0 B8R0.1 CCCCS(=O)CCO CSC000117714 [0,0,0,0,0,0|4,0,0]=4 1 B8R0.1 CCOC(=O)CCSC CSC000173045 [0,0,0,0,0,0|0,0,0]=0 2 B8R0.1 CCOC(=O)CSCC CSC000172126 [0,0,0,0,0,0|2,0,0]=2 3 B9R0.4 CCCCC(=O)OC(C)C CSC000169914 [0,1,0,0,0,0|1,0,0]=2 4 B9R0.4 CCCNC(=O)NC(C)C CSC000163085 [0,1,0,0,0,0|3,0,0]=4 5 B9R0.4 CCCOC(=O)CC(C)C CSC000170144 [0,1,0,0,0,0|3,0,0]=4 6 B9R0.4 CNCCC(=O)NC(C)C CSC011534604 [0,1,0,0,0,0|2,0,0]=3 7 B9R0.5 CCCC(=O)NCCSC CSC000161292 [0,1,0,0,0,0|1,0,0]=2 8 B9R0.5 CCCCCC(=O)OCC CSC000170156 [0,1,0,0,0,0|1,0,0]=2 9 B9R0.5 CCCCNC(=O)CNC CSC000213093 [0,1,0,0,0,0|3,0,0]=4 10 B9R0.5 CCCCNC(=O)COC CSC000159063 [0,1,0,0,0,0|3,0,0]=4 11 B9R0.5 CCCCNC(=O)NCC CSC000163430 [0,1,0,0,0,0|2,0,0]=3 12 B9R0.5 CCCCOC(=O)CCC CSC011212260 [0,1,0,0,0,0|2,0,0]=3 13 B9R0.5 CCNC(=O)NCCC#C CSC011979724 [0,1,0,0,0,0|2,0,1]=4 14 B9R0.5 CCNC(=O)NCCOC CSC000163157 [0,1,0,0,0,0|1,1,0]=3 15 B9R0.5 CCOC(=O)CCCC#N CSC009871613 [0,1,0,0,0,0|1,0,1]=3 16 B9R0.5 CCOC(=O)CSCC#N CSC000172129 [0,1,0,0,0,0|2,0,0]=3 17 B9R0.5 COCCNC(=O)COC CSC000157859 [0,1,0,0,0,0|2,1,0]=4 18 B9R0.8 CCCOC(=O)C(C)CC CSC011213261 [0,1,0,0,0,0|3,0,0]=4 19 B9R0.18 CCCCC(=O)OCCC CSC000169915 [0,1,0,0,0,0|1,0,0]=2 20 B9R0.18 CCCCS(=O)CCCC CSC000031468 [0,1,0,0,0,0|3,0,0]=4 21 B9R0.18 CCCNC(=O)NCCC CSC000163711 [0,1,0,0,0,0|3,0,0]=4 22 B9R0.34 CCCC(=O)OC(C)CC CSC000062825 [0,1,0,0,0,0|3,0,0]=4 23 B9R0.34 CCOC(=O)CC(C)CC CSC011218107 [0,1,0,0,0,0|1,0,0]=2 24 B9R0.35 CCCC(C)C(=O)OCC CSC011217054 [0,1,0,0,0,0|1,0,0]=2 25 B9R0.48 CCCC(=O)OCC(C)C CSC000005790 [0,1,0,0,0,0|3,0,0]=4 26 B9R0.48 CCNC(=O)NCC(=C)C CSC012183401 [0,1,0,0,0,0|3,0,0]=4 27 B9R0.48 CCOC(=O)CCC(=O)C CSC011212338 [0,1,0,0,0,0|1,0,0]=2 28 B9R0.48 CCOC(=O)CCC(C)C CSC011212201 [0,1,0,0,0,0|1,0,0]=2 29 B6R0.1 CCCC(=O)NO CSC000190123 [2,0,0,0,0,0|2,0,0]=4 30 B8R0.4 CCCCCCCSC CSC000033844 [1,1,0,0,0,0|1,0,1]=4 31 B8R0.4 CCCCCCSCC CSC000073868 [1,1,0,0,0,0|1,0,1]=4 32 B8R0.4 CSCCCCCCO CSC012179070 [1,1,0,0,0,0|1,0,1]=4 33 B8R0.4 CSCCCCCSC CSC009866234 [1,1,0,0,0,0|1,0,1]=4 34 B8R0.9 COC(=O)CSC(C)C CSC000151538 [1,1,0,0,0,0|2,0,0]=4 35 B8R0.25 CCCCS(=O)(=O)CC CSC000047449 [1,1,0,0,0,0|2,0,0]=4 36 B10R0.6 CCCCCC(=O)OC(C)C CSC000170157 [0,2,0,0,0,0|1,0,0]=3 37 B10R0.6 CCCCOC(=O)CC(C)C CSC011212304 [0,2,0,0,0,0|2,0,0]=4 38 B10R0.32 CCCC(C)C(=O)NC(C)C CSC000174269 [0,2,0,0,0,0|2,0,0]=4 39 B10R0.96 CC(C)OC(=O)CCC(=O)C CSC000031084 [0,2,0,0,0,0|1,0,0]=3 40 B10R0.1 CCCC(=O)OCCCCO CSC000073227 [0,2,0,0,0,0|2,0,0]=4 41 B10R0.1 CCCCCCC(=O)OCC CSC011219609 [0,2,0,0,0,0|1,0,0]=3 42 B10R0.1 CCCCCOC(=O)CCC CSC000039025 [0,2,0,0,0,0|2,0,0]=4 43 B10R0.1 CCOC(=O)CCSCCO CSC011325821 [0,2,0,0,0,0|0,0,0]=2 44 B10R0.2 CCCC(O)CC(=O)OCC CSC011216533 [0,2,0,0,0,0|1,0,0]=3 45 B10R0.3 CCCC(=O)OCCC(C)C CSC000024463 [0,2,0,0,0,0|2,0,0]=4 46 B10R0.3 CCOC(=O)CCCC(=O)C CSC000032325 [0,2,0,0,0,0|1,0,0]=3 47 B10R0.3 CCOC(=O)CSCC(=O)C CSC000172134 [0,2,0,0,0,0|1,0,0]=3 48 B10R0.19 CCCOC(=O)C(C)CCC CSC011217736 [0,2,0,0,0,0|1,0,0]=3 49 B10R0.91 CCCCC(=O)NCCC#C CSC011979654 [0,2,0,0,0,0|2,0,0]=4 50 B10R0.91 CCCCCC(=O)OCC=C CSC000006420 [0,2,0,0,0,0|1,0,1]=4 51 B10R0.91 CCCCCC(=O)OCCC CSC000170158 [0,2,0,0,0,0|1,0,0]=3 52 B10R0.91 CCCCNC(=O)NCCC CSC000163429 [0,2,0,0,0,0|2,0,0]=4 53 B10R0.91 CCCNC(=O)NCCOC CSC000163156 [0,2,0,0,0,0|1,1,0]=4 54 B10R0.91 CCOCC(=O)NCCC#C CSC011979636 [0,2,0,0,0,0|1,0,1]=4 55 B10R0.108 CCOC(=O)CNC(=O)CN CSC011367924 [0,2,0,0,0,0|2,0,0]=4 56 B10R0.108 CCOC(=O)NCC(=O)OC CSC000161429 [0,2,0,0,0,0|0,1,1]=4 57 B10R0.26 CCOC(=O)CN(C)C(C)C CSC000227145 [0,2,0,0,0,0|2,0,0]=4 58 B10R0.34 CCOC(=O)CN(CC)CC CSC000224615 [0,2,0,0,0,0|2,0,0]=4 59 B10R0.129 CCOC(=O)C(C)(C)CC=C CSC000082643 [0,2,0,0,0,0|1,0,1]=4 60 B10R0.109 CCOC(=O)CCC(C)(C)C CSC012130662 [0,2,0,0,0,0|1,0,0]=3 61 B10R0.109 CCOC(=O)CCC(C)(F)F CSC000054117 [0,2,0,0,0,0|1,0,0]=3 62 B10R0.109 CCOC(=O)CCC(F)(F)F CSC011215681 [0,2,0,0,0,0|2,0,0]=4 63 B10R0.109 CCOC(=O)CNS(=O)(=O)C CSC000238371 [0,2,0,0,0,0|1,0,1]=4 64 B10R1.293 CCCNC(=O)C1CC1C CSC000161773 [0,1,0,1,0,0|2,0,0]=4 65 B10R1.11 CCNC(=O)C1CCCN1 CSC011197115 [0,1,0,1,0,0|2,0,0]=4 66 B10R1.11 CCNC(=O)C1CCNC1 CSC011790733 [0,1,0,1,0,0|2,0,0]=4 67 B10R1.11 CCNC(=O)C1CCOC1 CSC011558105 [0,1,0,1,0,0|1,1,0]=4 68 B10R1.11 CCNC(=O)C1CSCN1 CSC011222803 [0,1,0,1,0,0|1,0,0]=3 69 B10R1.11 CCNC(=O)[C@@H]1CCCN1 CSC011422904 [0,1,0,1,0,0|2,0,0]=4 70 B10R1.11 CCNC(=O)[C@@H]1CCNC1 CSC018701730 [0,1,0,1,0,0|2,0,0]=4 71 B10R1.11 CCNC(=O)[C@H]1CCNC1 CSC015592258 [0,1,0,1,0,0|2,0,0]=4 72 B10R1.11 CCNC(=O)[C@H]1CSCN1 CSC046269313 [0,1,0,1,0,0|1,0,0]=3 73 B10R1.11 CCOC(=O)C1=CCCC1 CSC009876662 [0,1,0,1,0,0|1,0,1]=4 74 B10R1.11 CCOC(=O)C1CC=CC1 CSC011934596 [0,1,0,1,0,0|1,0,0]=3 75 B10R1.11 CCOC(=O)C1CCCO1 CSC000171706 [0,1,0,1,0,0|1,0,0]=3 76 B10R1.11 CCOC(=O)C1CCSC1 CSC012019184 [0,1,0,1,0,0|0,0,0]=2 77 B10R1.137 CCNC(=O)NC1CCC1 CSC011910442 [0,1,0,1,0,0|2,0,0]=4 78 B10R1.137 CCOC(=O)CC1CCC1 CSC012001245 [0,1,0,1,0,0|1,0,0]=3 79 B10R1.186 CCCCNC(=O)C1CC1 CSC000159052 [0,1,0,1,0,0|2,0,0]=4 80 B10R1.186 COCCNC(=O)C1CC1 CSC000157847 [0,1,0,1,0,0|1,1,0]=4 81 B10R1.178 NCCNC(=O)C1CCC1 CSC000721965 [0,1,0,1,0,0|2,0,0]=4 82 B10R1.140 CCOC(=O)C1CC(=O)C1 CSC000094141 [0,1,0,1,0,0|1,0,0]=3 83 B10R1.140 CCOC(=O)C1CC(C1)C CSC009829402 [0,1,0,1,0,0|1,0,0]=3 84 B10R1.401 CCNC(=O)C1(CCC1)N CSC012868886 [0,1,0,1,0,0|2,0,0]=4