0 B6R0.6 BrCC[NH2+]CCBr W6266 [0,0,0,0,0,0|2,0,1]=3 1 B6R0.6 C#CCCCCBr 0285AC [0,0,0,0,0,0|3,0,1]=4 2 B6R0.6 C#CCCCCCl Z1919 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.6 C#CCCCCI 1166AQ [0,0,0,0,0,0|3,0,1]=4 4 B6R0.6 C=CCCCCCl X6224 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.6 CCC#CCCO 5338AH [0,0,0,0,0,0|2,0,1]=3 6 B6R0.6 CCCC#CCO V0624 [0,0,0,0,0,0|2,0,1]=3 7 B6R0.6 CCCCSCC 7568AF [0,0,0,0,0,0|4,0,0]=4 8 B6R0.6 CCCNCCO 8316AA [0,0,0,0,0,0|1,0,0]=1 9 B6R0.6 CNCCCCO 5794AB [0,0,0,0,0,0|3,0,0]=3 10 B6R0.6 C\C=C/CCCO 7448AL [0,0,0,0,0,0|2,0,2]=4 11 B6R0.6 ICCOCCI 4098AB [0,0,0,0,0,0|3,0,0]=3 12 B6R0.6 NCCOCCN 9093AB [0,0,0,0,0,0|3,0,0]=3 13 B6R0.6 SCCCCCS 7344AF [0,0,0,0,0,0|1,2,0]=3 14 B6R0.6 SCCOCCS 5152AL [0,0,0,0,0,0|1,2,0]=3 15 B5R0.2 C=CCCCN 2628AB [1,0,0,0,0,0|2,0,1]=4 16 B5R0.2 CC#CCCC 7448AF [1,0,0,0,0,0|2,0,1]=4 17 B5R0.2 CCCCON 7308AJ [1,0,0,0,0,0|3,0,0]=4 18 B5R0.2 CCCSSC 8846AJ [1,0,0,0,0,0|3,0,0]=4 19 B5R0.2 CC\C=C/CC 7431AL [1,0,0,0,0,0|2,0,1]=4 20 B5R0.2 CC\C=C/CO 3214AL [1,0,0,0,0,0|1,0,1]=3 21 B5R0.2 CC\C=C\CC 3771AD [1,0,0,0,0,0|2,0,1]=4 22 B5R0.2 N#CCCCBr B613 [1,0,0,0,0,0|2,0,1]=4 23 B5R0.2 NCCCCBr 4038AB [1,0,0,0,0,0|2,0,0]=3 24 B5R0.2 NCCCCBr Z4484 [1,0,0,0,0,0|2,0,0]=3 25 B5R0.2 NCCCCCl 9859AB [1,0,0,0,0,0|2,0,0]=3 26 B5R0.2 OCCNCO 5459AL [1,0,0,0,0,0|0,0,0]=1 27 B7R0.1 C=CCC#CCCO 1165AQ [0,1,0,0,0,0|2,0,1]=4 28 B7R0.1 CCCC#CCCC 7932AF [0,1,0,0,0,0|3,0,0]=4 29 B7R0.1 CCCC#CCCO 5337AH [0,1,0,0,0,0|2,0,0]=3 30 B7R0.1 CCCCC#CCO V0602 [0,1,0,0,0,0|2,0,1]=4 31 B7R0.1 CCCCCCOC 8052AL [0,1,0,0,0,0|2,0,0]=3 32 B7R0.1 CCCCSCCO 5039AL [0,1,0,0,0,0|2,0,0]=3 33 B7R0.1 CCCNCCCN 1645AB [0,1,0,0,0,0|2,0,0]=3 34 B7R0.1 CCC\C=C/CCC 7451AL [0,1,0,0,0,0|3,0,0]=4 35 B7R0.1 CCNCCCCO 2370AE [0,1,0,0,0,0|2,0,0]=3 36 B7R0.1 CC\C=C/CCCO 7447AL [0,1,0,0,0,0|2,0,1]=4 37 B7R0.1 NCCCNCCN M698 [0,1,0,0,0,0|2,0,0]=3 38 B7R0.1 NCCCNCCO 6154AB [0,1,0,0,0,0|1,0,0]=2 39 B7R0.1 NCCNCCCO 8334AL [0,1,0,0,0,0|1,0,0]=2 40 B7R0.1 OCCNNCCO 1925AB [0,1,0,0,0,0|0,0,0]=1 41 B7R0.3 CCCCC(Br)CC 6006AL [0,1,0,0,0,0|3,0,0]=4 42 B7R0.3 CCCC[C@@H](N)CO V7833 [0,1,0,0,0,0|2,0,0]=3 43 B7R0.3 CCCNC(=O)CN V6930 [0,1,0,0,0,0|2,0,1]=4 44 B7R0.3 OCCCC(O)CO 4412AL [0,1,0,0,0,0|1,0,0]=2 45 B7R0.4 C=CCNCC(=O)O Y8695 [0,1,0,0,0,0|1,0,2]=4 46 B7R0.4 CC(C)NCCCO 0839AE [0,1,0,0,0,0|3,0,0]=4 47 B7R0.4 CCC#CCC(C)O 6519AL [0,1,0,0,0,0|2,0,1]=4 48 B7R0.4 CCCOCC(=O)O 5344AE [0,1,0,0,0,0|2,0,1]=4 49 B7R0.4 NC(=O)CSCCO 6778AD [0,1,0,0,0,0|1,0,2]=4 50 B7R0.4 NCCCCC(=O)O 9495AB [0,1,0,0,0,0|2,0,1]=4 51 B7R0.4 O=C(O)COCCCl Y5074 [0,1,0,0,0,0|2,0,1]=4 52 B7R0.4 OB(O)CCCCBr X0904 [0,1,0,0,0,0|3,0,0]=4 53 B7R0.7 CCCC(C)CCC 6609AL [0,1,0,0,0,0|3,0,0]=4 54 B7R0.7 CCCC(O)CCC 6512AL [0,1,0,0,0,0|3,0,0]=4 55 B7R0.7 CCCC(S)CCO U459 [0,1,0,0,0,0|2,0,0]=3 56 B7R0.7 CCNC(C)CCO 9482AE [0,1,0,0,0,0|3,0,0]=4 57 B7R0.7 CN(CCN)CCN 8596AL [0,1,0,0,0,0|2,0,0]=3 58 B7R0.7 O=C(CCO)CCO 5879AB [0,1,0,0,0,0|1,0,0]=2 59 B7R1.1 CCC1=NCCN1 5611AL [0,0,0,1,0,0|2,0,1]=4 60 B7R1.1 NCC1CCCC1 W7173 [0,0,0,1,0,0|3,0,0]=4 61 B7R1.1 NCC1CCCN1 W7106 [0,0,0,1,0,0|2,0,0]=3 62 B7R1.1 NCC1CCCN1 W7375 [0,0,0,1,0,0|2,0,0]=3 63 B7R1.1 NC[C@@H]1CCCN1 0819AA [0,0,0,1,0,0|2,0,0]=3 64 B7R1.1 NC[C@H]1CCCN1 Z3950 [0,0,0,1,0,0|2,0,0]=3 65 B7R1.1 OCC1OCCO1 2093AL [0,0,0,1,0,0|1,0,0]=2 66 B7R1.1 OC[C@@H]1CCNC1 4311AA [0,0,0,1,0,0|3,0,0]=4 67 B7R1.1 OC[C@@H]1CCNC1 Z7301 [0,0,0,1,0,0|3,0,0]=4 68 B7R1.1 OC[C@@H]1CCOC1 4598AA [0,0,0,1,0,0|3,0,0]=4 69 B7R1.1 OC[C@H]1CCNC1 1914AA [0,0,0,1,0,0|3,0,0]=4 70 B7R1.3 BrC1CCCOC1 X9769 [0,0,0,1,0,0|3,0,0]=4 71 B7R1.3 CC1=CCCNC1 V9748 [0,0,0,1,0,0|2,0,1]=4 72 B7R1.3 CC1COCCN1 W6211 [0,0,0,1,0,0|3,0,0]=4 73 B7R1.3 C[C@@H]1CNCCO1 8974AH [0,0,0,1,0,0|1,0,0]=2 74 B7R1.3 C[C@@H]1CNCCO1 W3662 [0,0,0,1,0,0|1,0,0]=2 75 B7R1.3 C[C@@H]1COCCN1 X4857 [0,0,0,1,0,0|3,0,0]=4 76 B7R1.3 C[C@H]1CNCCO1 W8218 [0,0,0,1,0,0|1,0,0]=2 77 B7R1.3 C[C@H]1COCCN1 X4748 [0,0,0,1,0,0|3,0,0]=4 78 B7R1.3 NC1CCCNC1 5237AE [0,0,0,1,0,0|2,0,0]=3 79 B7R1.3 NC1CCCOC1 X9447 [0,0,0,1,0,0|3,0,0]=4 80 B7R1.3 N[C@@H]1CCCOC1 5857AA [0,0,0,1,0,0|3,0,0]=4 81 B7R1.3 O=C1CCCNC1 7001AB [0,0,0,1,0,0|1,0,2]=4 82 B7R1.3 O=C1COCCO1 3182AB [0,0,0,1,0,0|1,0,2]=4 83 B7R1.3 OC1CCSCC1 W5218 [0,0,0,1,0,0|3,0,0]=4 84 B7R1.3 O[C@@H]1CCCNC1 9408AB [0,0,0,1,0,0|1,0,0]=2 85 B7R1.4 NC1CCCC1O W9232 [0,0,0,1,0,0|2,0,0]=3 86 B7R1.4 N[C@@H]1CCC[C@@H]1O V0969 [0,0,0,1,0,0|2,0,0]=3 87 B7R1.4 N[C@@H]1CCC[C@H]1O V0968 [0,0,0,1,0,0|2,0,0]=3 88 B7R1.4 N[C@@H]1COC[C@@H]1N X8658 [0,0,0,1,0,0|3,0,0]=4 89 B7R1.4 N[C@@H]1COC[C@H]1O 4689AJ [0,0,0,1,0,0|2,0,0]=3 90 B7R1.4 N[C@H]1CCC[C@H]1O V0971 [0,0,0,1,0,0|2,0,0]=3 91 B7R1.4 OC1CCCC1O 5008AJ [0,0,0,1,0,0|1,0,0]=2 92 B7R1.4 O[C@@H]1CCC[C@H]1O 6973AB [0,0,0,1,0,0|1,0,0]=2 93 B7R1.4 O[C@H]1CNC[C@@H]1O Z5315 [0,0,0,1,0,0|0,0,0]=1 94 B7R1.6 OCCC1COC1 1983AB [0,0,0,1,0,0|3,0,0]=4 95 B7R1.7 CCCCC1CO1 4465AL [0,0,0,1,0,0|2,0,0]=3 96 B7R1.7 ClCCOC1CC1 Y8014 [0,0,0,1,0,0|3,0,0]=4 97 B4R0.2 C=CCCC 7306AF [2,0,0,0,0,0|1,0,1]=4 98 B4R0.2 CCCC#N A365 [2,0,0,0,0,0|1,0,1]=4 99 B4R0.2 CCCCC 8942AJ [2,0,0,0,0,0|1,0,0]=3 100 B4R0.2 CCCCN 7306AL [2,0,0,0,0,0|1,0,0]=3 101 B4R0.2 CCCCS 4787AL [2,0,0,0,0,0|0,1,0]=3 102 B4R0.2 CCNCC 7648AL [2,0,0,0,0,0|0,0,0]=2 103 B4R0.2 CCNCC 7649AL [2,0,0,0,0,0|0,0,0]=2 104 B4R0.2 CCNCC 7650AL [2,0,0,0,0,0|0,0,0]=2 105 B4R0.2 CNCCN X9276 [2,0,0,0,0,0|1,0,0]=3 106 B4R0.2 CSCCO U461 [2,0,0,0,0,0|1,0,0]=3 107 B4R0.2 C\C=C\CC 7309AF [2,0,0,0,0,0|1,0,1]=4 108 B4R0.2 NCCCN 7173AL [2,0,0,0,0,0|2,0,0]=4 109 B4R0.2 NCCCO 5983AL [2,0,0,0,0,0|1,0,0]=3 110 B4R0.2 NOCCO 5251AJ [2,0,0,0,0,0|2,0,0]=4 111 B6R0.1 CC(CO)CCN 2620AL [1,1,0,0,0,0|1,0,0]=3 112 B6R0.1 CCCC(C)CCl 4812AL [1,1,0,0,0,0|2,0,0]=4 113 B6R0.1 CCNC(=O)CC 8553AL [1,1,0,0,0,0|1,0,1]=4 114 B6R0.1 C[C@@H](CO)CCN 4158AL [1,1,0,0,0,0|1,0,0]=3 115 B6R0.1 ClCC(Cl)CCBr 4770AL [1,1,0,0,0,0|2,0,0]=4 116 B6R0.1 OC(CCl)CCCl 4625AL [1,1,0,0,0,0|2,0,0]=4 117 B6R0.4 CC(Br)CCCBr 9465AB [1,1,0,0,0,0|2,0,0]=4 118 B6R0.4 CC(C)SCCN 3448AF [1,1,0,0,0,0|2,0,0]=4 119 B6R0.4 CC(O)CCCO 1536AL [1,1,0,0,0,0|0,0,0]=2 120 B6R0.4 CCCSC(C)C 8111AL [1,1,0,0,0,0|2,0,0]=4 121 B6R0.4 CCNCC(=O)O X5133 [1,1,0,0,0,0|0,0,1]=3 122 B6R0.4 O=C([O-])CNCO 0872AC [1,1,0,0,0,0|0,0,2]=4 123 B6R0.4 O=[N+]([O-])CCCO V2307 [1,1,0,0,0,0|1,0,1]=4 124 B8R0.1 CCCCN(C)CCCl 9577AC [0,2,0,0,0,0|2,0,0]=4 125 B8R0.1 N#CCC(=O)NCCO 4656AD [0,2,0,0,0,0|1,0,1]=4 126 B8R0.4 CCCCCCON=O 8053AL [0,2,0,0,0,0|2,0,0]=4 127 B8R0.4 CCCCCOCCO 6511AH [0,2,0,0,0,0|2,0,0]=4 128 B8R0.4 CCCCNCCC#N 8245AE [0,2,0,0,0,0|2,0,0]=4 129 B8R0.4 CCCCNCCCC W7485 [0,2,0,0,0,0|2,0,0]=4 130 B8R0.4 CCCC\C=C/CCO 7442AL [0,2,0,0,0,0|2,0,0]=4 131 B8R0.4 CC\C=C/CCCCO 7454AL [0,2,0,0,0,0|2,0,0]=4 132 B8R0.6 C#CC(O)CCCCC X7103 [0,2,0,0,0,0|2,0,0]=4 133 B8R0.6 C#CC(O)CCCCC X7104 [0,2,0,0,0,0|2,0,0]=4 134 B8R0.6 OCCCCC(O)CO X6223 [0,2,0,0,0,0|1,0,0]=3 135 B8R0.7 CCCCCCC(C)O Z6063 [0,2,0,0,0,0|2,0,0]=4 136 B8R0.7 NCCCCCC(=O)O 5982AB [0,2,0,0,0,0|2,0,0]=4 137 B8R0.7 NCCCNCC(=O)O 8332AL [0,2,0,0,0,0|1,0,1]=4 138 B8R0.25 CC(C)(CO)CCCN 3910AD [0,2,0,0,0,0|2,0,0]=4 139 B8R0.21 OCCCCC(F)(F)F 1336AE [0,2,0,0,0,0|2,0,0]=4 140 B8R0.21 OCCOCC(F)(F)F 7977AD [0,2,0,0,0,0|2,0,0]=4 141 B8R0.28 CC(C)CCCC(C)O 6866AL [0,2,0,0,0,0|2,0,0]=4 142 B8R0.30 C[N+](C)(CCO)CCO 7192AL [0,2,0,0,0,0|0,0,1]=3 143 B6R1.1 C1=CCNCC1 V3961 [1,0,0,1,0,0|1,0,1]=4 144 B6R1.1 C1=CCOCC1 X4947 [1,0,0,1,0,0|1,0,1]=4 145 B6R1.1 C1CNCCN1 8845AL [1,0,0,1,0,0|1,0,0]=3 146 B6R1.1 C1CNCCN1 8846AL [1,0,0,1,0,0|1,0,0]=3 147 B6R1.1 C1CNCCN1 G991 [1,0,0,1,0,0|1,0,0]=3 148 B6R1.1 C1CSCCO1 7266AF [1,0,0,1,0,0|1,0,0]=3 149 B6R1.2 BrC1CCNC1 X9668 [1,0,0,1,0,0|1,0,0]=3 150 B6R1.2 BrC1CCOC1 W4135 [1,0,0,1,0,0|2,0,0]=4 151 B6R1.2 CC1=NCCN1 5706AL [1,0,0,1,0,0|1,0,1]=4 152 B6R1.2 CC1CCCN1 2138AL [1,0,0,1,0,0|1,0,0]=3 153 B6R1.2 C[C@@H]1CCNC1 1585AB [1,0,0,1,0,0|1,0,0]=3 154 B6R1.2 C[C@H]1CCNC1 W4034 [1,0,0,1,0,0|1,0,0]=3 155 B6R1.2 ClC1CCCC1 H294 [1,0,0,1,0,0|2,0,0]=4 156 B6R1.2 ClC1CCOC1 X2032 [1,0,0,1,0,0|2,0,0]=4 157 B6R1.2 N[C@@H]1CCOC1 X8829 [1,0,0,1,0,0|2,0,0]=4 158 B6R1.3 BrCCC1CO1 4719AJ [1,0,0,1,0,0|1,0,0]=3 159 B6R1.3 NCCC1CC1 4787AC [1,0,0,1,0,0|2,0,0]=4 160 B6R1.3 NCCC1CC1 9526AB [1,0,0,1,0,0|2,0,0]=4 161 B6R1.6 ICC1CCO1 1038AD [1,0,0,1,0,0|1,0,0]=3 162 B6R1.6 NCC1CCC1 W6312 [1,0,0,1,0,0|2,0,0]=4 163 B6R1.6 NCC1CCC1 W6876 [1,0,0,1,0,0|2,0,0]=4 164 B6R1.6 OCC1CCO1 Z4942 [1,0,0,1,0,0|0,0,0]=2 165 B6R1.6 OCC1CNC1 W9563 [1,0,0,1,0,0|2,0,0]=4 166 B6R1.6 OCC1CNC1 Y5829 [1,0,0,1,0,0|2,0,0]=4 167 B8R1.2 C#CC1CCCNC1 Y6534 [0,1,0,1,0,0|2,0,0]=4 168 B8R1.2 CCC1CNCCO1 V6407 [0,1,0,1,0,0|1,0,0]=3 169 B8R1.2 CC[C@H]1COCCN1 1076AB [0,1,0,1,0,0|1,0,0]=3 170 B8R1.2 FCC1CCCNC1 2978AD [0,1,0,1,0,0|2,0,0]=4 171 B8R1.2 N#CC1CCCNC1 W8644 [0,1,0,1,0,0|2,0,0]=4 172 B8R1.2 NCC1CCCCO1 V7179 [0,1,0,1,0,0|2,0,0]=4 173 B8R1.2 NCC1CCCNC1 U802 [0,1,0,1,0,0|2,0,0]=4 174 B8R1.2 NC[C@H]1COCCO1 8566AH [0,1,0,1,0,0|2,0,0]=4 175 B8R1.2 OCC1CCNCC1 5626AH [0,1,0,1,0,0|2,0,0]=4 176 B8R1.2 OCC1CCSCC1 Y6767 [0,1,0,1,0,0|2,0,0]=4 177 B8R1.2 OCC1CNCCO1 W3143 [0,1,0,1,0,0|0,0,0]=2 178 B8R1.2 OCC1CNCCO1 X8636 [0,1,0,1,0,0|0,0,0]=2 179 B8R1.2 OCC1COCCN1 1479AA [0,1,0,1,0,0|0,0,0]=2 180 B8R1.2 OCC1COCCN1 6468AC [0,1,0,1,0,0|0,0,0]=2 181 B8R1.2 OC[C@@H]1CNCCO1 X9792 [0,1,0,1,0,0|0,0,0]=2 182 B8R1.2 ONC1CCCCC1 1210AB [0,1,0,1,0,0|2,0,0]=4 183 B8R1.2 [C@@H]1(CC)COCCN1 9533AF [0,1,0,1,0,0|1,0,0]=3 184 B8R1.5 CC1CNCCC1=O W6393 [0,1,0,1,0,0|1,0,1]=4 185 B8R1.5 CC1CNCCN1C 9602AH [0,1,0,1,0,0|2,0,0]=4 186 B8R1.5 CC1COCCC1O 2365AJ [0,1,0,1,0,0|2,0,0]=4 187 B8R1.5 C[C@H]1CNCCN1C 6630AB [0,1,0,1,0,0|2,0,0]=4 188 B8R1.5 C[C@H]1CNCCN1C 9092AH [0,1,0,1,0,0|2,0,0]=4 189 B8R1.5 N[C@@H]1CCCC[C@@H]1O W4237 [0,1,0,1,0,0|2,0,0]=4 190 B8R1.5 N[C@H]1CCCC[C@@H]1O B566 [0,1,0,1,0,0|2,0,0]=4 191 B8R1.5 N[C@H]1CCCC[C@H]1O 0705AC [0,1,0,1,0,0|2,0,0]=4 192 B8R1.5 N[C@H]1CCCC[C@H]1O X3115 [0,1,0,1,0,0|2,0,0]=4 193 B8R1.5 O=C1NCCCC1O W4139 [0,1,0,1,0,0|1,0,1]=4 194 B8R1.5 OC1CCCCC1Cl 7832AA [0,1,0,1,0,0|2,0,0]=4 195 B8R1.5 OC1OCCOC1O V6147 [0,1,0,1,0,0|1,0,0]=3 196 B8R1.8 CNCC1CCCO1 7539AF [0,1,0,1,0,0|2,0,0]=4 197 B8R1.8 COCC1CCCN1 V2776 [0,1,0,1,0,0|1,0,0]=3 198 B8R1.8 COCC1CCCN1 Y4051 [0,1,0,1,0,0|1,0,0]=3 199 B8R1.8 COC[C@H]1CCCN1 8959AH [0,1,0,1,0,0|1,0,0]=3 200 B8R1.11 CN1CCCC1CN X2049 [0,1,0,1,0,0|2,0,0]=4 201 B8R1.22 NC1CCCCNC1 3820AJ [0,1,0,1,0,0|2,0,0]=4 202 B8R1.22 O=C1CCOCCN1 0717AP [0,1,0,1,0,0|1,0,1]=4 203 B8R1.22 O=C1CCOCCO1 4654AL [0,1,0,1,0,0|1,0,1]=4 204 B8R1.1 O=C1CCC(CO)O1 X3393 [0,1,0,1,0,0|1,0,1]=4 205 B8R1.1 O=C1CC[C@@H](CO)O1 N841 [0,1,0,1,0,0|1,0,1]=4 206 B8R1.1 O=C1CC[C@H](CO)O1 B249 [0,1,0,1,0,0|1,0,1]=4 207 B8R1.3 CC1CNC(C)CN1 X7143 [0,1,0,1,0,0|2,0,0]=4 208 B8R1.3 CC1COC(C)CN1 Z6902 [0,1,0,1,0,0|1,0,0]=3 209 B8R1.3 NC1CCC(O)CC1 5488AB [0,1,0,1,0,0|2,0,0]=4 210 B8R1.3 O=C1CCC(O)CN1 W4138 [0,1,0,1,0,0|1,0,1]=4 211 B8R1.3 O[C@H]1CC[C@@H](O)CC1 U023 [0,1,0,1,0,0|2,0,0]=4 212 B8R1.3 O[C@H]1CC[C@H](O)CC1 U202 [0,1,0,1,0,0|2,0,0]=4 213 B8R1.52 CC1(CBr)OCCO1 0485AE [0,1,0,1,0,0|2,0,0]=4 214 B8R1.52 CCC1(C)OCCO1 5612AL [0,1,0,1,0,0|2,0,0]=4 215 B8R1.4 CC1CC(=O)CCO1 3309AA [0,1,0,1,0,0|2,0,0]=4 216 B8R1.4 CC1CC(O)CCO1 1817AJ [0,1,0,1,0,0|2,0,0]=4 217 B8R1.4 CN1CCCC(N)C1 W9236 [0,1,0,1,0,0|2,0,0]=4 218 B8R1.4 CN1CCC[C@@H](N)C1 8666AH [0,1,0,1,0,0|2,0,0]=4 219 B8R1.4 CN1CCC[C@@H](N)C1 8990AH [0,1,0,1,0,0|2,0,0]=4 220 B8R1.4 CN1CCOC(=O)C1 9637AA [0,1,0,1,0,0|0,0,2]=4 221 B8R1.4 C[C@@H]1CN(C)CCN1 8938AH [0,1,0,1,0,0|2,0,0]=4 222 B8R1.4 NC1CCCC(O)C1 2142AJ [0,1,0,1,0,0|2,0,0]=4 223 B8R1.4 NC1CCCC(O)C1 W7861 [0,1,0,1,0,0|2,0,0]=4 224 B8R1.7 O=C(O)C1NCCS1 W7647 [0,1,0,1,0,0|0,1,1]=4 225 B8R1.72 CC1(C)CCCNC1 Y8537 [0,1,0,1,0,0|2,0,0]=4 226 B8R1.72 CC1(C)CNCCO1 7349AA [0,1,0,1,0,0|1,0,0]=3 227 B8R1.72 CC1(O)CCCNC1 4087AE [0,1,0,1,0,0|1,0,0]=3 228 B8R1.72 FC1(F)CCCNC1 4607AB [0,1,0,1,0,0|2,0,0]=4 229 B8R1.72 FC1(F)CCCNC1 W6523 [0,1,0,1,0,0|2,0,0]=4 230 B8R2.34 C1CC2CC1CN2 Z4541 [0,0,0,2,0,0|2,0,0]=4 231 B8R2.34 [C@@H]12CO[C@@H](CN1)C2 8387AH [0,0,0,2,0,0|1,0,0]=3 232 B8R2.34 [C@H]12CN[C@H](CN1)C2 7389AJ [0,0,0,2,0,0|2,0,0]=4 233 B8R2.34 [C@H]12CO[C@H](CN1)C2 8424AH [0,0,0,2,0,0|1,0,0]=3