,0,0,0,0|1,1,0]=4 2150 B9R0.2 CNCCSCCC(C)F m_7__22986920__13165340 [0,2,0,0,0,0|1,1,0]=4 2151 B9R0.2 CNCCSCCC(C)O m_7__22986920__12057932 [0,2,0,0,0,0|1,1,0]=4 2152 B9R0.2 COCCCCNC(C)C m_269862__7194164__7204804 [0,2,0,0,0,0|2,0,0]=4 2153 B9R0.2 COCCCCSC(C)C m_62__2390328__10159086 [0,2,0,0,0,0|2,0,0]=4 2154 B9R0.2 COCCCNCC(C)C m_207__109474__121216 [0,2,0,0,0,0|2,0,0]=4 2155 B9R0.2 COCCCNCC(C)F m_270004__13461138__24710510 [0,2,0,0,0,0|2,0,0]=4 2156 B9R0.2 COCCCNCC(C)O m_273610__11516456__11516404 [0,2,0,0,0,0|1,0,0]=3 2157 B9R0.2 COCCCNCC(F)Br m_270004__23851146__24710510 [0,2,0,0,0,0|2,0,0]=4 2158 B9R0.2 COCCCNCC(F)Cl m_270004__21631482__24710510 [0,2,0,0,0,0|2,0,0]=4 2159 B9R0.2 COCCCNCC(F)F m_270004__10150310__24710510 [0,2,0,0,0,0|2,0,0]=4 2160 B9R0.2 COCCCOCC(=O)N m_22__58357__8282558 [0,2,0,0,0,0|0,0,2]=4 2161 B9R0.2 COCCCSCC(=O)O m_7__26823__9108870 [0,2,0,0,0,0|0,1,1]=4 2162 B9R0.2 COCCCSCC(C)C m_62__1010136__9108904 [0,2,0,0,0,0|1,1,0]=4 2163 B9R0.2 COCCCSCC(C)F m_62__9108898__16913488 [0,2,0,0,0,0|1,1,0]=4 2164 B9R0.2 COCCCSCC(C)O m_7__10953796__9108870 [0,2,0,0,0,0|0,1,0]=3 2165 B9R0.2 COCCCSCC(F)F m_7__17626136__16886816 [0,2,0,0,0,0|1,1,0]=4 2166 B9R0.2 COCCCSC[C@H](C)N m_7__20871336__9108870 [0,2,0,0,0,0|1,1,0]=4 2167 B9R0.2 COCCNCCC(C)C m_207__109486__134014 [0,2,0,0,0,0|1,0,0]=3 2168 B9R0.2 COCCOCCC(=O)N m_22__58357__1880256 [0,2,0,0,0,0|1,0,1]=4 2169 B9R0.2 COCCOCCN(C)C m_2230__10268178__2463448 [0,2,0,0,0,0|1,0,0]=3 2170 B9R0.2 COCCON=CC(C)C m_4__9452942__7831602 [0,2,0,0,0,0|1,0,1]=4 2171 B9R0.2 COCCONCC(C)O m_273610__11528094__11516404 [0,2,0,0,0,0|1,0,0]=3 2172 B9R0.2 COCCSCCC(=O)C m_7__6362310__107330 [0,2,0,0,0,0|0,1,1]=4 2173 B9R0.2 COCCSCCC(C)C m_62__7021584__8623480 [0,2,0,0,0,0|0,1,0]=3 2174 B9R0.2 COCCSCCC(C)F m_62__13165346__8623480 [0,2,0,0,0,0|0,1,0]=3 2175 B9R0.2 COCCSCCC(C)N m_34__20871470__323278 [0,2,0,0,0,0|0,1,0]=3 2176 B9R0.2 COCCSCCC(C)O m_62__12057938__8623480 [0,2,0,0,0,0|0,1,0]=3 2177 B9R0.2 COCCSCCC(F)F m_7__22986868__149891 [0,2,0,0,0,0|1,1,0]=4 2178 B9R0.2 COCCSCCN(C)C m_7__6362310__391100 [0,2,0,0,0,0|1,1,0]=4 2179 B9R0.2 COCCSCCS(=O)C m_7__6362310__11566584 [0,2,0,0,0,0|1,1,0]=4 2180 B9R0.2 COCCSCSC(C)C m_7__6362310__12306378 [0,2,0,0,0,0|1,1,0]=4 2181 B9R0.2 COCSCCCC(C)C m_7__8333108__6762 [0,2,0,0,0,0|2,0,0]=4 2182 B9R0.2 CS(=O)CCSCCCO m_7__10972294__11566584 [0,2,0,0,0,0|1,1,0]=4 2183 B9R0.2 CSCCCNCC(C)C m_207__5135872__121216 [0,2,0,0,0,0|2,0,0]=4 2184 B9R0.2 CSCCCNCC(C)O m_273610__11523336__11516404 [0,2,0,0,0,0|1,0,0]=3 2185 B9R0.2 CSCCCSCC(=O)O m_7__26823__16930422 [0,2,0,0,0,0|0,1,1]=4 2186 B9R0.2 CSCCCSCC(C)C m_7__10890048__1010132 [0,2,0,0,0,0|1,1,0]=4 2187 B9R0.2 CSCCCSCC(C)F m_7__10890048__16970746 [0,2,0,0,0,0|1,1,0]=4 2188 B9R0.2 CSCCCSCC(C)O m_7__10890048__10902704 [0,2,0,0,0,0|0,1,0]=3 2189 B9R0.2 CSCCCSCC(F)F m_7__10890048__16886816 [0,2,0,0,0,0|1,1,0]=4 2190 B9R0.2 CSCCCSC[C@H](C)N m_7__20871336__16930422 [0,2,0,0,0,0|1,1,0]=4 2191 B9R0.2 CSCCNCCC(C)C m_207__11946676__134014 [0,2,0,0,0,0|1,1,0]=4 2192 B9R0.2 CSCCOCCC(C)C m_62__15357102__876088 [0,2,0,0,0,0|0,1,0]=3 2193 B9R0.2 CSCCONCC(C)O m_273610__11528236__11516404 [0,2,0,0,0,0|1,0,0]=3 2194 B9R0.2 CSCCSCCC(C)C m_62__7021584__8268572 [0,2,0,0,0,0|0,2,0]=4 2195 B9R0.2 CSCCSCCC(C)F m_62__13165346__8268572 [0,2,0,0,0,0|0,2,0]=4 2196 B9R0.2 CSCCSCCC(C)N m_34__20871470__136507 [0,2,0,0,0,0|0,2,0]=4 2197 B9R0.2 CSCCSCCC(C)O m_62__12057938__8268572 [0,2,0,0,0,0|0,2,0]=4 2198 B9R0.2 C[C@H](N)CSCC#CCO m_7__20871336__15141006 [0,2,0,0,0,0|1,0,1]=4 2199 B9R0.2 C[C@H](N)CSCC=CCO m_7__20871336__16809272 [0,2,0,0,0,0|1,0,1]=4 2200 B9R0.2 C[C@H](N)CSCCCCF m_7__20871336__10157908 [0,2,0,0,0,0|1,1,0]=4 2201 B9R0.2 C[C@H](N)CSCCCCO m_7__20871336__3191338 [0,2,0,0,0,0|1,0,0]=3 2202 B9R0.2 FC(Br)CNCCCCCl m_270004__23851146__24721168 [0,2,0,0,0,0|2,0,0]=4 2203 B9R0.2 FC(Cl)CNCCCCCl m_270004__21631482__24721168 [0,2,0,0,0,0|2,0,0]=4 2204 B9R0.2 FC(F)CNCCCCCl m_270004__10150310__24721168 [0,2,0,0,0,0|2,0,0]=4 2205 B9R0.2 FCCCCSCC(F)F m_7__22987700__10157908 [0,2,0,0,0,0|1,1,0]=4 2206 B9R0.2 FCCSCCCC(F)F m_7__22986760__22320828 [0,2,0,0,0,0|1,1,0]=4 2207 B9R0.2 N=C(N)NCCOCCO m_58668__2991290__2227896 [0,2,0,0,0,0|1,0,1]=4 2208 B9R0.2 NC(=O)CCCSCCO m_7__128807__22787802 [0,2,0,0,0,0|0,1,1]=4 2209 B9R0.2 NC(=O)CCOCCCO m_22__58357__17833552 [0,2,0,0,0,0|1,0,1]=4 2210 B9R0.2 NCCCCSCC(F)F m_7__20871294__16886816 [0,2,0,0,0,0|1,1,0]=4 2211 B9R0.2 NCCCOCCC(=O)N m_240690__7368526__24777152 [0,2,0,0,0,0|1,0,1]=4 2212 B9R0.2 NCCOCCCC(=O)N m_240690__7368526__21394362 [0,2,0,0,0,0|1,0,1]=4 2213 B9R0.2 NCCSCCCC(Cl)Cl m_7__20871276__23915472 [0,2,0,0,0,0|1,1,0]=4 2214 B9R0.2 NCCSCCCC(F)F m_7__20871276__18239790 [0,2,0,0,0,0|1,1,0]=4 2215 B9R0.2 O=C(O)CSCCCCF m_7__26823__10157908 [0,2,0,0,0,0|0,1,1]=4 2216 B9R0.2 O=C(O)CSCCCCO m_7__26823__3191338 [0,2,0,0,0,0|0,1,1]=4 2217 B9R0.2 OCCCCSCC(F)F m_7__22987700__3191338 [0,2,0,0,0,0|1,1,0]=4 2218 B9R0.2 OCCCSCCC(F)F m_7__22986868__6354 [0,2,0,0,0,0|1,1,0]=4 2219 B9R0.2 OCCSCCCC(Cl)Cl m_7__128807__23915472 [0,2,0,0,0,0|0,1,0]=3 2220 B9R0.2 OCCSCCCC(F)F m_7__22986760__102708 [0,2,0,0,0,0|0,1,0]=3 2221 B9R0.2 OCCSCCOC(F)F m_62__13445082__10178562 [0,2,0,0,0,0|1,1,0]=4 2222 B9R0.2 OCCSCOCC(F)F m_7__128807__13807872 [0,2,0,0,0,0|1,1,0]=4 2223 B9R0.45 C#CCCCCCCSC m_62__875850__13442848 [0,2,0,0,0,0|2,0,0]=4 2224 B9R0.45 C#CCCCCCNCC m_270004__8160850__17825426 [0,2,0,0,0,0|2,0,0]=4 2225 B9R0.45 C#CCCCCCSCC m_7__22987770__23172888 [0,2,0,0,0,0|2,0,0]=4 2226 B9R0.45 C#CCCCCNCCC m_270004__8288780__17825424 [0,2,0,0,0,0|2,0,0]=4 2227 B9R0.45 C#CCCCCNCCO m_270004__8349608__17825424 [0,2,0,0,0,0|1,0,0]=3 2228 B9R0.45 C#CCCCCSCCC m_62__875778__17318686 [0,2,0,0,0,0|1,1,0]=4 2229 B9R0.45 C#CCCCCSCCN m_7__20871276__22787466 [0,2,0,0,0,0|1,1,0]=4 2230 B9R0.45 C#CCCCCSCCO m_62__17318684__10178562 [0,2,0,0,0,0|0,1,0]=3 2231 B9R0.45 C#CCCCSCCCC m_62__875776__17850946 [0,2,0,0,0,0|1,1,0]=4 2232 B9R0.45 C#CCCCSCCCO m_7__10972294__10211628 [0,2,0,0,0,0|0,1,1]=4 2233 B9R0.45 C#CCCCSCCOC m_62__524272__17850946 [0,2,0,0,0,0|0,1,1]=4 2234 B9R0.45 C#CCCOCCNCC m_270004__21999386__24715004 [0,2,0,0,0,0|1,0,0]=3 2235 B9R0.45 C#CCCSCCCCC m_62__5063390__18060662 [0,2,0,0,0,0|1,1,0]=4 2236 B9R0.45 C#CCCSCCCCF m_62__10157914__18060662 [0,2,0,0,0,0|1,1,0]=4 2237 B9R0.45 C#CCCSCCCCN m_34__20871448__22325280 [0,2,0,0,0,0|1,1,0]=4 2238 B9R0.45 C#CCCSCCCCO m_7__22849690__18060656 [0,2,0,0,0,0|1,0,1]=4 2239 B9R0.45 C#CCCSCCCOC m_62__9108898__18060662 [0,2,0,0,0,0|1,1,0]=4 2240 B9R0.45 C#CCCSCCCSC m_7__10890048__18060656 [0,2,0,0,0,0|1,1,0]=4 2241 B9R0.45 C#CCCSCCNCC m_7__22986872__18060656 [0,2,0,0,0,0|1,1,0]=4 2242 B9R0.45 C#CCCSCCOCC m_62__204255__18060662 [0,2,0,0,0,0|1,1,0]=4 2243 B9R0.45 C#CCCSCCSCC m_7__8765656__18060656 [0,2,0,0,0,0|1,1,0]=4 2244 B9R0.45 C#CCOCCCNCC 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CC(C)CSCC(O)CO m_7__27301__3173190 [0,2,0,0,0,0|2,0,0]=4 2891 B9R0.1 CC(C)NCC[C@@H](O)CO m_269862__14590510__7204804 [0,2,0,0,0,0|2,0,0]=4 2892 B9R0.1 CC(C)SCSC(C)CO m_7__6338928__12306378 [0,2,0,0,0,0|1,1,0]=4 2893 B9R0.1 CC(CO)CCNC(C)C m_269862__24471902__7204804 [0,2,0,0,0,0|2,0,0]=4 2894 B9R0.1 CC(CO)CSC[C@H](C)N m_7__20871336__7968760 [0,2,0,0,0,0|2,0,0]=4 2895 B9R0.1 CC(CO)NCCC(F)F m_269862__13943056__15157990 [0,2,0,0,0,0|2,0,0]=4 2896 B9R0.1 CC(CO)NCCN(C)C m_269862__10205846__15157990 [0,2,0,0,0,0|2,0,0]=4 2897 B9R0.1 CC(CO)SCCC(F)F m_7__22986868__17610454 [0,2,0,0,0,0|1,1,0]=4 2898 B9R0.1 CC(CO)SCCN(C)C m_7__6338928__391100 [0,2,0,0,0,0|1,1,0]=4 2899 B9R0.1 CC(CO)SCCS(=O)C m_7__6338928__11566584 [0,2,0,0,0,0|1,1,0]=4 2900 B9R0.1 CC(F)CCNC(=O)CO m_22__10546012__7941800 [0,2,0,0,0,0|1,0,1]=4 2901 B9R0.1 CC(F)CCNC(C)CCl m_2230__22399894__13165354 [0,2,0,0,0,0|2,0,0]=4 2902 B9R0.1 CC(F)CCNC(C)CO m_269862__10546064__15157990 [0,2,0,0,0,0|1,0,0]=3 2903 B9R0.1 CC(F)CCN[C@H](C)CF 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m_273610__11554168__11516404 [0,2,0,0,0,0|1,0,0]=3 3299 B9R0.55 CC(O)CCSCC(=O)O m_7__26823__12057932 [0,2,0,0,0,0|0,1,1]=4 3300 B9R0.55 CC(O)CCSCC(C)F m_62__12057938__16913488 [0,2,0,0,0,0|1,1,0]=4 3301 B9R0.55 CC(O)CCSCC(C)O m_7__10953796__12057932 [0,2,0,0,0,0|0,1,0]=3 3302 B9R0.55 CC(O)CCSCC(F)F m_7__22987700__12057932 [0,2,0,0,0,0|1,1,0]=4 3303 B9R0.55 CC(O)CCSC[C@H](C)N m_7__20871336__12057932 [0,2,0,0,0,0|1,1,0]=4 3304 B9R0.55 CC(O)CNCCC(C)F m_273610__11529660__11516404 [0,2,0,0,0,0|1,0,0]=3 3305 B9R0.55 CC(O)CNCCC(Cl)Cl m_273610__23816588__11516404 [0,2,0,0,0,0|2,0,0]=4 3306 B9R0.55 CC(O)CNCCC(F)F m_273610__13857570__11516404 [0,2,0,0,0,0|2,0,0]=4 3307 B9R0.55 CC(O)CNCCN(C)C m_273610__13857018__11516404 [0,2,0,0,0,0|2,0,0]=4 3308 B9R0.55 CC(O)CNCCS(=O)C m_273610__11522046__11516404 [0,2,0,0,0,0|2,0,0]=4 3309 B9R0.55 CC(O)CSCCC(C)F m_7__10953796__13165340 [0,2,0,0,0,0|0,1,0]=3 3310 B9R0.55 CC(O)CSCCC(F)F m_7__22986868__10902704 [0,2,0,0,0,0|1,1,0]=4 3311 B9R0.55 CC(O)CSCCN(C)C m_7__10953796__391100 [0,2,0,0,0,0|1,1,0]=4 3312 B9R0.55 CC(O)CSCCS(=O)C m_7__10953796__11566584 [0,2,0,0,0,0|1,1,0]=4 3313 B9R0.55 CC(O)CSCSC(C)C m_7__10953796__12306378 [0,2,0,0,0,0|1,1,0]=4 3314 B7R1.1 CCN1CCCC1 m_2230__678722__22383854 [1,0,0,1,0,0|1,0,0]=3 3315 B7R1.1 CNC1CCCC1 m_207__134027__121596 [1,0,0,1,0,0|2,0,0]=4 3316 B7R1.1 CSC1CCCC1 m_62__875850__10178584 [1,0,0,1,0,0|2,0,0]=4 3317 B7R1.1 CSC1CCOC1 m_62__875850__10903820 [1,0,0,1,0,0|1,0,0]=3 3318 B7R1.1 CSC1CCSC1 m_7__15266840__5046 [1,0,0,1,0,0|1,1,0]=4 3319 B7R1.1 CS[C@H]1CCNC1 m_7__22987620__5046 [1,0,0,1,0,0|2,0,0]=4 3320 B7R1.1 ON=C1CCCC1 m_4__388124__66759 [1,0,0,1,0,0|1,0,1]=4 3321 B7R1.3 CN1CCCCC1 m_2230__679042__2463448 [1,0,0,1,0,0|2,0,0]=4 3322 B7R1.3 CN1CCNCC1 m_269982__7368754__14064228 [1,0,0,1,0,0|2,0,0]=4 3323 B7R1.3 CN1CCOCC1 m_2230__665308__2463448 [1,0,0,1,0,0|1,0,0]=3 3324 B7R1.3 CN1CCSCC1 m_2230__848268__2463448 [1,0,0,1,0,0|1,1,0]=4 3325 B7R1.4 CC1CCCN1C m_2230__6338494__2463448 [1,0,0,1,0,0|2,0,0]=4 3326 B7R1.5 CC1CC1C=NO m_4__388124__7048186 [1,0,0,1,0,0|1,0,1]=4 3327 B7R1.5 CCNC1CC1C m_270004__8294846__24715004 [1,0,0,1,0,0|1,0,0]=3 3328 B7R1.5 CSCC1CC1C m_62__12216592__876088 [1,0,0,1,0,0|2,0,0]=4 3329 B7R1.5 CSC[C@@H]1C[C@H]1C m_62__875850__23861442 [1,0,0,1,0,0|2,0,0]=4 3330 B7R1.6 CCNC1COC1 m_269862__7865270__7931470 [1,0,0,1,0,0|2,0,0]=4 3331 B7R1.6 CCNC1CSC1 m_270004__13270386__24715004 [1,0,0,1,0,0|2,0,0]=4 3332 B7R1.6 CCSC1CCC1 m_7__10684076__5047 [1,0,0,1,0,0|0,1,0]=3 3333 B7R1.6 CCSC1CNC1 m_7__22987816__5047 [1,0,0,1,0,0|1,1,0]=4 3334 B7R1.6 CCSC1COC1 m_7__13420946__5047 [1,0,0,1,0,0|1,1,0]=4 3335 B7R1.6 CCSC1CSC1 m_7__20064714__5047 [1,0,0,1,0,0|1,1,0]=4 3336 B7R1.6 CSCC1CCC1 m_62__6007776__876088 [1,0,0,1,0,0|2,0,0]=4 3337 B7R1.7 CCCSC1CC1 m_7__22986886__16761930 [1,0,0,1,0,0|1,1,0]=4 3338 B7R1.7 CCNCC1CC1 m_207__121480__2989440 [1,0,0,1,0,0|1,0,0]=3 3339 B7R1.7 CCSCC1CC1 m_62__875846__7141822 [1,0,0,1,0,0|0,1,0]=3 3340 B7R1.7 CCSCC1CS1 m_7__22987770__22787476 [1,0,0,1,0,0|1,1,0]=4 3341 B7R1.7 CSCCC1CC1 m_62__875850__9143162 [1,0,0,1,0,0|2,0,0]=4 3342 B7R1.7 FCCSC1CC1 m_7__22987858__22320828 [1,0,0,1,0,0|1,1,0]=4 3343 B7R1.7 NCCSC1CC1 m_7__20871276__16761930 [1,0,0,1,0,0|1,1,0]=4 3344 B7R1.7 OCCSC1CC1 m_7__22987858__102708 [1,0,0,1,0,0|0,1,0]=3 3345 B7R1.8 CCN1CC[C@H]1C m_270004__24224170__24715004 [1,0,0,1,0,0|1,0,0]=3 3346 B7R1.8 CN1CCC1CO m_2230__13428546__2463448 [1,0,0,1,0,0|1,0,0]=3 3347 B7R1.8 CSC1CCC1O m_7__22986908__5046 [1,0,0,1,0,0|1,0,0]=3 3348 B9R1.2 CCC1CCCN(C1)C m_2230__678580__2463448 [0,1,0,1,0,0|2,0,0]=4 3349 B9R1.2 CCC1CN(CCN1)C m_269982__16886878__14064228 [0,1,0,1,0,0|2,0,0]=4 3350 B9R1.2 CCC1CN(CCO1)C m_2230__702680__2463448 [0,1,0,1,0,0|1,0,0]=3 3351 B9R1.2 CCC1CN(CCS1)C m_2230__6287584__2463448 [0,1,0,1,0,0|1,1,0]=4 3352 B9R1.2 CCN1CCCC(C1)O m_2230__678744__22383854 [0,1,0,1,0,0|2,0,0]=4 3353 B9R1.2 CN1CCCC(C1)CO m_2230__678750__2463448 [0,1,0,1,0,0|2,0,0]=4 3354 B9R1.2 CN1CCOC(C1)CN m_269982__8991808__14064228 [0,1,0,1,0,0|2,0,0]=4 3355 B9R1.2 CN1CCO[C@@H](C1)CO m_2230__13610048__2463448 [0,1,0,1,0,0|1,0,0]=3 3356 B9R1.2 COC1CN(CCO1)C m_2230__12100878__2463448 [0,1,0,1,0,0|2,0,0]=4 3357 B9R1.2 CS[C@@H]1CCC[C@@H](C1)O m_7__17656074__5046 [0,1,0,1,0,0|2,0,0]=4 3358 B9R1.7 C=C1CCN(C1)CCO m_2230__13656258__6165700 [0,1,0,1,0,0|1,0,1]=4 3359 B9R1.7 CC1CCN(C1)CCF m_2230__6813990__22320836 [0,1,0,1,0,0|2,0,0]=4 3360 B9R1.7 CC1CCN(C1)CCN m_269982__7372840__14439794 [0,1,0,1,0,0|2,0,0]=4 3361 B9R1.7 CC1CCN(C1)CCO m_2230__6813990__6165700 [0,1,0,1,0,0|1,0,0]=3 3362 B9R1.7 CCCN1CCC(C1)C m_2230__6813990__13271112 [0,1,0,1,0,0|2,0,0]=4 3363 B9R1.7 CCCN1CC[C@@H](C1)F m_2230__10719192__13271112 [0,1,0,1,0,0|2,0,0]=4 3364 B9R1.7 CCCN1CC[C@@H](C1)O m_2230__3351214__13271112 [0,1,0,1,0,0|2,0,0]=4 3365 B9R1.7 CCCN1CC[C@H](C1)F m_2230__10719368__13271112 [0,1,0,1,0,0|2,0,0]=4 3366 B9R1.7 CCCN1CC[C@H](C1)N m_269982__7368756__13271120 [0,1,0,1,0,0|2,0,0]=4 3367 B9R1.7 CCN[C@@H]1CC[C@@H](C1)O m_270004__11714050__24715004 [0,1,0,1,0,0|2,0,0]=4 3368 B9R1.7 CCN[C@H]1CC[C@@H](C1)O m_270004__24793980__24715004 [0,1,0,1,0,0|2,0,0]=4 3369 B9R1.7 CCSC1CCC(C1)O m_7__17795750__5047 [0,1,0,1,0,0|2,0,0]=4 3370 B9R1.7 CN1CCC(C1)CCO m_2230__16720226__2463448 [0,1,0,1,0,0|2,0,0]=4 3371 B9R1.7 FCCN1CC[C@@H](C1)F m_2230__10719192__22320836 [0,1,0,1,0,0|2,0,0]=4 3372 B9R1.7 FCCN1CC[C@H](C1)F m_2230__10719368__22320836 [0,1,0,1,0,0|2,0,0]=4 3373 B9R1.7 NCCN1CC[C@@H](C1)O m_269982__13594114__14439794 [0,1,0,1,0,0|2,0,0]=4 3374 B9R1.7 NCCN1CC[C@H](C1)F m_269982__17669062__14439794 [0,1,0,1,0,0|2,0,0]=4 3375 B9R1.7 NCCN1CC[C@H](C1)N m_269982__7368756__14439794 [0,1,0,1,0,0|2,0,0]=4 3376 B9R1.7 N[C@@H]1CCN(C1)CCF m_269982__7368756__22320816 [0,1,0,1,0,0|2,0,0]=4 3377 B9R1.7 N[C@@H]1CCN(C1)CCO m_269982__7368756__10880280 [0,1,0,1,0,0|1,0,0]=3 3378 B9R1.7 OCCN1CC[C@@H](C1)F m_2230__10719192__6165700 [0,1,0,1,0,0|1,0,0]=3 3379 B9R1.7 OCCN1CC[C@@H](C1)O m_2230__3351214__6165700 [0,1,0,1,0,0|1,0,0]=3 3380 B9R1.7 OCCN1CC[C@H](C1)F m_2230__10719368__6165700 [0,1,0,1,0,0|1,0,0]=3 3381 B9R1.7 O[C@H]1CCN(C1)CCF m_2230__3351214__22320836 [0,1,0,1,0,0|2,0,0]=4 3382 B9R1.8 CCCC1CNCCN1 m_269982__23917336__7393392 [0,1,0,1,0,0|2,0,0]=4 3383 B9R1.8 CCCN1CCCCC1 m_2230__679042__13271112 [0,1,0,1,0,0|2,0,0]=4 3384 B9R1.8 CCCN1CCNCC1 m_269982__7368754__13271120 [0,1,0,1,0,0|2,0,0]=4 3385 B9R1.8 CCCN1CCOCC1 m_2230__665308__13271112 [0,1,0,1,0,0|2,0,0]=4 3386 B9R1.8 CCCN1CCSCC1 m_2230__848268__13271112 [0,1,0,1,0,0|2,0,0]=4 3387 B9R1.8 CCNC1CCCCC1 m_207__121480__121598 [0,1,0,1,0,0|2,0,0]=4 3388 B9R1.8 CCNC1CCCOC1 m_270004__8160850__8157396 [0,1,0,1,0,0|1,0,0]=3 3389 B9R1.8 CCNC1CCCSC1 m_207__121480__9295358 [0,1,0,1,0,0|1,1,0]=4 3390 B9R1.8 CCSC1CCCCC1 m_7__22987770__9868258 [0,1,0,1,0,0|2,0,0]=4 3391 B9R1.8 CCSC1CCCNC1 m_7__22871154__5047 [0,1,0,1,0,0|2,0,0]=4 3392 B9R1.8 CCSC1CCCOC1 m_7__8601826__5047 [0,1,0,1,0,0|1,0,0]=3 3393 B9R1.8 CNCC1CCCCC1 m_207__134027__121242 [0,1,0,1,0,0|2,0,0]=4 3394 B9R1.8 CNC[C@H]1CCCCN1 m_269982__18320082__14064228 [0,1,0,1,0,0|2,0,0]=4 3395 B9R1.8 CSCC1CCCCC1 m_62__875850__5821482 [0,1,0,1,0,0|1,1,0]=4 3396 B9R1.8 CSCC1CCCCO1 m_62__875850__524424 [0,1,0,1,0,0|0,1,0]=3 3397 B9R1.8 CSCC1CCCOC1 m_62__875850__7425144 [0,1,0,1,0,0|1,0,0]=3 3398 B9R1.8 CSCC1COCCO1 m_62__875850__10738068 [0,1,0,1,0,0|0,0,0]=2 3399 B9R1.8 CSC[C@@H]1CCCNC1 m_7__22987726__5046 [0,1,0,1,0,0|2,0,0]=4 3400 B9R1.8 CSC[C@@H]1CNCCO1 m_7__22986850__5046 [0,1,0,1,0,0|1,0,0]=3 3401 B9R1.8 FCCN1CCCCC1 m_2230__679042__22320836 [0,1,0,1,0,0|2,0,0]=4 3402 B9R1.8 FCCN1CCNCC1 m_269982__7368754__22320816 [0,1,0,1,0,0|2,0,0]=4 3403 B9R1.8 FCCN1CCOCC1 m_2230__665308__22320836 [0,1,0,1,0,0|2,0,0]=4 3404 B9R1.8 FCCN1CCSCC1 m_2230__848268__22320836 [0,1,0,1,0,0|2,0,0]=4 3405 B9R1.8 NCCN1CCCCC1 m_269982__7374328__14439794 [0,1,0,1,0,0|2,0,0]=4 3406 B9R1.8 NCCN1CCNCC1 m_269982__7368754__14439794 [0,1,0,1,0,0|2,0,0]=4 3407 B9R1.8 NCCN1CCOCC1 m_269982__7368914__14439794 [0,1,0,1,0,0|2,0,0]=4 3408 B9R1.8 NCCN1CCSCC1 m_269982__7369916__14439794 [0,1,0,1,0,0|2,0,0]=4 3409 B9R1.8 OCCN1CC=CCC1 m_2230__8375936__6165700 [0,1,0,1,0,0|1,0,1]=4 3410 B9R1.8 OCCN1CCCC=N1 m_2230__22595168__6165700 [0,1,0,1,0,0|1,0,1]=4 3411 B9R1.8 OCCN1CCCCC1 m_2230__679042__6165700 [0,1,0,1,0,0|1,0,0]=3 3412 B9R1.8 OCCN1CCNCC1 m_269982__7368754__10880280 [0,1,0,1,0,0|1,0,0]=3 3413 B9R1.8 OCCN1CCOCC1 m_2230__665308__6165700 [0,1,0,1,0,0|1,0,0]=3 3414 B9R1.8 OCCN1CCSCC1 m_2230__848268__6165700 [0,1,0,1,0,0|1,0,0]=3 3415 B9R1.8 ON=CC1CCCCC1 m_4__388124__66959 [0,1,0,1,0,0|1,0,1]=4 3416 B9R1.9 CC1CC(C1)NCCF m_269862__9706110__8852816 [0,1,0,1,0,0|2,0,0]=4 3417 B9R1.9 CC1CC(C1)NCCO m_269862__7193048__8852816 [0,1,0,1,0,0|1,0,0]=3 3418 B9R1.9 CCCCN1CC(C1)F m_2230__15542798__22993830 [0,1,0,1,0,0|2,0,0]=4 3419 B9R1.9 CCCNC1CC(C1)C m_270004__8288780__8852818 [0,1,0,1,0,0|2,0,0]=4 3420 B9R1.9 CCCSC1CC(C1)O m_7__22986886__10953812 [0,1,0,1,0,0|1,1,0]=4 3421 B9R1.9 CCNCC1CC(C1)O m_270004__12309058__24715004 [0,1,0,1,0,0|2,0,0]=4 3422 B9R1.9 NCCSC1CC(C1)O m_7__20871276__10953812 [0,1,0,1,0,0|1,1,0]=4 3423 B9R1.9 O=C1CC(C1)SCCO m_7__128807__11757122 [0,1,0,1,0,0|0,1,1]=4 3424 B9R1.9 OCCCN1CC(C1)F m_2230__15542798__680950 [0,1,0,1,0,0|2,0,0]=4 3425 B9R1.9 OCCSC1CC(C1)O m_7__128807__10953812 [0,1,0,1,0,0|0,1,0]=3 3426 B9R1.12 C#CCCN1CCCC1 m_2230__678722__9420240 [0,1,0,1,0,0|2,0,0]=4 3427 B9R1.12 C=CCCN1CCCC1 m_2230__678722__8929530 [0,1,0,1,0,0|2,0,0]=4 3428 B9R1.12 CCCCN1CCCC1 m_2230__678722__22993830 [0,1,0,1,0,0|2,0,0]=4 3429 B9R1.12 CCCNC1CCCC1 m_207__109413__121596 [0,1,0,1,0,0|2,0,0]=4 3430 B9R1.12 CCCNC1CCOC1 m_270004__8288780__8157394 [0,1,0,1,0,0|2,0,0]=4 3431 B9R1.12 CCCNC1CCSC1 m_270004__8288780__8157326 [0,1,0,1,0,0|2,0,0]=4 3432 B9R1.12 CCCSC1CCCC1 m_62__875778__10178584 [0,1,0,1,0,0|1,1,0]=4 3433 B9R1.12 CCCSC1CCOC1 m_62__875778__10903820 [0,1,0,1,0,0|1,1,0]=4 3434 B9R1.12 CCCSC1CCSC1 m_7__15266840__14390332 [0,1,0,1,0,0|1,1,0]=4 3435 B9R1.12 CCCS[C@H]1CCNC1 m_7__22987620__14390332 [0,1,0,1,0,0|1,1,0]=4 3436 B9R1.12 CCNCC1CCCC1 m_270004__8160850__8300536 [0,1,0,1,0,0|2,0,0]=4 3437 B9R1.12 CCNCC1CCCO1 m_270004__8288644__24715004 [0,1,0,1,0,0|1,0,0]=3 3438 B9R1.12 CCNCC1CCCS1 m_270004__8298440__24715004 [0,1,0,1,0,0|1,1,0]=4 3439 B9R1.12 CCNCC1CCOC1 m_270004__8291482__24715004 [0,1,0,1,0,0|2,0,0]=4 3440 B9R1.12 CCNCC1OCCO1 m_270004__18331526__24715004 [0,1,0,1,0,0|0,0,0]=2 3441 B9R1.12 CCNCC1SCCS1 m_270004__12107410__24715004 [0,1,0,1,0,0|0,2,0]=4 3442 B9R1.12 CCSCC1=NOCC1 m_7__22987770__12889536 [0,1,0,1,0,0|2,0,0]=4 3443 B9R1.12 CCSCC1CCCC1 m_62__875846__8766438 [0,1,0,1,0,0|2,0,0]=4 3444 B9R1.12 CCSCC1CCCN1 m_7__22987948__5047 [0,1,0,1,0,0|2,0,0]=4 3445 B9R1.12 CCSCC1CCCO1 m_62__875846__9419582 [0,1,0,1,0,0|1,0,0]=3 3446 B9R1.12 CCSCC1CCOC1 m_62__875846__8794298 [0,1,0,1,0,0|2,0,0]=4 3447 B9R1.12 CCSCC1OCCO1 m_7__22987770__5357046 [0,1,0,1,0,0|0,0,0]=2 3448 B9R1.12 COCCN1CCCC1 m_2230__678722__666874 [0,1,0,1,0,0|1,0,0]=3 3449 B9R1.12 COCSC1CCCC1 m_7__27260__6762 [0,1,0,1,0,0|2,0,0]=4 3450 B9R1.12 CSCCC1CCCC1 m_62__875850__5819056 [0,1,0,1,0,0|1,1,0]=4 3451 B9R1.12 CSCCC1CCCO1 m_62__875850__9194610 [0,1,0,1,0,0|1,0,0]=3 3452 B9R1.12 CSCCC1CCOC1 m_62__875850__10689340 [0,1,0,1,0,0|2,0,0]=4 3453 B9R1.12 CSCCC1SCCS1 m_62__875850__12140276 [0,1,0,1,0,0|0,2,0]=4 3454 B9R1.12 CSCCN1CCCC1 m_2230__678722__681390 [0,1,0,1,0,0|1,1,0]=4 3455 B9R1.12 FCCCN1CCCC1 m_2230__678722__16896936 [0,1,0,1,0,0|2,0,0]=4 3456 B9R1.12 FCCNC1CCCC1 m_207__18491578__121596 [0,1,0,1,0,0|2,0,0]=4 3457 B9R1.12 FCCSC1CCCC1 m_7__27260__22320828 [0,1,0,1,0,0|1,1,0]=4 3458 B9R1.12 FCCSC1CCOC1 m_7__22987382__22320828 [0,1,0,1,0,0|1,1,0]=4 3459 B9R1.12 FCCSC1CCSC1 m_7__15266840__22320828 [0,1,0,1,0,0|1,1,0]=4 3460 B9R1.12 FCCS[C@H]1CCNC1 m_7__22987620__22320828 [0,1,0,1,0,0|1,1,0]=4 3461 B9R1.12 N#CCCN1CCCC1 m_2230__678722__680296 [0,1,0,1,0,0|2,0,0]=4 3462 B9R1.12 NCCCN1CCCC1 m_269982__7368900__10880302 [0,1,0,1,0,0|2,0,0]=4 3463 B9R1.12 NCCNC1CCCC1 m_272690__11349186__11345956 [0,1,0,1,0,0|2,0,0]=4 3464 B9R1.12 NCCSC1CCCC1 m_7__20871276__2560312 [0,1,0,1,0,0|1,1,0]=4 3465 B9R1.12 NCCSC1CCOC1 m_7__20871276__9630604 [0,1,0,1,0,0|1,1,0]=4 3466 B9R1.12 NCCSC1CCSC1 m_7__20871276__10684060 [0,1,0,1,0,0|1,1,0]=4 3467 B9R1.12 OCCCN1CCCC1 m_2230__678722__680950 [0,1,0,1,0,0|1,0,0]=3 3468 B9R1.12 OCCNC1CCCC1 m_207__121484__121596 [0,1,0,1,0,0|1,0,0]=3 3469 B9R1.12 OCCNC1CCOC1 m_270004__8349608__8157394 [0,1,0,1,0,0|1,0,0]=3 3470 B9R1.12 OCCNC1CCSC1 m_270004__8349608__8157326 [0,1,0,1,0,0|1,0,0]=3 3471 B9R1.12 OCCSC1CC=CC1 m_7__128807__16736518 [0,1,0,1,0,0|0,1,1]=4 3472 B9R1.12 OCCSC1CCCC1 m_7__27260__102708 [0,1,0,1,0,0|0,1,0]=3 3473 B9R1.12 OCCSC1CCOC1 m_7__22987382__102708 [0,1,0,1,0,0|0,1,0]=3 3474 B9R1.12 OCCSC1CCSC1 m_7__15266840__6166114 [0,1,0,1,0,0|0,1,0]=3 3475 B9R1.12 OCCS[C@H]1CCNC1 m_7__22987620__102708 [0,1,0,1,0,0|0,1,0]=3 3476 B9R1.15 C#CC1COCCN1C m_2230__10911200__2463448 [0,1,0,1,0,0|2,0,0]=4 3477 B9R1.15 C=CC1COCCN1C m_2230__22409032__2463448 [0,1,0,1,0,0|2,0,0]=4 3478 B9R1.15 CC1CCCCC1=NO m_4__388124__66922 [0,1,0,1,0,0|1,0,1]=4 3479 B9R1.15 CC1CCOCC1=NO m_4__388124__13756140 [0,1,0,1,0,0|0,0,1]=3 3480 B9R1.15 CCC1CCCCN1C m_2230__1722000__2463448 [0,1,0,1,0,0|2,0,0]=4 3481 B9R1.15 CCC1COCCN1C m_2230__4978178__2463448 [0,1,0,1,0,0|1,0,0]=3 3482 B9R1.15 CCN1CCCCC1C m_270004__8128030__24715004 [0,1,0,1,0,0|2,0,0]=4 3483 B9R1.15 CCN1CCCC[C@H]1C m_2230__22409340__22383854 [0,1,0,1,0,0|2,0,0]=4 3484 B9R1.15 CCN1CCNCC1C m_269982__7368790__7393392 [0,1,0,1,0,0|2,0,0]=4 3485 B9R1.15 CCN1CCOCC1C m_2230__679548__22383854 [0,1,0,1,0,0|1,0,0]=3 3486 B9R1.15 CCN1CCOC[C@@H]1C m_2230__10745968__22383854 [0,1,0,1,0,0|1,0,0]=3 3487 B9R1.15 CCN1CCSCC1C m_2230__5359444__22383854 [0,1,0,1,0,0|1,1,0]=4 3488 B9R1.15 CN1CCC=CC1CO m_2230__18367858__2463448 [0,1,0,1,0,0|1,0,1]=4 3489 B9R1.15 CN1CCCCC1CF m_2230__16896206__2463448 [0,1,0,1,0,0|2,0,0]=4 3490 B9R1.15 CN1CCCCC1CO m_2230__804372__2463448 [0,1,0,1,0,0|1,0,0]=3 3491 B9R1.15 CN1CCNCC1CO m_269982__12889570__14064228 [0,1,0,1,0,0|2,0,0]=4 3492 B9R1.15 CN1CCNC[C@H]1CO m_269982__23466534__14064228 [0,1,0,1,0,0|2,0,0]=4 3493 B9R1.15 CN1CCOCC1C#N m_2230__7463302__2463448 [0,1,0,1,0,0|2,0,0]=4 3494 B9R1.15 CN1CCOCC1CF m_2230__17068944__2463448 [0,1,0,1,0,0|2,0,0]=4 3495 B9R1.15 CN1CCOCC1CO m_2230__15779506__2463448 [0,1,0,1,0,0|1,0,0]=3 3496 B9R1.15 CN1CCSCC1CO m_2230__7964058__2463448 [0,1,0,1,0,0|1,1,0]=4 3497 B9R1.15 CNC1CCCCC1C m_269862__7193148__7200292 [0,1,0,1,0,0|2,0,0]=4 3498 B9R1.15 CNC1CCCC[C@H]1F m_269862__7193148__16655726 [0,1,0,1,0,0|2,0,0]=4 3499 B9R1.15 CNC1CCNCC1C m_269982__17670816__14064228 [0,1,0,1,0,0|2,0,0]=4 3500 B9R1.15 CNC1CCOCC1C m_269862__7193148__9582752 [0,1,0,1,0,0|1,0,0]=3 3501 B9R1.15 CNC1CNCCC1C m_269982__22505482__14064228 [0,1,0,1,0,0|2,0,0]=4 3502 B9R1.15 CNC1COCCC1C m_269862__7193148__15475114 [0,1,0,1,0,0|1,0,0]=3 3503 B9R1.15 CN[C@@H]1CCCC[C@H]1N m_269982__11506054__14064228 [0,1,0,1,0,0|2,0,0]=4 3504 B9R1.15 CN[C@H]1CCCC[C@H]1N m_269982__15500706__14064228 [0,1,0,1,0,0|2,0,0]=4 3505 B9R1.15 CN[C@H]1CCOC[C@H]1N m_269982__17754790__14064228 [0,1,0,1,0,0|1,0,0]=3 3506 B9R1.15 CN[C@H]1COCC[C@H]1N m_269982__17754826__14064228 [0,1,0,1,0,0|2,0,0]=4 3507 B9R1.20 CCNCC1CC1CC m_270004__8160850__18234084 [0,1,0,1,0,0|2,0,0]=4 3508 B9R1.20 CCNC[C@@H]1C[C@H]1CC m_270004__8160850__18897550 [0,1,0,1,0,0|2,0,0]=4 3509 B9R1.20 CCNC[C@H]1C[C@H]1CF m_270004__17827024__24715004 [0,1,0,1,0,0|2,0,0]=4 3510 B9R1.20 CCNC[C@H]1C[C@H]1CO m_270004__16790534__24715004 [0,1,0,1,0,0|1,0,0]=3 3511 B9R1.20 CCSC[C@@H]1C[C@H]1CC m_62__875846__13155124 [0,1,0,1,0,0|2,0,0]=4 3512 B9R1.22 CCC1CN(CC1O)C m_2230__7914132__2463448 [0,1,0,1,0,0|1,0,0]=3 3513 B9R1.22 CN1CC(C(C1)CO)O m_2230__10908094__2463448 [0,1,0,1,0,0|2,0,0]=4 3514 B9R1.22 CN1C[C@H](C[C@H]1CO)F m_2230__10058990__2463448 [0,1,0,1,0,0|2,0,0]=4 3515 B9R1.22 CN1C[C@H](C[C@H]1CO)O m_2230__8976674__2463448 [0,1,0,1,0,0|2,0,0]=4 3516 B9R1.22 CO[C@@H]1CN(C[C@H]1O)C m_2230__10810016__2463448 [0,1,0,1,0,0|2,0,0]=4 3517 B9R1.22 C[C@H]1CN(C[C@@H]1CO)C m_2230__13027182__2463448 [0,1,0,1,0,0|2,0,0]=4 3518 B9R1.27 CC1CCN(C1CO)C m_2230__9163424__2463448 [0,1,0,1,0,0|1,0,0]=3 3519 B9R1.27 CCC1C(CCN1C)C m_2230__8990332__2463448 [0,1,0,1,0,0|2,0,0]=4 3520 B9R1.27 CC[C@H]1[C@H](CCN1C)O m_2230__22408844__2463448 [0,1,0,1,0,0|2,0,0]=4 3521 B9R1.33 C=C1COCC1NCC m_2230__14055376__22383854 [0,1,0,1,0,0|1,0,1]=4 3522 B9R1.33 CC1CCCN1CCF m_2230__6338494__22320836 [0,1,0,1,0,0|2,0,0]=4 3523 B9R1.33 CC1CCCN1CCO m_2230__6338494__6165700 [0,1,0,1,0,0|1,0,0]=3 3524 B9R1.33 CCCC1CCCN1C m_2230__13579908__2463448 [0,1,0,1,0,0|2,0,0]=4 3525 B9R1.33 CCCN1CCCC1C m_2230__6338494__13271112 [0,1,0,1,0,0|2,0,0]=4 3526 B9R1.33 CCNC1CCCC1C m_2230__9296222__22383854 [0,1,0,1,0,0|2,0,0]=4 3527 B9R1.33 CCNC1CCCC1O m_269862__7865270__15158002 [0,1,0,1,0,0|1,0,0]=3 3528 B9R1.33 CCNC1COCC1C m_2230__13166314__22383854 [0,1,0,1,0,0|1,0,0]=3 3529 B9R1.33 CCNC1CSCC1C m_2230__10125964__22383854 [0,1,0,1,0,0|1,1,0]=4 3530 B9R1.33 CCN[C@@H]1CCC[C@H]1F m_270004__21674338__24715004 [0,1,0,1,0,0|2,0,0]=4 3531 B9R1.33 CCN[C@@H]1CCC[C@H]1O m_270004__10910694__24715004 [0,1,0,1,0,0|1,0,0]=3 3532 B9R1.33 CCN[C@@H]1CNC[C@H]1C m_269982__22505224__7393392 [0,1,0,1,0,0|2,0,0]=4 3533 B9R1.33 CCN[C@@H]1COC[C@H]1F m_270004__17830876__24715004 [0,1,0,1,0,0|1,0,0]=3 3534 B9R1.33 CCN[C@@H]1COC[C@H]1O m_270004__23852260__24715004 [0,1,0,1,0,0|0,0,0]=2 3535 B9R1.33 CCN[C@@H]1COC[C@H]1O m_270004__23853474__24715004 [0,1,0,1,0,0|0,0,0]=2 3536 B9R1.33 CCN[C@H]1CCC[C@@H]1F m_270004__21811798__24715004 [0,1,0,1,0,0|2,0,0]=4 3537 B9R1.33 CCN[C@H]1CCC[C@H]1C m_2230__22399140__22383854 [0,1,0,1,0,0|2,0,0]=4 3538 B9R1.33 CCN[C@H]1CCC[C@H]1F m_270004__21631818__24715004 [0,1,0,1,0,0|2,0,0]=4 3539 B9R1.33 CCN[C@H]1CCC[C@H]1N m_269982__17754792__7393392 [0,1,0,1,0,0|2,0,0]=4 3540 B9R1.33 CCN[C@H]1CCC[C@H]1O m_270004__23852616__24715004 [0,1,0,1,0,0|1,0,0]=3 3541 B9R1.33 CCN[C@H]1CNC[C@H]1C m_269982__22505270__7393392 [0,1,0,1,0,0|2,0,0]=4 3542 B9R1.33 CCN[C@H]1COC[C@H]1C m_2230__22403954__22383854 [0,1,0,1,0,0|1,0,0]=3 3543 B9R1.33 CCN[C@H]1COC[C@H]1F m_270004__14044360__24715004 [0,1,0,1,0,0|1,0,0]=3 3544 B9R1.33 CCS[C@@H]1CCC[C@H]1O m_7__22987770__22323980 [0,1,0,1,0,0|1,0,0]=3 3545 B9R1.33 CCS[C@@H]1COC[C@H]1O m_7__22987770__12360262 [0,1,0,1,0,0|0,0,0]=2 3546 B9R1.33 CCS[C@H]1COC[C@H]1F m_62__875846__18327624 [0,1,0,1,0,0|1,0,0]=3 3547 B9R1.33 CN1CCCC1CCO m_2230__10893840__2463448 [0,1,0,1,0,0|1,0,0]=3 3548 B9R1.33 CNC[C@H]1COC[C@H]1O m_2230__13038508__2463448 [0,1,0,1,0,0|0,0,0]=2 3549 B9R1.33 COCC1CCCN1C m_2230__16794284__2463448 [0,1,0,1,0,0|2,0,0]=4 3550 B9R1.33 COC[C@H]1CCCN1C m_2230__22392084__2463448 [0,1,0,1,0,0|2,0,0]=4 3551 B9R1.33 CSC[C@@H]1CCC[C@H]1C m_62__875850__13911862 [0,1,0,1,0,0|1,1,0]=4 3552 B9R1.48 CC1CCCCN(C1)C m_2230__8964262__2463448 [0,1,0,1,0,0|2,0,0]=4 3553 B9R1.48 CC1CN(CCCO1)C m_2230__3001124__2463448 [0,1,0,1,0,0|2,0,0]=4 3554 B9R1.48 CC1COCCN(C1)C m_2230__13161110__2463448 [0,1,0,1,0,0|2,0,0]=4 3555 B9R1.48 CN1CCCCC(C1)N m_269982__15734008__14064228 [0,1,0,1,0,0|2,0,0]=4 3556 B9R1.48 CN1CCNCC(C1)O m_269982__13586758__14064228 [0,1,0,1,0,0|2,0,0]=4 3557 B9R1.48 CN1CCOCC(C1)F m_2230__20275084__2463448 [0,1,0,1,0,0|2,0,0]=4 3558 B9R1.48 CN1CCOCC(C1)O m_2230__14795914__2463448 [0,1,0,1,0,0|1,0,0]=3 3559 B9R1.49 CC1CCCN(CC1)C m_2230__3563028__2463448 [0,1,0,1,0,0|2,0,0]=4 3560 B9R1.49 CC1CCN(CCN1)C m_269982__17754846__14064228 [0,1,0,1,0,0|2,0,0]=4 3561 B9R1.49 CC1CCN(CCO1)C m_2230__13160604__2463448 [0,1,0,1,0,0|1,0,0]=3 3562 B9R1.49 CC1CCN(CCS1)C m_2230__9298202__2463448 [0,1,0,1,0,0|1,1,0]=4 3563 B9R1.49 CN1CCCC(CC1)O m_2230__10565428__2463448 [0,1,0,1,0,0|2,0,0]=4 3564 B9R1.50 CN1CCCCCCC1 m_2230__665322__2463448 [0,1,0,1,0,0|2,0,0]=4 3565 B9R1.58 CCN1CC(C1)CCO m_270004__16660726__24715004 [0,1,0,1,0,0|2,0,0]=4 3566 B9R1.58 CCN[C@H]1C[C@@H](C1)CO m_270004__13270496__24715004 [0,1,0,1,0,0|2,0,0]=4 3567 B9R1.58 CCSC1CC(C1)CO m_7__22987770__15703886 [0,1,0,1,0,0|2,0,0]=4 3568 B9R1.69 CC1CCN(CC1C)C m_2230__7968368__2463448 [0,1,0,1,0,0|2,0,0]=4 3569 B9R1.69 CC1CCN(CC1O)C m_2230__8254308__2463448 [0,1,0,1,0,0|1,0,0]=3 3570 B9R1.69 CC1CN(CCC1O)C m_2230__22405928__2463448 [0,1,0,1,0,0|2,0,0]=4 3571 B9R1.69 CN1CC[C@@H]([C@@H](C1)O)O m_2230__12632864__2463448 [0,1,0,1,0,0|2,0,0]=4 3572 B9R1.69 CN1CC[C@H]([C@@H](C1)O)F m_2230__13944416__2463448 [0,1,0,1,0,0|2,0,0]=4 3573 B9R1.69 C[C@H]1CCN(C[C@H]1O)C m_2230__14471782__2463448 [0,1,0,1,0,0|1,0,0]=3 3574 B9R1.69 C[C@H]1CN(CC[C@@H]1O)C m_2230__21246392__2463448 [0,1,0,1,0,0|2,0,0]=4 3575 B9R1.69 C[C@H]1CN([C@H](CO1)C)C m_2230__22407874__2463448 [0,1,0,1,0,0|2,0,0]=4 3576 B9R1.73 CCCN(C)C1CCC1 m_2230__2261920__7832192 [0,1,0,1,0,0|2,0,0]=4 3577 B9R1.73 CCNC(C)C1CCO1 m_269862__7865270__22386440 [0,1,0,1,0,0|2,0,0]=4 3578 B9R1.73 CN(CCF)C1CCC1 m_2230__6008210__22320836 [0,1,0,1,0,0|2,0,0]=4 3579 B9R1.73 CN(CCO)C1CCC1 m_2230__6008210__6165700 [0,1,0,1,0,0|1,0,0]=3 3580 B9R1.73 CN(CCO)C1CNC1 m_269982__10341168__10880280 [0,1,0,1,0,0|2,0,0]=4 3581 B9R1.73 CN(CCO)C1COC1 m_2230__13570148__6165700 [0,1,0,1,0,0|2,0,0]=4 3582 B9R1.73 CN(CCO)C1CSC1 m_2230__13465922__6165700 [0,1,0,1,0,0|2,0,0]=4 3583 B9R1.73 O=C(CCO)N1CCC1 m_487__4784906__12879784 [0,1,0,1,0,0|2,0,0]=4 3584 B9R1.75 CC(CCO)NC1CC1 m_2230__22400640__16761932 [0,1,0,1,0,0|2,0,0]=4 3585 B9R1.75 CC(CCO)SC1CC1 m_7__22987858__14772890 [0,1,0,1,0,0|2,0,0]=4 3586 B9R1.75 CCCC(=O)OC1CC1 m_276436__14080770__14088342 [0,1,0,1,0,0|1,0,1]=4 3587 B9R1.75 CCCC(C)NC1CC1 m_269862__7192602__7200560 [0,1,0,1,0,0|2,0,0]=4 3588 B9R1.75 CCCC(C)SC1CC1 m_7__14428530__16761930 [0,1,0,1,0,0|1,1,0]=4 3589 B9R1.75 CCCN(C)CC1CC1 m_2230__2261920__15163310 [0,1,0,1,0,0|2,0,0]=4 3590 B9R1.75 CN(CCF)CC1CC1 m_2230__1000274__22320836 [0,1,0,1,0,0|2,0,0]=4 3591 B9R1.75 CN(CCN)CC1CC1 m_269982__10894792__10880982 [0,1,0,1,0,0|2,0,0]=4 3592 B9R1.75 CN(CCO)CC1CC1 m_2230__1731032__2463448 [0,1,0,1,0,0|1,0,0]=3 3593 B9R1.75 O=C(CCO)NC1CC1 m_487__150646__12879784 [0,1,0,1,0,0|2,0,0]=4 3594 B9R1.75 O=S(CCO)CC1CC1 m_265282__7088216__15163316 [0,1,0,1,0,0|0,1,0]=3 3595 B9R1.90 CCN1C(CC1CO)C m_2230__15757628__22383854 [0,1,0,1,0,0|2,0,0]=4 3596 B9R1.100 CC(NCCF)C1CC1 m_269862__9706110__7200230 [0,1,0,1,0,0|2,0,0]=4 3597 B9R1.100 CC(NCCO)C1CC1 m_269862__7193048__7200230 [0,1,0,1,0,0|1,0,0]=3 3598 B9R1.100 CC(SCCO)C1CC1 m_7__128807__12129412 [0,1,0,1,0,0|0,1,0]=3 3599 B9R1.100 CCCCN(C)C1CC1 m_2230__765802__2463448 [0,1,0,1,0,0|2,0,0]=4 3600 B9R1.100 CCCN[C@@H](C)C1CC1 m_2230__22400112__13271112 [0,1,0,1,0,0|2,0,0]=4 3601 B9R1.100 CCCOC(=O)C1CC1 m_276436__14076550__14085874 [0,1,0,1,0,0|1,0,1]=4 3602 B9R1.100 CCCSC(C)C1CC1 m_7__22986886__12129412 [0,1,0,1,0,0|1,1,0]=4 3603 B9R1.100 CN(CCCO)C1CC1 m_2230__804662__680950 [0,1,0,1,0,0|2,0,0]=4 3604 B9R1.100 C[C@H](NCCF)C1CC1 m_2230__22400112__22320836 [0,1,0,1,0,0|2,0,0]=4 3605 B9R1.100 C[C@H](NCCO)C1CC1 m_2230__22400112__6165700 [0,1,0,1,0,0|1,0,0]=3 3606 B9R1.100 O=C(NCCO)C1CC1 m_270062__7594790__15529362 [0,1,0,1,0,0|1,0,1]=4 3607 B9R1.100 O=C(OCCF)C1CC1 m_276436__14078274__14085874 [0,1,0,1,0,0|1,0,1]=4 3608 B9R1.100 O=C(OCCO)C1CC1 m_1458__473538__485506 [0,1,0,1,0,0|0,0,1]=3 3609 B9R1.117 CC1(CCC1)NCCF m_2230__22404308__22320836 [0,1,0,1,0,0|2,0,0]=4 3610 B9R1.117 CC1(CCC1)NCCO m_2230__22404308__6165700 [0,1,0,1,0,0|1,0,0]=3 3611 B9R1.117 CC1(CNC1)NCCO m_269982__22505400__10880280 [0,1,0,1,0,0|2,0,0]=4 3612 B9R1.117 CC1(COC1)NCCO m_2230__22396972__6165700 [0,1,0,1,0,0|2,0,0]=4 3613 B9R1.117 CC1(CSC1)NCCO m_2230__22397754__6165700 [0,1,0,1,0,0|2,0,0]=4 3614 B9R1.117 CCCNC1(CCC1)C m_2230__22404308__13271112 [0,1,0,1,0,0|2,0,0]=4 3615 B9R1.117 CCNCC1(CCO1)C m_270004__22495754__24715004 [0,1,0,1,0,0|2,0,0]=4 3616 B9R1.154 CCNC1C(CC1O)O m_270004__23852944__24715004 [0,1,0,1,0,0|2,0,0]=4 3617 B9R1.154 CCNC1[C@@H](C[C@H]1O)O m_270004__21470474__24715004 [0,1,0,1,0,0|2,0,0]=4 3618 B9R1.173 CN1CCC1(C)CCO m_2230__22408956__2463448 [0,1,0,1,0,0|2,0,0]=4 3619 B9R1.183 CC1CC1N(C)CCF m_2230__16770468__22320836 [0,1,0,1,0,0|2,0,0]=4 3620 B9R1.183 CC1CC1N(C)CCO m_2230__16770468__6165700 [0,1,0,1,0,0|1,0,0]=3 3621 B9R1.183 CCCN(C)C1CC1C m_2230__16770468__13271112 [0,1,0,1,0,0|2,0,0]=4 3622 B9R1.191 CC1CC1(C)NCCF m_2230__22397712__22320836 [0,1,0,1,0,0|2,0,0]=4 3623 B9R1.191 CC1CC1(C)NCCO m_2230__22397712__6165700 [0,1,0,1,0,0|1,0,0]=3 3624 B9R1.191 CCCNC1(CC1C)C m_2230__22397712__13271112 [0,1,0,1,0,0|2,0,0]=4 3625 B9R1.4 CCCN1CCC1CO m_2230__13428546__13271112 [0,1,0,1,0,0|1,0,0]=3 3626 B9R1.4 CCN1CCC1COC m_2230__10478002__22383854 [0,1,0,1,0,0|2,0,0]=4 3627 B9R1.4 CCNC1CCC1CC m_269862__7865270__10177948 [0,1,0,1,0,0|2,0,0]=4 3628 B9R1.4 CCNC1CCC1CO m_269862__7865270__17047872 [0,1,0,1,0,0|1,0,0]=3 3629 B9R1.4 CCN[C@@H]1CC[C@H]1CF m_270004__23853708__24715004 [0,1,0,1,0,0|2,0,0]=4 3630 B9R1.4 CCN[C@H]1CC[C@H]1CO m_270004__23853202__24715004 [0,1,0,1,0,0|1,0,0]=3 3631 B9R1.4 OCC1CCN1CCF m_2230__13428546__22320836 [0,1,0,1,0,0|2,0,0]=4 3632 B9R1.4 OCCN1CCC1CO m_2230__13428546__6165700 [0,1,0,1,0,0|1,0,0]=3 3633 B9R1.5 CC1CCCCCN1C m_2230__9017564__2463448 [0,1,0,1,0,0|2,0,0]=4 3634 B9R1.5 CC1CCNCCN1C m_269982__14413696__14064228 [0,1,0,1,0,0|2,0,0]=4 3635 B9R1.5 CC1CCOCCN1C m_2230__13439614__2463448 [0,1,0,1,0,0|1,0,0]=3 3636 B9R1.5 CC1CCSCCN1C m_2230__9285662__2463448 [0,1,0,1,0,0|1,1,0]=4 3637 B9R1.5 CC1COCCCN1C m_2230__24525948__2463448 [0,1,0,1,0,0|1,0,0]=3 3638 B9R1.5 CC1CSCCCN1C m_2230__13433016__2463448 [0,1,0,1,0,0|1,1,0]=4 3639 B9R1.5 C[C@@H]1CNCCCN1C m_269982__22505118__14064228 [0,1,0,1,0,0|2,0,0]=4 3640 B9R1.5 C[C@@H]1COCCCN1C m_2230__21997220__2463448 [0,1,0,1,0,0|1,0,0]=3 3641 B9R1.14 C=C[C@@H]1OCC[C@H]1NC m_2230__10744612__2463448 [0,1,0,1,0,0|1,0,1]=4 3642 B9R1.14 CCC1CCCC1=NO m_4__388124__7048182 [0,1,0,1,0,0|1,0,1]=4 3643 B9R1.14 CCC1CCCC1NC m_269862__7193148__7202366 [0,1,0,1,0,0|2,0,0]=4 3644 B9R1.14 CCC1CCCN1CC m_2230__4599928__22383854 [0,1,0,1,0,0|2,0,0]=4 3645 B9R1.14 CCC1COCC1=NO m_4__388124__11983054 [0,1,0,1,0,0|0,0,1]=3 3646 B9R1.14 CCC1COCC1NC m_269862__7193148__11982532 [0,1,0,1,0,0|1,0,0]=3 3647 B9R1.14 CCN1CC=CC1CO m_270004__24176800__24715004 [0,1,0,1,0,0|1,0,1]=4 3648 B9R1.14 CCN1CCCC1CO m_270004__8134002__24715004 [0,1,0,1,0,0|1,0,0]=3 3649 B9R1.14 CCN1CCC[C@@H]1CF m_270004__17056106__24715004 [0,1,0,1,0,0|2,0,0]=4 3650 B9R1.14 CCN1CCC[C@H]1CF m_2230__17313732__22383854 [0,1,0,1,0,0|2,0,0]=4 3651 B9R1.14 CC[C@@H]1CCCN1CC m_270004__24776924__24715004 [0,1,0,1,0,0|2,0,0]=4 3652 B9R1.14 CC[C@@H]1OCC[C@H]1NC m_2230__10911408__2463448 [0,1,0,1,0,0|1,0,0]=3 3653 B9R1.14 CNC1CCCC1OC m_269862__7193148__12621944 [0,1,0,1,0,0|2,0,0]=4 3654 B9R1.14 CN[C@@H]1CCC[C@H]1CF m_2230__22396922__2463448 [0,1,0,1,0,0|2,0,0]=4 3655 B9R1.14 CN[C@@H]1CCC[C@H]1CO m_2230__22399992__2463448 [0,1,0,1,0,0|1,0,0]=3 3656 B9R1.14 CN[C@H]1CCC[C@@H]1CN m_269982__22505302__14064228 [0,1,0,1,0,0|2,0,0]=4 3657 B9R1.14 CN[C@H]1CCC[C@@H]1OC m_2230__10745488__2463448 [0,1,0,1,0,0|2,0,0]=4 3658 B9R1.14 CN[C@H]1CCC[C@H]1CO m_2230__22399092__2463448 [0,1,0,1,0,0|1,0,0]=3 3659 B9R1.14 CN[C@H]1COC[C@@H]1OC m_2230__11571956__2463448 [0,1,0,1,0,0|1,0,0]=3 3660 B9R1.14 CN[C@H]1COC[C@H]1CO m_2230__21290468__2463448 [0,1,0,1,0,0|1,0,0]=3 3661 B9R1.16 CC1CC1CNCCO m_270004__8349608__9139722 [0,1,0,1,0,0|1,0,0]=3 3662 B9R1.16 CC1CC1CSCCN m_7__20871276__12216586 [0,1,0,1,0,0|1,1,0]=4 3663 B9R1.16 CC1CC1CSCCO m_62__12216592__10178562 [0,1,0,1,0,0|0,1,0]=3 3664 B9R1.16 CC1CC1NCCC#N m_273610__13857230__11515974 [0,1,0,1,0,0|2,0,0]=4 3665 B9R1.16 CCCNCC1CC1C m_270004__8288780__9139722 [0,1,0,1,0,0|2,0,0]=4 3666 B9R1.16 CCCNCC1CC1Cl m_270004__8288780__15344010 [0,1,0,1,0,0|2,0,0]=4 3667 B9R1.16 CCCSCC1CC1Br m_7__22986886__15765428 [0,1,0,1,0,0|1,1,0]=4 3668 B9R1.16 CCCSCC1CC1C m_62__12216592__875868 [0,1,0,1,0,0|1,1,0]=4 3669 B9R1.16 CCCSC[C@@H]1C[C@H]1C m_62__875778__23861442 [0,1,0,1,0,0|1,1,0]=4 3670 B9R1.16 CCNCCC1CC1C m_270004__23850414__24715004 [0,1,0,1,0,0|2,0,0]=4 3671 B9R1.16 CSCCCC1CC1C m_62__17055834__876088 [0,1,0,1,0,0|1,1,0]=4 3672 B9R1.16 C[C@H]1C[C@@H]1CSCCN m_7__20871276__23861434 [0,1,0,1,0,0|1,1,0]=4 3673 B9R1.16 C[C@H]1C[C@@H]1CSCCO m_62__23861440__10178562 [0,1,0,1,0,0|0,1,0]=3 3674 B9R1.16 C[C@H]1C[C@@H]1NCCC#N m_273610__12364740__11515974 [0,1,0,1,0,0|2,0,0]=4 3675 B9R1.16 NCCSCC1CC1Br m_7__20871276__15765428 [0,1,0,1,0,0|1,1,0]=4 3676 B9R1.16 OCCNCC1CC1Cl m_270004__8349608__15344010 [0,1,0,1,0,0|1,0,0]=3 3677 B9R1.16 OCCSCC1CC1Br m_7__128807__15765428 [0,1,0,1,0,0|0,1,0]=3 3678 B9R1.17 C#CCCSC1CCC1 m_7__10684076__18060656 [0,1,0,1,0,0|1,1,0]=4 3679 B9R1.17 C=CCCSC1CCC1 m_7__10684076__8929468 [0,1,0,1,0,0|1,1,0]=4 3680 B9R1.17 CCC=NOC1CCC1 m_34__17309904__9422448 [0,1,0,1,0,0|1,0,1]=4 3681 B9R1.17 CCCCNC1COC1 m_269862__7192636__7931470 [0,1,0,1,0,0|1,0,0]=3 3682 B9R1.17 CCCCSC1CCC1 m_7__10684076__131272 [0,1,0,1,0,0|1,1,0]=4 3683 B9R1.17 CCCCSC1CNC1 m_7__22987816__770176 [0,1,0,1,0,0|1,1,0]=4 3684 B9R1.17 CCCCSC1COC1 m_7__13420946__131272 [0,1,0,1,0,0|0,1,0]=3 3685 B9R1.17 CCCCSC1CSC1 m_7__20064714__131272 [0,1,0,1,0,0|0,2,0]=4 3686 B9R1.17 CCCNCC1CCC1 m_270004__8288780__24715052 [0,1,0,1,0,0|2,0,0]=4 3687 B9R1.17 CCCNCC1COC1 m_207__109413__22332602 [0,1,0,1,0,0|2,0,0]=4 3688 B9R1.17 CCCON=C1CCC1 m_34__5065688__13271108 [0,1,0,1,0,0|1,0,1]=4 3689 B9R1.17 CCCSCC1CCC1 m_62__875778__6007778 [0,1,0,1,0,0|1,1,0]=4 3690 B9R1.17 CCCSCC1COC1 m_62__875778__16613884 [0,1,0,1,0,0|1,1,0]=4 3691 B9R1.17 CCCSC[C@H]1CCO1 m_7__22986886__17058812 [0,1,0,1,0,0|1,0,0]=3 3692 B9R1.17 CCNCCC1CCC1 m_270004__12854806__24715004 [0,1,0,1,0,0|2,0,0]=4 3693 B9R1.17 CCNCCC1CCO1 m_270004__23839986__24715004 [0,1,0,1,0,0|1,0,0]=3 3694 B9R1.17 CCNCCN1CCC1 m_270004__8299198__24715004 [0,1,0,1,0,0|2,0,0]=4 3695 B9R1.17 CCOCSC1CCC1 m_7__10684076__10176980 [0,1,0,1,0,0|1,1,0]=4 3696 B9R1.17 CCOCSC1COC1 m_7__13420946__10176980 [0,1,0,1,0,0|1,1,0]=4 3697 B9R1.17 CCSCCC1CCC1 m_62__875846__12121634 [0,1,0,1,0,0|2,0,0]=4 3698 B9R1.17 CCSCCC1CCO1 m_7__22987770__22866650 [0,1,0,1,0,0|1,0,0]=3 3699 B9R1.17 CCSCCC1COC1 m_7__22987770__16711750 [0,1,0,1,0,0|2,0,0]=4 3700 B9R1.17 CCSCOC1CCC1 m_7__22987770__10266484 [0,1,0,1,0,0|1,0,0]=3 3701 B9R1.17 CCSCSC1CCC1 m_7__10684076__9456150 [0,1,0,1,0,0|1,1,0]=4 3702 B9R1.17 CCSCSC1COC1 m_7__13420946__9456150 [0,1,0,1,0,0|1,1,0]=4 3703 B9R1.17 CNCCSC1CCC1 m_7__22986920__13420952 [0,1,0,1,0,0|1,1,0]=4 3704 B9R1.17 CNCCSC1COC1 m_7__22986920__10173692 [0,1,0,1,0,0|1,1,0]=4 3705 B9R1.17 COCCNC1COC1 m_269862__7192698__7931470 [0,1,0,1,0,0|2,0,0]=4 3706 B9R1.17 COCCSC1CCC1 m_7__10684076__149891 [0,1,0,1,0,0|0,1,0]=3 3707 B9R1.17 COCCSC1CNC1 m_7__22987816__149891 [0,1,0,1,0,0|1,1,0]=4 3708 B9R1.17 COCCSC1COC1 m_7__13420946__149891 [0,1,0,1,0,0|1,1,0]=4 3709 B9R1.17 COCCSC1CSC1 m_7__20064714__149891 [0,1,0,1,0,0|1,1,0]=4 3710 B9R1.17 CSCCCC1CCC1 m_62__875850__12056162 [0,1,0,1,0,0|1,1,0]=4 3711 B9R1.17 CSCCNC1COC1 m_269862__11963794__7931470 [0,1,0,1,0,0|2,0,0]=4 3712 B9R1.17 CSCCOC1CCC1 m_62__875850__10211404 [0,1,0,1,0,0|0,1,0]=3 3713 B9R1.17 CSCCOC1CNC1 m_7__22871144__5046 [0,1,0,1,0,0|1,1,0]=4 3714 B9R1.17 CSCCSC1CCC1 m_7__10684076__7912552 [0,1,0,1,0,0|0,2,0]=4 3715 B9R1.17 CSCCSC1COC1 m_7__13420946__7912552 [0,1,0,1,0,0|1,1,0]=4 3716 B9R1.17 FCCCNC1COC1 m_269862__17065594__7931470 [0,1,0,1,0,0|2,0,0]=4 3717 B9R1.17 FCCCSC1CCC1 m_7__10684076__16896928 [0,1,0,1,0,0|1,1,0]=4 3718 B9R1.17 FCCCSC1COC1 m_7__13420946__16896928 [0,1,0,1,0,0|1,1,0]=4 3719 B9R1.17 FCCNCC1COC1 m_207__18491578__22332602 [0,1,0,1,0,0|2,0,0]=4 3720 B9R1.17 FCCON=C1CCC1 m_34__5065688__22320830 [0,1,0,1,0,0|1,0,1]=4 3721 B9R1.17 FCCSCC1COC1 m_7__22987642__22320828 [0,1,0,1,0,0|1,1,0]=4 3722 B9R1.17 N#CCCNC1CCC1 m_273610__12113724__11515974 [0,1,0,1,0,0|2,0,0]=4 3723 B9R1.17 N#CCCSC1CCC1 m_7__10953802__13420952 [0,1,0,1,0,0|1,1,0]=4 3724 B9R1.17 NCCCSC1CCC1 m_7__20871288__13420952 [0,1,0,1,0,0|1,1,0]=4 3725 B9R1.17 NCCCSC1COC1 m_7__20871288__10173692 [0,1,0,1,0,0|1,1,0]=4 3726 B9R1.17 NCCSCC1CCC1 m_7__20871276__6078530 [0,1,0,1,0,0|1,1,0]=4 3727 B9R1.17 NCCSCC1COC1 m_7__20871276__9395478 [0,1,0,1,0,0|1,1,0]=4 3728 B9R1.17 NCCSC[C@H]1CCO1 m_7__20871276__17058812 [0,1,0,1,0,0|1,1,0]=4 3729 B9R1.17 OCCCNC1COC1 m_269862__7192678__7931470 [0,1,0,1,0,0|2,0,0]=4 3730 B9R1.17 OCCCSC1CCC1 m_7__10684076__6354 [0,1,0,1,0,0|0,1,0]=3 3731 B9R1.17 OCCCSC1CNC1 m_7__22987816__6354 [0,1,0,1,0,0|1,1,0]=4 3732 B9R1.17 OCCCSC1COC1 m_7__13420946__6354 [0,1,0,1,0,0|1,1,0]=4 3733 B9R1.17 OCCCSC1CSC1 m_7__20064714__6354 [0,1,0,1,0,0|1,1,0]=4 3734 B9R1.17 OCCNCC1CCC1 m_270004__8349608__24715052 [0,1,0,1,0,0|1,0,0]=3 3735 B9R1.17 OCCNCC1COC1 m_207__121484__22332602 [0,1,0,1,0,0|1,0,0]=3 3736 B9R1.17 OCCSCC1CCC1 m_62__6007776__10178562 [0,1,0,1,0,0|0,1,0]=3 3737 B9R1.17 OCCSCC1COC1 m_7__22987642__102708 [0,1,0,1,0,0|0,1,0]=3 3738 B9R1.17 OCCSC[C@H]1CCO1 m_7__128807__17058812 [0,1,0,1,0,0|0,1,0]=3 3739 B9R1.39 CC1CCC1NCCF m_269862__9706110__9109936 [0,1,0,1,0,0|2,0,0]=4 3740 B9R1.39 CC1CCC1NCCO m_269862__7193048__9109936 [0,1,0,1,0,0|1,0,0]=3 3741 B9R1.39 CCCSC1CCC1O m_7__22986908__14390332 [0,1,0,1,0,0|1,0,0]=3 3742 B9R1.39 CCNCC1CCC1C m_270004__23844138__24715004 [0,1,0,1,0,0|2,0,0]=4 3743 B9R1.39 CCNC[C@@H]1CC[C@H]1O m_270004__21537060__24715004 [0,1,0,1,0,0|1,0,0]=3 3744 B9R1.39 CCNC[C@H]1CC[C@H]1C m_270004__21813148__24715004 [0,1,0,1,0,0|2,0,0]=4 3745 B9R1.39 CCNC[C@H]1CC[C@H]1F m_270004__21848130__24715004 [0,1,0,1,0,0|2,0,0]=4 3746 B9R1.39 CCSC[C@@H]1CC[C@H]1O m_62__875846__23862058 [0,1,0,1,0,0|1,0,0]=3 3747 B9R1.39 CCSC[C@H]1CC[C@H]1C m_62__875846__21674492 [0,1,0,1,0,0|2,0,0]=4 3748 B9R1.39 COCSC1CCC1O m_7__22986908__6762 [0,1,0,1,0,0|2,0,0]=4 3749 B9R1.39 CSCSC1CCC1O m_7__22986908__10542644 [0,1,0,1,0,0|2,0,0]=4 3750 B9R1.39 O=C1CCC1SCCO m_7__128807__20026952 [0,1,0,1,0,0|0,1,1]=4 3751 B9R1.39 OC1CCC1SCCF m_7__22986908__22320828 [0,1,0,1,0,0|1,1,0]=4 3752 B9R1.39 OCCSC1CCC1O m_7__22986908__102708 [0,1,0,1,0,0|0,1,0]=3 3753 B9R1.83 C#CCCSCC1CC1 m_62__7141820__18060662 [0,1,0,1,0,0|1,1,0]=4 3754 B9R1.83 C#CCOCSC1CC1 m_7__22987858__10548336 [0,1,0,1,0,0|1,0,1]=4 3755 B9R1.83 C=CCCNCC1CC1 m_207__11969928__2989440 [0,1,0,1,0,0|2,0,0]=4 3756 B9R1.83 C=CCCSCC1CC1 m_62__7141820__9875548 [0,1,0,1,0,0|1,1,0]=4 3757 B9R1.83 C=CCOCSC1CC1 m_7__22987858__12361584 [0,1,0,1,0,0|1,0,1]=4 3758 B9R1.83 CCC=NOCC1CC1 m_34__17309904__7141814 [0,1,0,1,0,0|1,0,1]=4 3759 B9R1.83 CCCCCSC1CC1 m_7__8271838__16761930 [0,1,0,1,0,0|1,1,0]=4 3760 B9R1.83 CCCCNCC1CC1 m_207__109452__2989440 [0,1,0,1,0,0|2,0,0]=4 3761 B9R1.83 CCCCSCC1CC1 m_7__10390288__770176 [0,1,0,1,0,0|1,1,0]=4 3762 B9R1.83 CCCNCCC1CC1 m_270004__8288780__13455800 [0,1,0,1,0,0|2,0,0]=4 3763 B9R1.83 CCCOCSC1CC1 m_7__22987858__12361582 [0,1,0,1,0,0|1,0,0]=3 3764 B9R1.83 CCCON=CC1CC1 m_4__11573770__7831630 [0,1,0,1,0,0|1,0,1]=4 3765 B9R1.83 CCCSCCC1CC1 m_62__875778__9143162 [0,1,0,1,0,0|1,1,0]=4 3766 B9R1.83 CCNCCCC1CC1 m_270004__11760216__24715004 [0,1,0,1,0,0|2,0,0]=4 3767 B9R1.83 CCNCCOC1CC1 m_270004__13147592__24715004 [0,1,0,1,0,0|1,0,0]=3 3768 B9R1.83 CCNCCSC1CC1 m_7__22986872__16761930 [0,1,0,1,0,0|1,1,0]=4 3769 B9R1.83 CCOCCSC1CC1 m_7__22987858__5044 [0,1,0,1,0,0|1,1,0]=4 3770 B9R1.83 CCOCSCC1CC1 m_7__10390288__10176980 [0,1,0,1,0,0|1,1,0]=4 3771 B9R1.83 CCSCCCC1CC1 m_62__875846__12641598 [0,1,0,1,0,0|2,0,0]=4 3772 B9R1.83 CCSCCOC1CC1 m_62__875846__13445166 [0,1,0,1,0,0|1,0,0]=3 3773 B9R1.83 CCSCCSC1CC1 m_7__8765656__16761930 [0,1,0,1,0,0|1,1,0]=4 3774 B9R1.83 CCSCSCC1CC1 m_7__10390288__9456150 [0,1,0,1,0,0|1,1,0]=4 3775 B9R1.83 CNCCSCC1CC1 m_7__22986920__7141812 [0,1,0,1,0,0|1,1,0]=4 3776 B9R1.83 COCCCSC1CC1 m_7__17626136__16761930 [0,1,0,1,0,0|1,1,0]=4 3777 B9R1.83 COCCNCC1CC1 m_207__109486__2989440 [0,1,0,1,0,0|1,0,0]=3 3778 B9R1.83 COCCSCC1CC1 m_62__7141820__8623480 [0,1,0,1,0,0|0,1,0]=3 3779 B9R1.83 COCCSCC1CS1 m_7__6362310__22787476 [0,1,0,1,0,0|1,1,0]=4 3780 B9R1.83 COCSCCC1CC1 m_7__18798568__6762 [0,1,0,1,0,0|2,0,0]=4 3781 B9R1.83 CSCCCCC1CC1 m_62__875850__13763132 [0,1,0,1,0,0|1,1,0]=4 3782 B9R1.83 CSCCCSC1CC1 m_7__10890048__16761930 [0,1,0,1,0,0|1,1,0]=4 3783 B9R1.83 CSCCNCC1CC1 m_207__11946676__2989440 [0,1,0,1,0,0|1,1,0]=4 3784 B9R1.83 CSCCOCC1CC1 m_62__875850__5635706 [0,1,0,1,0,0|0,1,0]=3 3785 B9R1.83 CSCCSCC1CC1 m_62__7141820__8268572 [0,1,0,1,0,0|0,2,0]=4 3786 B9R1.83 FCCCCSC1CC1 m_7__22987858__10157908 [0,1,0,1,0,0|1,1,0]=4 3787 B9R1.83 FCCCNCC1CC1 m_207__17065564__2989440 [0,1,0,1,0,0|2,0,0]=4 3788 B9R1.83 FCCCSCC1CC1 m_7__10390288__16896928 [0,1,0,1,0,0|1,1,0]=4 3789 B9R1.83 FCCSCCC1CC1 m_7__18798568__22320828 [0,1,0,1,0,0|1,1,0]=4 3790 B9R1.83 N#CCCNCC1CC1 m_273610__11517374__11515974 [0,1,0,1,0,0|2,0,0]=4 3791 B9R1.83 N#CCCSCC1CC1 m_7__10953802__7141812 [0,1,0,1,0,0|1,1,0]=4 3792 B9R1.83 NCCCCSC1CC1 m_7__20871294__16761930 [0,1,0,1,0,0|1,1,0]=4 3793 B9R1.83 NCCCSCC1CC1 m_7__20871288__7141812 [0,1,0,1,0,0|1,1,0]=4 3794 B9R1.83 NCCSCCC1CC1 m_7__20871276__9143154 [0,1,0,1,0,0|1,1,0]=4 3795 B9R1.83 NOCCCSC1CC1 m_7__22987730__16761930 [0,1,0,1,0,0|2,0,0]=4 3796 B9R1.83 OCC#CCSC1CC1 m_7__22987858__15141006 [0,1,0,1,0,0|1,0,1]=4 3797 B9R1.83 OCC=CCSC1CC1 m_7__22987858__16809272 [0,1,0,1,0,0|1,0,1]=4 3798 B9R1.83 OCCCCSC1CC1 m_7__22987858__3191338 [0,1,0,1,0,0|1,0,0]=3 3799 B9R1.83 OCCCNCC1CC1 m_207__109475__2989440 [0,1,0,1,0,0|1,0,0]=3 3800 B9R1.83 OCCCSCC1CC1 m_7__10390288__6354 [0,1,0,1,0,0|0,1,0]=3 3801 B9R1.83 OCCCSCC1CS1 m_7__10972294__22787476 [0,1,0,1,0,0|1,1,0]=4 3802 B9R1.83 OCCNCCC1CC1 m_270004__8349608__13455800 [0,1,0,1,0,0|1,0,0]=3 3803 B9R1.83 OCCSCCC1CC1 m_7__18798568__102708 [0,1,0,1,0,0|0,1,0]=3 3804 B9R1.83 ON=CCCCC1CC1 m_4__388124__12623032 [0,1,0,1,0,0|1,0,1]=4 3805 B9R1.89 CCN1CCCCCC1 m_2230__678972__22383854 [0,1,0,1,0,0|2,0,0]=4 3806 B9R1.89 CCN1CCCNCC1 m_269982__7368760__7393392 [0,1,0,1,0,0|2,0,0]=4 3807 B9R1.89 CCN1CCCOCC1 m_2230__6727026__22383854 [0,1,0,1,0,0|1,0,0]=3 3808 B9R1.89 CCN1CCCSCC1 m_2230__7912842__22383854 [0,1,0,1,0,0|1,1,0]=4 3809 B9R1.89 CNC1CCCCCC1 m_207__134027__121595 [0,1,0,1,0,0|2,0,0]=4 3810 B9R1.89 CNC1CCCSCC1 m_269862__7193148__11947008 [0,1,0,1,0,0|1,1,0]=4 3811 B9R1.89 CSC1CCCCCC1 m_7__17653480__5046 [0,1,0,1,0,0|1,1,0]=4 3812 B9R1.89 CSC1CCCNCC1 m_7__22988076__5046 [0,1,0,1,0,0|2,0,0]=4 3813 B9R1.89 ON=C1CCCCCC1 m_4__388124__66755 [0,1,0,1,0,0|1,0,1]=4 3814 B9R1.89 ON=C1COCCOC1 m_4__388124__10542526 [0,1,0,1,0,0|1,0,1]=4 3815 B9R1.1 CN1CCC(CC1)CO m_2230__765796__2463448 [0,1,0,1,0,0|2,0,0]=4 3816 B9R1.3 CC1C(CCCN1C)O m_2230__10719784__2463448 [0,1,0,1,0,0|2,0,0]=4 3817 B9R1.3 CC1COCC(N1C)C m_2230__12911698__2463448 [0,1,0,1,0,0|2,0,0]=4 3818 B9R1.3 C[C@@H]1[C@@H](CCCN1C)O m_2230__13038652__2463448 [0,1,0,1,0,0|2,0,0]=4 3819 B9R1.3 C[C@H]1OCCN([C@@H]1C)C m_2230__22408752__2463448 [0,1,0,1,0,0|2,0,0]=4 3820 B9R1.11 CC(CF)N1CCCC1 m_2230__678722__22994052 [0,1,0,1,0,0|2,0,0]=4 3821 B9R1.11 CC(CN)N1CCCC1 m_269982__7368900__13769420 [0,1,0,1,0,0|2,0,0]=4 3822 B9R1.11 CCC(C)N1CCCC1 m_2230__678722__14247836 [0,1,0,1,0,0|2,0,0]=4 3823 B9R1.11 CNC(C)C1CCCO1 m_2230__8740286__2463448 [0,1,0,1,0,0|2,0,0]=4 3824 B9R1.11 CNC(C)[C@H]1CCCO1 m_269862__7193148__15703558 [0,1,0,1,0,0|2,0,0]=4 3825 B9R1.11 O=C(CO)N1CCCC1 m_22__57697__7941800 [0,1,0,1,0,0|1,0,1]=4 3826 B9R1.21 CCC1CC(CO1)NC m_269862__7193148__12059362 [0,1,0,1,0,0|2,0,0]=4 3827 B9R1.21 CCN1CC[C@H](C1)CO m_2230__17547532__22383854 [0,1,0,1,0,0|2,0,0]=4 3828 B9R1.21 CNC1COC(C1)CO m_269862__7193148__15493886 [0,1,0,1,0,0|1,0,0]=3 3829 B9R1.78 CC(CO)N[C@@H]1C[C@@H]1F m_269862__14595886__15157990 [0,1,0,1,0,0|2,0,0]=4 3830 B9R1.78 CC(CO)N[C@@H]1C[C@H]1C m_269862__12364724__15157990 [0,1,0,1,0,0|1,0,0]=3 3831 B9R1.78 CC(CO)N[C@@H]1C[C@H]1O m_269862__23835522__15157990 [0,1,0,1,0,0|2,0,0]=4 3832 B9R1.78 CC(CO)N[C@H]1C[C@H]1F m_269862__17757774__15157990 [0,1,0,1,0,0|2,0,0]=4 3833 B9R1.78 CC1CC1NC(=O)CO m_22__3048356__7941800 [0,1,0,1,0,0|1,0,1]=4 3834 B9R1.78 CCC(C)N[C@@H]1C[C@H]1C m_269862__12364724__7200134 [0,1,0,1,0,0|2,0,0]=4 3835 B9R1.78 CCC(C)N[C@@H]1C[C@H]1O m_269862__23835522__7200134 [0,1,0,1,0,0|2,0,0]=4 3836 B9R1.78 C[C@H]1C[C@@H]1NC(=O)CO m_22__12364688__7941800 [0,1,0,1,0,0|1,0,1]=4 3837 B9R1.79 CC(CCl)NC1CCC1 m_2230__22399894__7832192 [0,1,0,1,0,0|2,0,0]=4 3838 B9R1.79 CC(CO)NC1CCC1 m_269862__10892244__15157990 [0,1,0,1,0,0|1,0,0]=3 3839 B9R1.79 CC(CO)SC1CCC1 m_7__10684076__17610454 [0,1,0,1,0,0|0,1,0]=3 3840 B9R1.79 CC(CO)SC1CNC1 m_7__22987816__17610454 [0,1,0,1,0,0|1,1,0]=4 3841 B9R1.79 CC(CO)SC1COC1 m_7__13420946__17610454 [0,1,0,1,0,0|1,1,0]=4 3842 B9R1.79 CC(CO)SC1CSC1 m_7__20064714__17610454 [0,1,0,1,0,0|1,1,0]=4 3843 B9R1.79 CCC(=O)OC1CCC1 m_276436__14078572__14101862 [0,1,0,1,0,0|1,0,1]=4 3844 B9R1.79 CCC(C)NC1CCC1 m_269862__10892244__7200134 [0,1,0,1,0,0|2,0,0]=4 3845 B9R1.79 CCC(C)SC1CCC1 m_7__10684076__14247828 [0,1,0,1,0,0|1,1,0]=4 3846 B9R1.79 CCC(O)CN1CCC1 m_63__8755088__9043956 [0,1,0,1,0,0|2,0,0]=4 3847 B9R1.79 CCN(C)CC1CCO1 m_2230__20847698__22383854 [0,1,0,1,0,0|2,0,0]=4 3848 B9R1.79 C[C@@H](CN)SC1CCC1 m_7__20871330__13420952 [0,1,0,1,0,0|1,1,0]=4 3849 B9R1.79 C[C@H](CF)NC1CCC1 m_2230__22399906__7832192 [0,1,0,1,0,0|2,0,0]=4 3850 B9R1.79 C[C@H](CO)NC1CCC1 m_2230__22399532__7832192 [0,1,0,1,0,0|1,0,0]=3 3851 B9R1.79 C[C@H](CO)NC1COC1 m_2230__22399532__14925342 [0,1,0,1,0,0|2,0,0]=4 3852 B9R1.79 O=C(CO)NC1CCC1 m_22__4117342__7941800 [0,1,0,1,0,0|1,0,1]=4 3853 B9R1.79 OCC(O)CN1CCC1 m_63__8755088__8671902 [0,1,0,1,0,0|2,0,0]=4 3854 B9R1.80 CC(CCl)NCC1CC1 m_2230__22399894__15163310 [0,1,0,1,0,0|2,0,0]=4 3855 B9R1.80 CC(CF)NCC1CC1 m_270004__10214060__7548776 [0,1,0,1,0,0|2,0,0]=4 3856 B9R1.80 CC(CO)CSC1CC1 m_7__6078536__16761930 [0,1,0,1,0,0|2,0,0]=4 3857 B9R1.80 CC(CO)SCC1CC1 m_7__6338928__7141812 [0,1,0,1,0,0|0,1,0]=3 3858 B9R1.80 CC(CO)SCC1CS1 m_7__6338928__22787476 [0,1,0,1,0,0|1,1,0]=4 3859 B9R1.80 CCC(=O)OCC1CC1 m_276436__14076632__14101862 [0,1,0,1,0,0|1,0,1]=4 3860 B9R1.80 CCC(C)CNC1CC1 m_207__109430__7687310 [0,1,0,1,0,0|2,0,0]=4 3861 B9R1.80 CCC(C)CSC1CC1 m_7__7022538__16761930 [0,1,0,1,0,0|1,1,0]=4 3862 B9R1.80 CCC(C)NCC1CC1 m_207__109487__2989440 [0,1,0,1,0,0|2,0,0]=4 3863 B9R1.80 CCC(C)SCC1CC1 m_7__10390288__14247828 [0,1,0,1,0,0|1,1,0]=4 3864 B9R1.80 CCC(F)CSC1CC1 m_7__22987858__9787594 [0,1,0,1,0,0|1,1,0]=4 3865 B9R1.80 CCC(O)CNC1CC1 m_273610__13857022__11516276 [0,1,0,1,0,0|2,0,0]=4 3866 B9R1.80 CCC(O)CSC1CC1 m_7__22988104__16761930 [0,1,0,1,0,0|1,1,0]=4 3867 B9R1.80 CC[C@H](N)CSC1CC1 m_7__20871354__16761930 [0,1,0,1,0,0|1,1,0]=4 3868 B9R1.80 C[C@@H](CN)SCC1CC1 m_7__20871330__7141812 [0,1,0,1,0,0|1,1,0]=4 3869 B9R1.80 C[C@H](CF)NCC1CC1 m_207__13811060__2989440 [0,1,0,1,0,0|2,0,0]=4 3870 B9R1.80 C[C@H](CN)NCC1CC1 m_269982__22505378__10880982 [0,1,0,1,0,0|2,0,0]=4 3871 B9R1.80 C[C@H](CO)NCC1CC1 m_207__1299140__2989440 [0,1,0,1,0,0|1,0,0]=3 3872 B9R1.80 O=C(CO)NCC1CC1 m_22__309938__7941800 [0,1,0,1,0,0|1,0,1]=4 3873 B9R1.80 OCC(O)CSC1CC1 m_7__22987858__3173190 [0,1,0,1,0,0|2,0,0]=4 3874 B9R1.81 CCN(C)[C@@H]1CC[C@H]1O m_2230__22408566__22383854 [0,1,0,1,0,0|2,0,0]=4 3875 B9R1.81 C[C@@H]1CCN1C(=O)CO m_22__20901942__7941800 [0,1,0,1,0,0|1,0,1]=4 3876 B9R1.99 CC1(CC1)CNCCF m_207__18491578__9439020 [0,1,0,1,0,0|2,0,0]=4 3877 B9R1.99 CC1(CC1)CNCCO m_207__121484__9439020 [0,1,0,1,0,0|1,0,0]=3 3878 B9R1.99 CC1(CC1)NCCCO m_2230__22404332__680950 [0,1,0,1,0,0|2,0,0]=4 3879 B9R1.99 CCCCNC1(CC1)C m_2230__22404332__22993830 [0,1,0,1,0,0|2,0,0]=4 3880 B9R1.99 CCCNCC1(CC1)C m_207__109413__9439020 [0,1,0,1,0,0|2,0,0]=4 3881 B9R1.99 CCCNCC1(CC1)F m_207__109413__9479524 [0,1,0,1,0,0|2,0,0]=4 3882 B9R1.99 CCCSCC1(CC1)Br m_7__22986886__10901808 [0,1,0,1,0,0|1,1,0]=4 3883 B9R1.99 CCCSCC1(CC1)Cl m_7__22986886__13965792 [0,1,0,1,0,0|1,1,0]=4 3884 B9R1.99 FCCNCC1(CC1)F m_207__18491578__9479524 [0,1,0,1,0,0|2,0,0]=4 3885 B9R1.99 NCCSCC1(CC1)Br m_7__20871276__10901808 [0,1,0,1,0,0|1,1,0]=4 3886 B9R1.99 NCCSCC1(CC1)Cl m_7__20871276__13965792 [0,1,0,1,0,0|1,1,0]=4 3887 B9R1.99 OCCNCC1(CC1)F m_207__121484__9479524 [0,1,0,1,0,0|1,0,0]=3 3888 B9R1.99 OCCSCC1(CC1)Br m_7__128807__10901808 [0,1,0,1,0,0|0,1,0]=3 3889 B9R1.99 OCCSCC1(CC1)Cl m_7__128807__13965792 [0,1,0,1,0,0|0,1,0]=3 3890 B9R1.118 CNC1(CCCOC1)C m_2230__22404548__2463448 [0,1,0,1,0,0|2,0,0]=4 3891 B9R1.132 C[C@H]1CC[C@H](N1C)CO m_2230__12910002__2463448 [0,1,0,1,0,0|2,0,0]=4 3892 B9R1.135 CC1CN(C1C)CCF m_2230__10547152__22320836 [0,1,0,1,0,0|2,0,0]=4 3893 B9R1.135 CC1CN(C1C)CCO m_2230__10547152__6165700 [0,1,0,1,0,0|1,0,0]=3 3894 B9R1.135 CCCN1CC(C1C)C m_2230__10547152__13271112 [0,1,0,1,0,0|2,0,0]=4 3895 B9R1.202 CN1CCC[C@@]1(C)CO m_2230__16807304__2463448 [0,1,0,1,0,0|2,0,0]=4 3896 B9R1.202 CNC1(CCCC1O)C m_2230__17523550__2463448 [0,1,0,1,0,0|2,0,0]=4 3897 B9R1.6 CN(C)C1CCCOC1 m_2230__10122300__2463448 [0,1,0,1,0,0|2,0,0]=4 3898 B9R1.6 CS(=O)C1CCCOC1 m_265282__8601832__4273530 [0,1,0,1,0,0|2,0,0]=4 3899 B9R1.6 NC(=O)C1CCCCO1 m_22__58357__7556158 [0,1,0,1,0,0|0,0,2]=4 3900 B9R1.6 NC(=O)C1COCCO1 m_22__58357__636198 [0,1,0,1,0,0|1,0,1]=4 3901 B9R1.13 CC(C)CN1CCCC1 m_2230__678722__681214 [0,1,0,1,0,0|2,0,0]=4 3902 B9R1.13 CC(F)CN1CCCC1 m_2230__678722__16970752 [0,1,0,1,0,0|2,0,0]=4 3903 B9R1.13 CC(O)CN1CCCC1 m_2230__678722__9736146 [0,1,0,1,0,0|1,0,0]=3 3904 B9R1.13 CN(C)C[C@@H]1CCCO1 m_2230__8963526__2463448 [0,1,0,1,0,0|2,0,0]=4 3905 B9R1.13 CS(=O)CC1CCCO1 m_265282__9298154__4273530 [0,1,0,1,0,0|2,0,0]=4 3906 B9R1.13 C[C@H](N)CN1CCCC1 m_269982__7368900__25012480 [0,1,0,1,0,0|2,0,0]=4 3907 B9R1.13 FC(F)CN1CCCC1 m_2230__678722__8371038 [0,1,0,1,0,0|2,0,0]=4 3908 B9R1.13 NC(=O)CC1OCCO1 m_22__58357__9099850 [0,1,0,1,0,0|1,0,1]=4 3909 B9R1.13 O=C(O)CN1CCCC1 m_270122__11723430__22563622 [0,1,0,1,0,0|1,0,1]=4 3910 B9R1.24 CNC1CCCC1(C)O m_2230__13973604__2463448 [0,1,0,1,0,0|2,0,0]=4 3911 B9R1.24 CNC1COCC1(C)C m_269862__7193148__13259104 [0,1,0,1,0,0|2,0,0]=4 3912 B9R1.24 CNC1COCC1(F)F m_2230__22410536__2463448 [0,1,0,1,0,0|2,0,0]=4 3913 B9R1.40 CN1CCOCC1(C)C m_2230__1950868__2463448 [0,1,0,1,0,0|2,0,0]=4 3914 B9R1.41 CC(O)[C@H]1CCCN1C m_2230__12057664__2463448 [0,1,0,1,0,0|2,0,0]=4 3915 B9R1.41 CN(C)[C@@H]1CCC[C@H]1O m_2230__13027130__2463448 [0,1,0,1,0,0|2,0,0]=4 3916 B9R1.41 CN(C)[C@@H]1CNC[C@H]1O m_269982__13570078__14064228 [0,1,0,1,0,0|2,0,0]=4 3917 B9R1.41 CN(C)[C@@H]1COC[C@H]1O m_2230__13027270__2463448 [0,1,0,1,0,0|1,0,0]=3 3918 B9R1.41 C[C@H]1CCO[C@H]1C(=O)N m_22__58357__10743374 [0,1,0,1,0,0|0,0,2]=4 3919 B9R1.41 NC(=O)C1COCC1O m_22__58357__22363626 [0,1,0,1,0,0|1,0,1]=4 3920 B9R1.46 CC(C)CNC1CC1C m_207__3377454__121216 [0,1,0,1,0,0|2,0,0]=4 3921 B9R1.46 CC(C)CN[C@@H]1C[C@H]1C m_207__12364696__121216 [0,1,0,1,0,0|2,0,0]=4 3922 B9R1.46 CC(C)CN[C@@H]1C[C@H]1O m_207__23835494__121216 [0,1,0,1,0,0|2,0,0]=4 3923 B9R1.46 CC(O)CN[C@@H]1C[C@@H]1F m_273610__14595896__11516404 [0,1,0,1,0,0|2,0,0]=4 3924 B9R1.46 CC(O)CN[C@@H]1C[C@H]1C m_273610__12364740__11516404 [0,1,0,1,0,0|1,0,0]=3 3925 B9R1.46 CC(O)CN[C@H]1C[C@H]1F m_273610__17757782__11516404 [0,1,0,1,0,0|2,0,0]=4 3926 B9R1.67 CC(C)CN1CC[C@H]1C m_270004__24224170__8127718 [0,1,0,1,0,0|2,0,0]=4 3927 B9R1.67 CC(C)SC1CCC1O m_7__22986908__5048 [0,1,0,1,0,0|2,0,0]=4 3928 B9R1.84 CC(C)CSC1CCC1 m_7__10684076__1010132 [0,1,0,1,0,0|1,1,0]=4 3929 B9R1.84 CC(F)CSC1CCC1 m_7__10684076__16970746 [0,1,0,1,0,0|1,1,0]=4 3930 B9R1.84 CC(O)CNC1CCC1 m_273610__12113724__11516404 [0,1,0,1,0,0|1,0,0]=3 3931 B9R1.84 CC(O)CNC1COC1 m_269862__7192560__7931470 [0,1,0,1,0,0|2,0,0]=4 3932 B9R1.84 CC(O)CSC1CCC1 m_7__10684076__10902704 [0,1,0,1,0,0|0,1,0]=3 3933 B9R1.84 CC(O)CSC1CNC1 m_7__22987816__10902704 [0,1,0,1,0,0|1,1,0]=4 3934 B9R1.84 CC(O)CSC1COC1 m_7__13420946__10902704 [0,1,0,1,0,0|1,1,0]=4 3935 B9R1.84 CC(O)CSC1CSC1 m_7__20064714__10902704 [0,1,0,1,0,0|1,1,0]=4 3936 B9R1.84 C[C@H](N)CSC1CCC1 m_7__20871336__13420952 [0,1,0,1,0,0|1,1,0]=4 3937 B9R1.84 FC(F)CSC1CCC1 m_7__10684076__16886816 [0,1,0,1,0,0|1,1,0]=4 3938 B9R1.84 NC(=O)COC1CCC1 m_22__58357__17782286 [0,1,0,1,0,0|0,0,2]=4 3939 B9R1.84 O=C(O)CSC1CCC1 m_7__26823__13420952 [0,1,0,1,0,0|0,1,1]=4 3940 B9R1.85 CC(C)CCNC1CC1 m_207__109430__134014 [0,1,0,1,0,0|2,0,0]=4 3941 B9R1.85 CC(C)CCSC1CC1 m_7__22987856__16761930 [0,1,0,1,0,0|1,1,0]=4 3942 B9R1.85 CC(C)CNCC1CC1 m_207__662500__121216 [0,1,0,1,0,0|2,0,0]=4 3943 B9R1.85 CC(C)CSCC1CC1 m_62__1010136__7141822 [0,1,0,1,0,0|1,1,0]=4 3944 B9R1.85 CC(F)CCSC1CC1 m_7__22987858__13165340 [0,1,0,1,0,0|1,1,0]=4 3945 B9R1.85 CC(F)CNCC1CC1 m_270004__13461138__7548776 [0,1,0,1,0,0|2,0,0]=4 3946 B9R1.85 CC(F)CSCC1CC1 m_62__7141820__16913488 [0,1,0,1,0,0|1,1,0]=4 3947 B9R1.85 CC(N)CCSC1CC1 m_7__20871360__16761930 [0,1,0,1,0,0|1,1,0]=4 3948 B9R1.85 CC(O)CCSC1CC1 m_7__22987858__12057932 [0,1,0,1,0,0|1,1,0]=4 3949 B9R1.85 CC(O)CNCC1CC1 m_273610__11517374__11516404 [0,1,0,1,0,0|1,0,0]=3 3950 B9R1.85 CC(O)CSCC1CC1 m_7__10953796__7141812 [0,1,0,1,0,0|0,1,0]=3 3951 B9R1.85 CC(O)CSCC1CS1 m_7__10953796__22787476 [0,1,0,1,0,0|1,1,0]=4 3952 B9R1.85 CN(C)CCOC1CC1 m_2230__14597450__2463448 [0,1,0,1,0,0|2,0,0]=4 3953 B9R1.85 C[C@H](N)CSCC1CC1 m_7__20871336__7141812 [0,1,0,1,0,0|1,1,0]=4 3954 B9R1.85 FC(Br)CNCC1CC1 m_270004__23851146__7548776 [0,1,0,1,0,0|2,0,0]=4 3955 B9R1.85 FC(Cl)CNCC1CC1 m_270004__21631482__7548776 [0,1,0,1,0,0|2,0,0]=4 3956 B9R1.85 FC(F)CNCC1CC1 m_207__21586816__2989440 [0,1,0,1,0,0|2,0,0]=4 3957 B9R1.85 FC(F)CSCC1CC1 m_7__22987700__7141812 [0,1,0,1,0,0|1,1,0]=4 3958 B9R1.85 NC(=O)COCC1CC1 m_22__58357__752298 [0,1,0,1,0,0|0,0,2]=4 3959 B9R1.85 O=C(O)CSCC1CC1 m_7__26823__7141812 [0,1,0,1,0,0|0,1,1]=4 3960 B9R1.96 CC(C)N1CCC1CO m_2230__13428546__680832 [0,1,0,1,0,0|2,0,0]=4 3961 B9R1.96 CCN1CCC1C(C)O m_270004__24177142__24715004 [0,1,0,1,0,0|2,0,0]=4 3962 B9R2.39 CN1C[C@@H]2C[C@H]1CO2 m_2230__12343778__2463448 [0,0,0,2,0,0|2,0,0]=4 3963 B9R2.2 C1CCN(C1)C2CC2 m_2230__678722__16761932 [0,0,0,2,0,0|2,0,0]=4 3964 B9R2.157 C1CC(C1)SC2CC2 m_7__10684076__16761930 [0,0,0,2,0,0|1,1,0]=4 3965 B9R2.69 C1CC1CNC2CC2 m_207__109430__2989440 [0,0,0,2,0,0|2,0,0]=4 3966 B9R2.69 C1CC1CSC2CC2 m_7__22987858__7141812 [0,0,0,2,0,0|1,1,0]=4