0 B9R0.45 CCCCCCSCCO CSC011304839 [0,0,0,0,0,0|4,0,0]=4 1 B9R0.45 CCCCSCCOCC CSC000053094 [0,0,0,0,0,0|4,0,0]=4 2 B8R0.4 CCCCCCCSC CSC000033844 [1,0,0,0,0,0|3,0,0]=4 3 B8R0.4 CCCCCCSCC CSC000073868 [1,0,0,0,0,0|3,0,0]=4 4 B8R0.4 CCCCCSCCO CSC011215970 [1,0,0,0,0,0|3,0,0]=4 5 B8R0.4 CCCCSCCCC CSC000025195 [1,0,0,0,0,0|2,0,0]=3 6 B8R0.4 CSCCCCCCO CSC012179070 [1,0,0,0,0,0|3,0,0]=4 7 B10R0.4 CC(C)NCCCCCCN CSC011419979 [0,1,0,0,0,0|3,0,0]=4 8 B10R0.71 CCCCCCCSCCO CSC011304838 [0,1,0,0,0,0|3,0,0]=4 9 B10R0.71 CCCCSCCOCCO CSC011409991 [0,1,0,0,0,0|3,0,0]=4 10 B10R1.5 NCCN1CCCC1CN CSC010258945 [0,0,0,1,0,0|2,0,0]=3 11 B10R1.17 CCCCN1CCCCC1 CSC000223645 [0,0,0,1,0,0|2,0,0]=3 12 B10R1.17 CCCCN1CCNCC1 CSC011194250 [0,0,0,1,0,0|3,0,0]=4 13 B10R1.17 CCCCN1CCOCC1 CSC000224583 [0,0,0,1,0,0|3,0,0]=4 14 B10R1.17 CCCCN1CCSCC1 CSC015913980 [0,0,0,1,0,0|3,0,0]=4 15 B10R1.17 CSCCN1CCCCC1 CSC000209123 [0,0,0,1,0,0|3,0,0]=4 16 B10R1.17 NCCCN1CCCCC1 CSC000204581 [0,0,0,1,0,0|1,0,0]=2 17 B10R1.17 NCCCN1CCNCC1 CSC011455964 [0,0,0,1,0,0|2,0,0]=3 18 B10R1.17 NCCCN1CCOCC1 CSC000210481 [0,0,0,1,0,0|2,0,0]=3 19 B10R1.21 CCCCNC1CCCC1 CSC000200677 [0,0,0,1,0,0|2,0,0]=3 20 B10R1.29 CCCCN1CCCC1C CSC016237178 [0,0,0,1,0,0|2,0,0]=3 21 B10R1.29 CSCCN1CCCC1C CSC046123987 [0,0,0,1,0,0|3,0,0]=4 22 B9R0.2 CCCCCCCC(=O)N CSC011216093 [1,1,0,0,0,0|1,0,1]=4 23 B9R0.18 CCCCN(C)CCCC CSC000020957 [1,1,0,0,0,0|1,0,0]=3 24 B9R0.18 CCCCN(C)CCCN CSC011191814 [1,1,0,0,0,0|0,0,0]=2 25 B9R0.18 CCCCS(=O)CCCC CSC000031468 [1,1,0,0,0,0|2,0,0]=4 26 B9R0.18 CN(CCCN)CCCN CSC000032369 [1,1,0,0,0,0|0,0,0]=2 27 B9R0.46 CCCCCNC(=O)CC CSC000157985 [1,1,0,0,0,0|1,0,1]=4 28 B9R0.46 CCCCSCC(O)CO CSC011995958 [1,1,0,0,0,0|2,0,0]=4 29 B11R0.148 CCCCCCCCCC(=O)N CSC011216713 [0,2,0,0,0,0|2,0,0]=4 30 B11R0.140 CNCCCN(C)CCCNC CSC000033595 [0,2,0,0,0,0|2,0,0]=4 31 B9R1.8 NCCN1CCSCC1 CSC000755026 [1,0,0,1,0,0|2,0,0]=4 32 B11R1.4 N#CCCCCN1CCCC1 CSC000224217 [0,1,0,1,0,0|1,0,1]=4 33 B11R1.4 NCCOCCN1CCCC1 CSC011651305 [0,1,0,1,0,0|1,0,0]=3 34 B11R1.24 CC1CCCN(C1)CCCF CSC016052343 [0,1,0,1,0,0|2,0,0]=4 35 B11R1.24 CC1CN(CCN1)CCCN CSC015620312 [0,1,0,1,0,0|2,0,0]=4 36 B11R1.24 OCCCN1CCCC(C1)O CSC000213728 [0,1,0,1,0,0|2,0,0]=4 37 B11R1.24 OCCCN1CCC[C@@H](C1)O CSC014194709 [0,1,0,1,0,0|2,0,0]=4 38 B11R1.230 CC1CC(CN1CCCO)O CSC015428650 [0,1,0,1,0,0|2,0,0]=4 39 B11R1.230 CC1CC(N(C1)CCCF)C CSC015295569 [0,1,0,1,0,0|2,0,0]=4 40 B11R1.17 CC1CCCCN1CCCF CSC016198936 [0,1,0,1,0,0|2,0,0]=4 41 B11R1.17 CC1CCCCN1CCCN CSC000212276 [0,1,0,1,0,0|1,0,0]=3 42 B11R1.17 CC1CCCCN1CCCO CSC000213889 [0,1,0,1,0,0|2,0,0]=4 43 B11R1.17 CC1CNCCN1CCCN CSC015967503 [0,1,0,1,0,0|1,0,0]=3 44 B11R1.17 CCCCN1CCOC[C@@H]1C CSC046332471 [0,1,0,1,0,0|2,0,0]=4 45 B11R1.17 CCCCN1CCOC[C@H]1C CSC015850260 [0,1,0,1,0,0|2,0,0]=4 46 B11R1.28 CCCCCN1CCNCC1 CSC011207891 [0,1,0,1,0,0|2,0,0]=4 47 B11R1.28 CNCCCN1CCCCC1 CSC000232496 [0,1,0,1,0,0|1,0,0]=3 48 B11R1.28 CNCCCN1CCOCC1 CSC000224819 [0,1,0,1,0,0|2,0,0]=4 49 B11R1.28 N#CCCCN1CCCCC1 CSC000223656 [0,1,0,1,0,0|1,0,1]=4 50 B11R1.28 NCCCNC1CCCCC1 CSC000211309 [0,1,0,1,0,0|1,0,0]=3 51 B11R1.28 OCCCCN1CCCCC1 CSC011305566 [0,1,0,1,0,0|2,0,0]=4 52 B11R1.28 OCCCCN1CCOCC1 CSC000723369 [0,1,0,1,0,0|2,0,0]=4 53 B11R1.41 CCC1CCCCN1CCN CSC000755458 [0,1,0,1,0,0|2,0,0]=4 54 B11R1.203 CCCCN1CCCNCC1 CSC011194251 [0,1,0,1,0,0|2,0,0]=4 55 B11R1.203 FCCCN1CCCCCC1 CSC012895120 [0,1,0,1,0,0|2,0,0]=4 56 B11R1.203 NCCCN1CCCCCC1 CSC000181460 [0,1,0,1,0,0|1,0,0]=3 57 B11R1.203 NCCCN1CCCNCC1 CSC011455967 [0,1,0,1,0,0|1,0,0]=3 58 B11R1.203 OCCCN1CCCCCC1 CSC000212468 [0,1,0,1,0,0|2,0,0]=4 59 B11R1.203 OCCCN1CCCOCC1 CSC011599119 [0,1,0,1,0,0|2,0,0]=4 60 B11R1.1 CC1CCN(CC1)CCCF CSC015316295 [0,1,0,1,0,0|2,0,0]=4 61 B11R1.1 CC1CCN(CC1)CCCN CSC000205138 [0,1,0,1,0,0|1,0,0]=3 62 B11R1.1 CC1CCN(CC1)CCCO CSC000213400 [0,1,0,1,0,0|2,0,0]=4 63 B11R1.1 CCCCN1CCC(CC1)C CSC000021023 [0,1,0,1,0,0|2,0,0]=4 64 B11R1.1 CCCCN1CCC(CC1)N CSC000746687 [0,1,0,1,0,0|2,0,0]=4 65 B11R1.1 NC1CCN(CC1)CCCF CSC012860623 [0,1,0,1,0,0|2,0,0]=4 66 B11R1.1 OC1CCN(CC1)CCCF CSC012862524 [0,1,0,1,0,0|2,0,0]=4 67 B11R1.40 CC(CO)CN1CCCCC1 CSC011934647 [0,1,0,1,0,0|2,0,0]=4 68 B11R1.212 CC1CCN(C1C)CCCF CSC015400731 [0,1,0,1,0,0|2,0,0]=4 69 B11R1.29 CN(CCCN)C1CCCC1 CSC011227406 [0,1,0,1,0,0|1,0,0]=3 70 B11R1.465 CC1CCC(N1CCCF)C CSC015684633 [0,1,0,1,0,0|2,0,0]=4