0 B5R0.1 CC(=CCS)C ACT06408 [0,0,0,0,0,0|0,1,3]=4 1 B5R0.1 CC(C)CCS ACT06430 [0,0,0,0,0,0|0,1,1]=2 2 B4R0.1 C(=O)C(=O)O ACT06826 [1,0,0,0,0,0|2,0,1]=4 3 B4R0.1 CC(=C)CBr ACT08856 [1,0,0,0,0,0|1,0,2]=4 4 B4R0.1 CC(=O)CCl ACT09266 [1,0,0,0,0,0|2,0,1]=4 5 B4R0.1 CC(C#C)O ACT09213 [1,0,0,0,0,0|1,0,2]=4 6 B4R0.1 CC(C)CS ACT06243 [1,0,0,0,0,0|0,1,0]=2 7 B4R0.1 CC=C(C)Br ACT12017 [1,0,0,0,0,0|2,0,1]=4 8 B4R0.1 C[C@@H](CN)N ACT04807 [1,0,0,0,0,0|2,0,0]=3 9 B4R0.1 C[C@H](CN)N ACT06789 [1,0,0,0,0,0|2,0,0]=3 10 B4R0.2 C#CCCO ACT08938 [1,0,0,0,0,0|2,0,1]=4 11 B4R0.2 C(CCl)CBr ACT04979 [1,0,0,0,0,0|2,0,1]=4 12 B4R0.2 C=CCCBr ACT03064 [1,0,0,0,0,0|2,0,0]=3 13 B4R0.2 CCCCS ACT06241 [1,0,0,0,0,0|0,1,1]=3 14 B4R0.2 CCCSC ACT06183 [1,0,0,0,0,0|2,0,0]=3 15 B4R0.2 CCOC#C ACT10610 [1,0,0,0,0,0|2,0,1]=4 16 B4R0.2 CCSCC ACT06138 [1,0,0,0,0,0|2,0,1]=4 17 B4R0.2 CNCC=C ACT04698 [1,0,0,0,0,0|2,0,0]=3 18 B4R0.2 CSCC=C ACT06184 [1,0,0,0,0,0|2,0,0]=3 19 B4R0.2 CSCCO ACT06338 [1,0,0,0,0,0|1,0,2]=4 20 B6R0.1 CNCC(CO)O ACT08072 [0,1,0,0,0,0|3,0,0]=4 21 B6R0.2 CC(C)NC(C)C ACT04717 [0,1,0,0,0,0|2,0,1]=4 22 B6R0.2 CC(C)SC(C)C ACT06148 [0,1,0,0,0,0|2,0,1]=4 23 B6R0.2 C[C@@H](CC(=O)O)N ACT02393 [0,1,0,0,0,0|1,0,0]=2 24 B6R0.2 C[C@@H](CC(=O)O)N ACT09644 [0,1,0,0,0,0|1,0,0]=2 25 B6R0.2 C[C@H](CC(=O)O)N ACT05190 [0,1,0,0,0,0|1,0,0]=2 26 B6R0.3 CC(C)[C@@H](CO)N ACT04154 [0,1,0,0,0,0|0,0,2]=3 27 B6R0.3 CC(C)[C@H](CO)N ACT05171 [0,1,0,0,0,0|0,0,2]=3 28 B6R0.3 CN(C)C(=O)C=C ACT05674 [0,1,0,0,0,0|2,0,1]=4 29 B6R0.3 C[C@@H]([C@H](CO)N)O ACT04169 [0,1,0,0,0,0|1,0,2]=4 30 B6R0.3 C[C@H]([C@@H](CO)N)O ACT04168 [0,1,0,0,0,0|1,0,2]=4 31 B6R0.3 C[C@H]([C@@H](CO)N)O ACT10787 [0,1,0,0,0,0|1,0,2]=4 32 B6R0.4 CC(C)CON=O ACT08297 [0,1,0,0,0,0|1,0,0]=2 33 B6R0.5 CC(C)(C)CCO ACT02969 [0,1,0,0,0,0|0,0,2]=3 34 B6R0.5 CC(C)(C)ON=O ACT08292 [0,1,0,0,0,0|2,0,0]=3 35 B6R0.5 C[Si](C)(C)CC=C ACT10237 [0,1,0,0,0,0|1,1,0]=3 36 B6R0.5 C[Si](C)(C)CCO ACT02730 [0,1,0,0,0,0|0,1,2]=4 37 B6R1.2 C1C=CCC1N ACT10576 [0,0,0,1,0,0|2,0,0]=3 38 B6R1.2 C1CNC[C@@H]1N ACT06688 [0,0,0,1,0,0|2,0,1]=4 39 B6R1.2 C1CNC[C@@H]1O ACT01716 [0,0,0,1,0,0|2,0,1]=4 40 B6R1.2 C1CNC[C@H]1N ACT04905 [0,0,0,1,0,0|2,0,1]=4 41 B6R1.2 C1CNC[C@H]1O ACT00442 [0,0,0,1,0,0|2,0,1]=4 42 B6R1.2 C1COC[C@@H]1O ACT10453 [0,0,0,1,0,0|1,0,2]=4 43 B6R1.2 C1COC[C@H]1N ACT06806 [0,0,0,1,0,0|1,0,2]=4 44 B6R1.2 C1COC[C@H]1O ACT05256 [0,0,0,1,0,0|1,0,2]=4 45 B6R1.2 C[C@@H]1CCNC1 ACT09361 [0,0,0,1,0,0|1,0,1]=3 46 B6R1.2 C[C@H]1CCCN1 ACT06587 [0,0,0,1,0,0|2,0,1]=4 47 B6R1.2 C[C@H]1CCNC1 ACT11957 [0,0,0,1,0,0|1,0,1]=3 48 B6R1.5 CN1CC(C1)N ACT10720 [0,0,0,1,0,0|2,0,1]=4 49 B6R1.10 CC1(CNC1)C ACT11956 [0,0,0,1,0,0|2,0,0]=3 50 B3R0.1 C(CCl)O ACT07200 [2,0,0,0,0,0|1,0,1]=4 51 B3R0.1 C(CF)O ACT09629 [2,0,0,0,0,0|1,0,1]=4 52 B3R0.1 C=CCS ACT06237 [2,0,0,0,0,0|1,0,1]=4 53 B3R0.1 CCCS ACT06229 [2,0,0,0,0,0|0,1,0]=3 54 B3R0.1 CCSC ACT06182 [2,0,0,0,0,0|1,0,1]=4 55 B3R0.2 CC(=O)Br ACT03135 [2,0,0,0,0,0|1,0,1]=4 56 B3R0.2 CC(=O)[S-] ACT05622 [2,0,0,0,0,0|1,0,1]=4 57 B3R0.2 CC(C)S ACT06230 [2,0,0,0,0,0|0,1,0]=3 58 B3R0.2 CC(C)[CH2-] ACT07636 [2,0,0,0,0,0|0,0,1]=3 59 B3R0.2 CP(C)C ACT08935 [2,0,0,0,0,0|1,0,0]=3 60 B5R0.3 C(C(CO)O)N ACT05643 [1,1,0,0,0,0|1,0,1]=4 61 B5R0.3 C([C@@H](CCl)O)N ACT03555 [1,1,0,0,0,0|2,0,0]=4 62 B5R0.3 C([C@H](CCl)O)O ACT05632 [1,1,0,0,0,0|1,0,1]=4 63 B5R0.3 C=C[C@@H](CO)N ACT09263 [1,1,0,0,0,0|1,0,1]=4 64 B5R0.3 CC(CCl)CBr ACT04986 [1,1,0,0,0,0|1,0,0]=3 65 B5R0.3 CCC(C=C)O ACT06029 [1,1,0,0,0,0|1,0,1]=4 66 B5R0.4 CC(C)(C#C)O ACT07439 [1,1,0,0,0,0|0,0,2]=4 67 B5R0.4 CC(C)(C)C#C ACT05303 [1,1,0,0,0,0|0,0,2]=4 68 B5R0.4 CC(C)(C)CBr ACT09941 [1,1,0,0,0,0|1,0,0]=3 69 B5R0.4 CC(C)(C)CO ACT08906 [1,1,0,0,0,0|0,0,1]=3 70 B5R0.4 CC(CO)(F)F ACT02888 [1,1,0,0,0,0|1,0,1]=4 71 B5R0.4 C[Si](C)(C)C=C ACT10207 [1,1,0,0,0,0|0,1,1]=4 72 B5R0.4 C[Si](C)(C)CBr ACT09165 [1,1,0,0,0,0|1,1,0]=4 73 B5R0.4 C[Si](C)(C)CCl ACT08903 [1,1,0,0,0,0|1,1,0]=4 74 B5R0.4 C[Si](C)(C)CI ACT09709 [1,1,0,0,0,0|1,1,0]=4 75 B5R0.4 C[Si](C)(C)CN ACT09163 [1,1,0,0,0,0|1,1,0]=4 76 B5R0.4 C[Si](C)(C)CO ACT09537 [1,1,0,0,0,0|0,1,1]=4 77 B5R0.5 CC(=O)C(=O)C ACT06100 [1,1,0,0,0,0|1,0,1]=4 78 B5R0.5 CC(C(=O)Br)Br ACT03417 [1,1,0,0,0,0|1,0,0]=3 79 B5R0.5 CC(C(=O)C)O ACT06054 [1,1,0,0,0,0|1,0,0]=3 80 B5R0.5 CC(C(=O)C)S ACT06274 [1,1,0,0,0,0|1,0,0]=3 81 B5R0.5 CC(C(=O)O)Br ACT01974 [1,1,0,0,0,0|1,0,0]=3 82 B5R0.5 CC(C(=O)O)N ACT07794 [1,1,0,0,0,0|1,0,0]=3 83 B5R0.5 CC(C(C)S)O ACT06277 [1,1,0,0,0,0|1,0,1]=4 84 B5R0.5 CC(C)C(=O)Cl ACT05625 [1,1,0,0,0,0|0,0,0]=2 85 B5R0.5 C[C@@H](C(=O)N)N ACT03139 [1,1,0,0,0,0|1,0,0]=3 86 B5R0.5 C[C@H](C(=O)N)N ACT10902 [1,1,0,0,0,0|1,0,0]=3 87 B5R0.5 C[C@H](C(=O)O)N ACT07928 [1,1,0,0,0,0|1,0,0]=3 88 B5R0.2 C#CCCCCl ACT08610 [1,1,0,0,0,0|1,0,1]=4 89 B5R0.2 C#CCCCO ACT09819 [1,1,0,0,0,0|1,0,1]=4 90 B5R0.2 C(CCO)CN ACT08231 [1,1,0,0,0,0|0,0,2]=4 91 B5R0.2 C=CCCC=C ACT05312 [1,1,0,0,0,0|1,0,1]=4 92 B5R0.2 C=CCCCBr ACT10075 [1,1,0,0,0,0|1,0,0]=3 93 B5R0.2 C=CCCCO ACT03061 [1,1,0,0,0,0|1,0,0]=3 94 B5R0.2 CCCCC#C ACT10051 [1,1,0,0,0,0|1,0,1]=4 95 B5R0.2 CCCSSC ACT06210 [1,1,0,0,0,0|1,1,0]=4 96 B5R0.2 CNCCNC ACT07313 [1,1,0,0,0,0|2,0,0]=4 97 B5R0.2 CSCCCO ACT06341 [1,1,0,0,0,0|0,0,2]=4 98 B5R0.2 CSSCC=C ACT06216 [1,1,0,0,0,0|2,0,0]=4 99 B7R0.2 C([C@H](CN)O)C(=O)O ACT10094 [0,2,0,0,0,0|1,0,0]=3 100 B7R0.2 CC(C)C[C@@H](CO)N ACT04160 [0,2,0,0,0,0|0,0,2]=4 101 B7R0.2 CC(C)C[C@H](CO)N ACT04161 [0,2,0,0,0,0|0,0,2]=4 102 B7R0.2 CC[C@H](C)CC(=O)O ACT09115 [0,2,0,0,0,0|0,0,0]=2 103 B7R0.2 C[C@H](CC(=O)OC)O ACT06831 [0,2,0,0,0,0|1,0,0]=3 104 B7R0.3 COC(=O)CCC=O ACT08469 [0,2,0,0,0,0|1,0,1]=4 105 B7R0.7 CCCC(C)CC=S ACT06342 [0,2,0,0,0,0|0,1,0]=3 106 B7R0.10 CC[C@H](C)[C@@H](CO)N ACT04158 [0,2,0,0,0,0|0,0,2]=4 107 B7R0.9 CC(=O)CC(C)(C)S ACT05878 [0,2,0,0,0,0|0,0,0]=2 108 B7R0.9 CC(=O)N[Si](C)(C)C ACT08258 [0,2,0,0,0,0|1,1,0]=4 109 B7R0.9 CC(=O)O[Si](C)(C)C ACT09455 [0,2,0,0,0,0|1,1,0]=4 110 B7R0.9 CC(C)(C)CC(=O)Cl ACT06988 [0,2,0,0,0,0|0,0,0]=2 111 B7R0.9 CC(C)(C)CC(=O)O ACT06987 [0,2,0,0,0,0|0,0,0]=2 112 B7R0.9 C[Si](C)(C)CC(=O)O ACT09356 [0,2,0,0,0,0|0,1,0]=3 113 B7R0.16 CC(C)[C@H](C(=O)N)N ACT03147 [0,2,0,0,0,0|0,0,0]=2 114 B7R0.16 CC(C)[C@H](C(=O)O)N ACT04818 [0,2,0,0,0,0|0,0,0]=2 115 B7R0.14 CC(C)(C)[C@@H](CO)N ACT07359 [0,2,0,0,0,0|0,0,2]=4 116 B7R0.14 CC(C)(C)[C@H](CO)N ACT07355 [0,2,0,0,0,0|0,0,2]=4 117 B7R0.4 CC(C)CCON=O ACT05198 [0,2,0,0,0,0|0,0,1]=3 118 B7R0.6 CC(=O)CCC(=O)C ACT02799 [0,2,0,0,0,0|1,0,1]=4 119 B7R0.6 CC(=O)NCC(=O)O ACT08307 [0,2,0,0,0,0|1,0,1]=4 120 B7R0.6 CN(C)CCC(=O)O ACT09593 [0,2,0,0,0,0|1,0,0]=3 121 B7R0.8 C[Si](C)(C)C#CC=O ACT09502 [0,2,0,0,0,0|0,1,1]=4 122 B5R1.2 C1C(CN1)O ACT02769 [1,0,0,1,0,0|2,0,0]=4 123 B5R1.3 C1CC1CBr ACT02757 [1,0,0,1,0,0|1,0,0]=3 124 B5R1.1 C1C=CCN1 ACT12011 [1,0,0,1,0,0|2,0,0]=4 125 B5R1.1 C1CCCC1 ACT08097 [1,0,0,1,0,0|1,0,1]=4 126 B5R1.1 C1CCOC1 ACT09264 [1,0,0,1,0,0|0,0,2]=4 127 B7R1.1 C1CNC[C@@H]1CO ACT07264 [0,1,0,1,0,0|1,0,1]=4 128 B7R1.1 C1COCC1CO ACT09047 [0,1,0,1,0,0|0,0,2]=4 129 B7R1.2 C1[C@@H](CNC1=O)O ACT01696 [0,1,0,1,0,0|1,0,0]=3 130 B7R1.3 C[C@@H]1CCCCN1 ACT09105 [0,1,0,1,0,0|1,0,1]=4 131 B7R1.3 C[C@@H]1CNCCN1 ACT11136 [0,1,0,1,0,0|1,0,1]=4 132 B7R1.3 C[C@H]1CCCCN1 ACT09533 [0,1,0,1,0,0|1,0,1]=4 133 B7R1.25 CC1(COC1)CO ACT04865 [0,1,0,1,0,0|2,0,0]=4 134 B7R1.14 CC1(CCCC1)O ACT11548 [0,1,0,1,0,0|1,0,1]=4