0 B5R0.3 C#CC(O)CC X7089 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.3 C=C[C@H](N)CO 2392AL [0,0,0,0,0,0|2,0,1]=3 2 B5R0.3 CC(CN)CN 1710AB [0,0,0,0,0,0|3,0,0]=3 3 B5R0.3 CCC(=O)CN X8894 [0,0,0,0,0,0|2,0,2]=4 4 B5R0.3 CCC(=O)CO X5132 [0,0,0,0,0,0|1,0,2]=3 5 B5R0.3 CCC(C)C#N 9871AA [0,0,0,0,0,0|3,0,1]=4 6 B5R0.3 CCC(C)CCl U282 [0,0,0,0,0,0|3,0,0]=3 7 B5R0.3 CCC(C)CS U578 [0,0,0,0,0,0|2,1,0]=3 8 B5R0.3 CCC(C)NN 9798AD [0,0,0,0,0,0|4,0,0]=4 9 B5R0.3 CCC(O)C#N 7246AF [0,0,0,0,0,0|2,0,1]=3 10 B5R0.3 CCC(O)CBr 4766AL [0,0,0,0,0,0|2,0,0]=2 11 B5R0.3 CCC(S)CS 4441AL [0,0,0,0,0,0|1,2,0]=3 12 B5R0.3 CN[C@@H](C)CO X7940 [0,0,0,0,0,0|3,0,0]=3 13 B5R0.3 FCC(Br)CBr 3889AE [0,0,0,0,0,0|3,0,0]=3 14 B5R0.3 NCC(Br)CBr 5327AJ [0,0,0,0,0,0|3,0,0]=3 15 B5R0.3 N\C(CCl)=N/O 0296AE [0,0,0,0,0,0|3,0,1]=4 16 B5R0.3 N\C(CO)=N\O 9010AE [0,0,0,0,0,0|2,0,1]=3 17 B5R0.3 O=C[C@@H](O)CO I485 [0,0,0,0,0,0|0,0,2]=2 18 B5R0.3 O=C[C@H](O)CO I433 [0,0,0,0,0,0|0,0,2]=2 19 B5R0.3 OC(CCl)CBr 7042AF [0,0,0,0,0,0|2,0,0]=2 20 B5R0.3 OC[C@@H](O)CF 1216AL [0,0,0,0,0,0|1,0,0]=1 21 B4R0.1 C#CC(C)N 3873AJ [1,0,0,0,0,0|2,0,1]=4 22 B4R0.1 C#C[C@@H](C)O 4141AL [1,0,0,0,0,0|1,0,1]=3 23 B4R0.1 C#C[C@H](C)N 9107AH [1,0,0,0,0,0|2,0,1]=4 24 B4R0.1 C#C[C@H](C)O 4183AL [1,0,0,0,0,0|1,0,1]=3 25 B4R0.1 CC(O)CF 7060AF [1,0,0,0,0,0|1,0,0]=2 26 B4R0.1 CSC(C)C 8107AL [1,0,0,0,0,0|3,0,0]=4 27 B4R0.1 C[C@@H](O)CN V4887 [1,0,0,0,0,0|1,0,0]=2 28 B4R0.1 C[C@H](O)CCl E885 [1,0,0,0,0,0|1,0,0]=2 29 B4R0.1 C\C(N)=N/O 5291AE [1,0,0,0,0,0|2,0,1]=4 30 B4R0.1 FC(Cl)CCl 3256AE [1,0,0,0,0,0|3,0,0]=4 31 B4R0.1 N=C(N)CO 6468AB [1,0,0,0,0,0|2,0,1]=4 32 B4R0.1 N=C(N)CO X6638 [1,0,0,0,0,0|2,0,1]=4 33 B4R0.1 NCC(=O)O 7986AL [1,0,0,0,0,0|1,0,2]=4 34 B4R0.2 C#CCCI 6186AJ [1,0,0,0,0,0|2,0,1]=4 35 B4R0.2 C=C=CCO 0432AQ [1,0,0,0,0,0|1,0,2]=4 36 B4R0.2 CCCCF 8004AD [1,0,0,0,0,0|2,0,0]=3 37 B4R0.2 CCCCN 7306AL [1,0,0,0,0,0|2,0,0]=3 38 B4R0.2 CCCNN 4415AE [1,0,0,0,0,0|3,0,0]=4 39 B4R0.2 CCCOC 4896AL [1,0,0,0,0,0|3,0,0]=4 40 B4R0.2 CCCSC U677 [1,0,0,0,0,0|3,0,0]=4 41 B4R0.2 CCNCC 7650AL [1,0,0,0,0,0|3,0,0]=4 42 B4R0.2 CSCCCl 7809AB [1,0,0,0,0,0|3,0,0]=4 43 B4R0.2 N#CCCS 0102AP [1,0,0,0,0,0|1,1,1]=4 44 B4R0.2 NCCON 7871AA [1,0,0,0,0,0|3,0,0]=4 45 B4R0.2 NCCON W5869 [1,0,0,0,0,0|3,0,0]=4 46 B6R0.1 C#CC(O)CCC X7102 [0,1,0,0,0,0|2,0,1]=4 47 B6R0.1 C#CCC(O)CC 6781AL [0,1,0,0,0,0|2,0,0]=3 48 B6R0.1 CCC(O)CNN 2943AE [0,1,0,0,0,0|2,0,0]=3 49 B6R0.1 CCCC(Br)CC 3975AB [0,1,0,0,0,0|3,0,0]=4 50 B6R0.1 CCCC(C)CC 7810AF [0,1,0,0,0,0|3,0,0]=4 51 B6R0.1 CCCC(C)CO 1207AA [0,1,0,0,0,0|2,0,0]=3 52 B6R0.1 CCCC(O)CC 7557AF [0,1,0,0,0,0|2,0,0]=3 53 B6R0.1 CCNC(C)CC 7145AD [0,1,0,0,0,0|3,0,0]=4 54 B6R0.1 CCOC(C)CN 0082AD [0,1,0,0,0,0|3,0,0]=4 55 B6R0.1 CCOC(C)CN Y4465 [0,1,0,0,0,0|3,0,0]=4 56 B6R0.1 CC[C@@H](N)COC 8948AH [0,1,0,0,0,0|2,0,0]=3 57 B6R0.1 CC[C@H](C)CCO 4202AL [0,1,0,0,0,0|2,0,0]=3 58 B6R0.1 CC[C@H](N)COC 9106AH [0,1,0,0,0,0|2,0,0]=3 59 B6R0.1 C[C@H](CO)CCO 1249AL [0,1,0,0,0,0|1,0,0]=2 60 B6R0.1 N#CCC(O)CCl R248 [0,1,0,0,0,0|2,0,0]=3 61 B6R0.1 OC(CCl)CCCl 4625AL [0,1,0,0,0,0|2,0,0]=3 62 B6R0.1 O[C@H](CBr)CCBr 9809AB [0,1,0,0,0,0|2,0,0]=3 63 B6R0.3 C#CC(O)C(=O)O 5648AL [0,1,0,0,0,0|1,0,2]=4 64 B6R0.3 CC(=O)C(N)CO 6844AC [0,1,0,0,0,0|1,0,2]=4 65 B6R0.3 CC(C)C(O)C#N 4772AD [0,1,0,0,0,0|2,0,1]=4 66 B6R0.3 CC(C)[C@H](N)CO 8725AA [0,1,0,0,0,0|2,0,0]=3 67 B6R0.3 CC(CO)C(=O)O Z7389 [0,1,0,0,0,0|1,0,1]=3 68 B6R0.3 CCC(C)C(C)C 5239AL [0,1,0,0,0,0|3,0,0]=4 69 B6R0.3 CCC(O)C(=O)[O-] 8154AL [0,1,0,0,0,0|1,0,2]=4 70 B6R0.3 CC[C@@H](Cl)C(=O)O 4152AL [0,1,0,0,0,0|2,0,1]=4 71 B6R0.3 CC[C@H](Cl)C(=O)O Z6043 [0,1,0,0,0,0|2,0,1]=4 72 B6R0.3 COC(C)C(C)O V6491 [0,1,0,0,0,0|3,0,0]=4 73 B6R0.3 C[C@@H](CN)C(=O)O 5650AC [0,1,0,0,0,0|2,0,1]=4 74 B6R0.3 C[C@@H](CN)C(=O)O 5862AB [0,1,0,0,0,0|2,0,1]=4 75 B6R0.3 C[C@H](O)[C@H](N)CO Z5595 [0,1,0,0,0,0|1,0,0]=2 76 B6R0.3 NC(=O)C(N)CO 2131AB [0,1,0,0,0,0|1,0,2]=4 77 B6R0.3 NCC(N)C(=O)O 3293AL [0,1,0,0,0,0|2,0,1]=4 78 B6R0.3 NC[C@H](N)C(=O)O 0179AB [0,1,0,0,0,0|2,0,1]=4 79 B6R0.3 N[C@H](CCl)C(=O)O 5119AB [0,1,0,0,0,0|2,0,1]=4 80 B6R0.3 O=C(O)C(Cl)CO 0455AQ [0,1,0,0,0,0|1,0,1]=3 81 B6R0.3 O=C(O)C(O)CCl 2399AL [0,1,0,0,0,0|1,0,1]=3 82 B6R0.3 O=C([O-])C(O)CO 7310AL [0,1,0,0,0,0|0,0,2]=3 83 B6R0.8 CC(C)(CCl)CCl 3020AB [0,1,0,0,0,0|3,0,0]=4 84 B6R0.8 CC(C)(CN)CO W4996 [0,1,0,0,0,0|2,0,0]=3 85 B6R0.8 CCC(C)(C)CO Y7195 [0,1,0,0,0,0|2,0,0]=3 86 B6R0.8 CCC(C)(N)CC 1117AE [0,1,0,0,0,0|3,0,0]=4 87 B6R0.8 CCC(C)(O)C#N 5636AB [0,1,0,0,0,0|2,0,1]=4 88 B6R0.9 CCC(CC)CBr 2060AE [0,1,0,0,0,0|3,0,0]=4 89 B6R0.9 CCC(CC)NC 7289AJ [0,1,0,0,0,0|3,0,0]=4 90 B6R0.9 CCC(CN)OC X2088 [0,1,0,0,0,0|2,0,0]=3 91 B6R0.9 CCC(CO)OC 5682AL [0,1,0,0,0,0|1,0,0]=2 92 B6R0.9 CCC(OC)OC 8873AL [0,1,0,0,0,0|3,0,0]=4 93 B6R1.2 CC1CCNC1 X9461 [0,0,0,1,0,0|3,0,0]=4 94 B6R1.2 CC1CCOC1 6124AL [0,0,0,1,0,0|2,0,0]=3 95 B6R1.2 CC1COCO1 6593AL [0,0,0,1,0,0|3,0,0]=4 96 B6R1.2 C[C@@H]1CCNC1 1585AB [0,0,0,1,0,0|3,0,0]=4 97 B6R1.2 C[C@H]1CCNC1 W4034 [0,0,0,1,0,0|3,0,0]=4 98 B6R1.2 FC1CCCC1 7941AL [0,0,0,1,0,0|3,0,0]=4 99 B6R1.2 FC1CCNC1 X9172 [0,0,0,1,0,0|3,0,0]=4 100 B6R1.2 F[C@H]1CCNC1 9169AH [0,0,0,1,0,0|3,0,0]=4 101 B6R1.2 NC1CC=CC1 W9476 [0,0,0,1,0,0|3,0,0]=4 102 B6R1.2 NC1CCOC1 W9158 [0,0,0,1,0,0|2,0,0]=3 103 B6R1.2 N[C@H]1CCNC1 N118 [0,0,0,1,0,0|3,0,0]=4 104 B6R1.2 O[C@@H]1CCSC1 1245AL [0,0,0,1,0,0|1,1,0]=3 105 B6R1.2 O[C@H]1CCSC1 Y1948 [0,0,0,1,0,0|1,1,0]=3 106 B6R1.6 BrCC1CCO1 6025AC [0,0,0,1,0,0|2,0,0]=3 107 B6R1.6 ICC1CCO1 1038AD [0,0,0,1,0,0|2,0,0]=3 108 B6R1.6 NCC1CCN1 0858AA [0,0,0,1,0,0|3,0,0]=4 109 B6R1.6 NCC1CCN1 6521AH [0,0,0,1,0,0|3,0,0]=4 110 B6R1.6 NCC1CCO1 V8594 [0,0,0,1,0,0|2,0,0]=3 111 B6R1.6 NCC1CNC1 2747AA [0,0,0,1,0,0|3,0,0]=4 112 B6R1.6 NCC1COC1 4443AJ [0,0,0,1,0,0|2,0,0]=3 113 B6R1.6 NCC1COC1 W7450 [0,0,0,1,0,0|2,0,0]=3 114 B6R1.6 O=CC1COC1 5573AA [0,0,0,1,0,0|1,0,2]=4 115 B6R1.6 OCC1CCN1 Z3841 [0,0,0,1,0,0|2,0,0]=3 116 B6R1.7 C[C@]1(CO)CO1 1288AL [0,0,0,1,0,0|1,0,0]=2 117 B6R1.7 NC1(CO)CC1 V2301 [0,0,0,1,0,0|2,0,0]=3 118 B6R1.7 NCC1(O)CC1 W8222 [0,0,0,1,0,0|2,0,0]=3 119 B3R0.1 CCCF 3973AE [2,0,0,0,0,0|1,0,0]=3 120 B3R0.1 CCCN 8883AL [2,0,0,0,0,0|1,0,0]=3 121 B3R0.1 NCCN 4103AL [2,0,0,0,0,0|2,0,0]=4 122 B3R0.1 NCCN 6791AA [2,0,0,0,0,0|2,0,0]=4 123 B3R0.1 NCCN 6876AF [2,0,0,0,0,0|2,0,0]=4 124 B3R0.1 NCCN 7518AA [2,0,0,0,0,0|2,0,0]=4 125 B3R0.1 NCCN 9393AJ [2,0,0,0,0,0|2,0,0]=4 126 B3R0.1 NCCN E395 [2,0,0,0,0,0|2,0,0]=4 127 B3R0.2 C=[N+](C)C X4459 [2,0,0,0,0,0|2,0,0]=4 128 B3R0.2 CC(Br)Br 4360AL [2,0,0,0,0,0|2,0,0]=4 129 B3R0.2 C[PH](C)=O 3279AL [2,0,0,0,0,0|1,0,1]=4 130 B3R0.2 C[S+](C)C 9165AJ [2,0,0,0,0,0|2,0,0]=4 131 B3R0.2 O=S(O)O 8693AF [2,0,0,0,0,0|1,0,1]=4 132 B5R0.1 C#CCC(C)O 6664AL [1,1,0,0,0,0|1,0,0]=3 133 B5R0.1 C=C(C)CON 4430AJ [1,1,0,0,0,0|1,0,1]=4 134 B5R0.1 CC(Br)CC#N 6005AL [1,1,0,0,0,0|2,0,0]=4 135 B5R0.1 CC(C)CCCl 7326AF [1,1,0,0,0,0|2,0,0]=4 136 B5R0.1 CC(C)CON 7310AJ [1,1,0,0,0,0|1,0,0]=3 137 B5R0.1 CC(C)C[Mg]Br 8722AJ [1,1,0,0,0,0|2,0,0]=4 138 B5R0.1 CC(O)CON 3604AB [1,1,0,0,0,0|0,0,0]=2 139 B5R0.1 CCOC(C)C 7879AL [1,1,0,0,0,0|2,0,0]=4 140 B5R0.1 CCSC(C)C 7880AL [1,1,0,0,0,0|2,0,0]=4 141 B5R0.1 CNCC(C)C 8603AL [1,1,0,0,0,0|2,0,0]=4 142 B5R0.1 CNCC(C)O 5343AD [1,1,0,0,0,0|1,0,0]=3 143 B5R0.1 COCC(C)N 0442AC [1,1,0,0,0,0|1,0,0]=3 144 B5R0.1 COC[C@H](C)O W4988 [1,1,0,0,0,0|0,0,0]=2 145 B5R0.1 C[C@@H](O)CC#N 1173AL [1,1,0,0,0,0|1,0,0]=3 146 B5R0.1 C[C@H](N)CCO 3502AC [1,1,0,0,0,0|1,0,0]=3 147 B5R0.1 C\C(Cl)=C\CO X6578 [1,1,0,0,0,0|1,0,1]=4 148 B5R0.1 NOCC(=O)O 2959AB [1,1,0,0,0,0|0,0,2]=4 149 B5R0.4 CCC(C)(Cl)Cl 5119AL [1,1,0,0,0,0|2,0,0]=4 150 B5R0.5 CC(Cl)C(Cl)Cl 7030AF [1,1,0,0,0,0|2,0,0]=4 151 B5R0.5 CC(N)C(C)O 7117AF [1,1,0,0,0,0|1,0,0]=3 152 B5R0.5 CC(O)C(=N)N 2094AL [1,1,0,0,0,0|1,0,1]=4 153 B5R0.5 CC(S)C(C)S 9352AJ [1,1,0,0,0,0|0,2,0]=4 154 B5R0.5 C[C@@H](O)C(=N)N X6061 [1,1,0,0,0,0|1,0,1]=4 155 B5R0.2 C#CCCCBr 9466AL [1,1,0,0,0,0|2,0,0]=4 156 B5R0.2 C=CCCCN 7616AH [1,1,0,0,0,0|2,0,0]=4 157 B5R0.2 C=CCCON 2267AA [1,1,0,0,0,0|1,0,1]=4 158 B5R0.2 CC#CCCO 6150AL [1,1,0,0,0,0|1,0,1]=4 159 B5R0.2 CCCCOC 7303AL [1,1,0,0,0,0|1,0,0]=3 160 B5R0.2 CCCNCC 8554AL [1,1,0,0,0,0|2,0,0]=4 161 B5R0.2 CCCOCC 7892AL [1,1,0,0,0,0|2,0,0]=4 162 B5R0.2 CCCOCCl 4494AB [1,1,0,0,0,0|2,0,0]=4 163 B5R0.2 CCCSCC R576 [1,1,0,0,0,0|2,0,0]=4 164 B5R0.2 CCOCCCl 7903AJ [1,1,0,0,0,0|2,0,0]=4 165 B5R0.2 CCOCCN 3903AD [1,1,0,0,0,0|2,0,0]=4 166 B5R0.2 COCCCI 9890AH [1,1,0,0,0,0|1,0,0]=3 167 B5R0.2 COCCON Y9404 [1,1,0,0,0,0|2,0,0]=4 168 B5R0.2 ClCCOCCl 7247AA [1,1,0,0,0,0|2,0,0]=4 169 B5R0.2 OCC#CCCl 0022AQ [1,1,0,0,0,0|1,0,1]=4 170 B5R0.2 [C-]#[N+]CCOC V5938 [1,1,0,0,0,0|2,0,0]=4 171 B7R0.2 CCC(N)CC(=O)O W4035 [0,2,0,0,0,0|2,0,0]=4 172 B7R0.2 CN(C)CC(O)CCl 4719AE [0,2,0,0,0,0|2,0,0]=4 173 B7R0.2 CN(C)CC(O)CN V6256 [0,2,0,0,0,0|2,0,0]=4 174 B7R0.2 NCC(N)CC(=O)O 5843AA [0,2,0,0,0,0|2,0,0]=4 175 B7R0.2 NC[C@H](O)CC(=O)O Z5048 [0,2,0,0,0,0|1,0,0]=3 176 B7R0.3 C#CCOC(C)CO X0064 [0,2,0,0,0,0|2,0,0]=4 177 B7R0.3 CC#CCC(O)CC 6775AL [0,2,0,0,0,0|2,0,0]=4 178 B7R0.3 CCCCC(O)CC 8762AB [0,2,0,0,0,0|2,0,0]=4 179 B7R0.3 CCOCC(N)CC 8270AE [0,2,0,0,0,0|2,0,0]=4 180 B7R0.5 CC(C)C(N)CCO 5799AJ [0,2,0,0,0,0|2,0,0]=4 181 B7R0.5 CCCC(O)C(C)C 5711AL [0,2,0,0,0,0|2,0,0]=4 182 B7R0.5 COCC(Cl)C(=O)O 2065AB [0,2,0,0,0,0|1,0,1]=4 183 B7R0.5 COCC(N)C(C)C 9904AH [0,2,0,0,0,0|2,0,0]=4 184 B7R0.7 CCCC(C)CCO 6091AL [0,2,0,0,0,0|2,0,0]=4 185 B7R0.7 CCNC(C)CCO 9482AE [0,2,0,0,0,0|2,0,0]=4 186 B7R0.7 O=C(CCO)CCO 5879AB [0,2,0,0,0,0|0,0,2]=4 187 B7R0.10 CCC(=O)C(O)CC 8871AL [0,2,0,0,0,0|2,0,0]=4 188 B7R0.10 CC[C@@H](O)C(=O)OC 9868AL [0,2,0,0,0,0|1,0,1]=4 189 B7R0.10 CC[C@H](O)C(=O)OC 9869AL [0,2,0,0,0,0|1,0,1]=4 190 B7R0.10 COC(=O)C(F)CO 0323AC [0,2,0,0,0,0|1,0,1]=4 191 B7R0.10 COC(=O)C(O)CO 0209AP [0,2,0,0,0,0|0,0,1]=3 192 B7R0.10 COC(=O)[C@@H](C)CO X3276 [0,2,0,0,0,0|1,0,1]=4 193 B7R0.10 O=C[C@@H](O)[C@@H](O)CO 7579AB [0,2,0,0,0,0|0,0,0]=2 194 B7R0.10 OC(CCl)C(O)CCl 7787AL [0,2,0,0,0,0|1,0,0]=3 195 B7R0.10 OC[C@H](O)[C@@H](O)CO 8162AL [0,2,0,0,0,0|0,0,0]=2 196 B7R0.10 O[C@@H](CS)[C@@H](O)CS 7309AH [0,2,0,0,0,0|0,1,0]=3 197 B7R0.10 O[C@H](CS)[C@@H](O)CS 3591AH [0,2,0,0,0,0|0,1,0]=3 198 B7R0.11 C=CCC(C)(C)CO 4084AB [0,2,0,0,0,0|2,0,0]=4 199 B7R0.11 CNCC(C)(C)CO 8093AA [0,2,0,0,0,0|2,0,0]=4 200 B7R0.11 COCC(C)(C)CN 9457AE [0,2,0,0,0,0|2,0,0]=4 201 B7R0.11 COCC(C)(C)CO Y5474 [0,2,0,0,0,0|1,0,0]=3 202 B7R0.12 CCN[C@@H](CC)CO 2889AC [0,2,0,0,0,0|2,0,0]=4 203 B7R0.14 CC(C)(C)C(O)CN 1562AL [0,2,0,0,0,0|2,0,0]=4 204 B7R0.14 CC(CO)C(F)(F)F 5962AB [0,2,0,0,0,0|2,0,0]=4 205 B7R0.14 NCC(O)C(F)(F)F 5967AB [0,2,0,0,0,0|2,0,0]=4 206 B7R0.15 CCC(CO)N(C)C 5536AD [0,2,0,0,0,0|2,0,0]=4 207 B7R0.15 CCC(OC)C(=O)O 8292AB [0,2,0,0,0,0|1,0,1]=4 208 B7R0.15 CN[C@H](CO)C(=O)O 0556AP [0,2,0,0,0,0|1,0,1]=4 209 B7R0.18 C#CC(O)(CC)CC 8060AJ [0,2,0,0,0,0|2,0,0]=4 210 B5R1.2 IC1CNC1 2304AJ [1,0,0,1,0,0|2,0,0]=4 211 B5R1.4 N[C@@H]1C[C@H]1N 3501AB [1,0,0,1,0,0|2,0,0]=4 212 B5R1.5 CC1(C)CS1 8089AL [1,0,0,1,0,0|1,1,0]=4 213 B5R1.1 C1CNNC1 Z5309 [1,0,0,1,0,0|2,0,0]=4 214 B7R1.1 BrCC1CCOC1 8390AA [0,1,0,1,0,0|2,0,0]=4 215 B7R1.1 CN[C@@H]1CCOC1 2045AJ [0,1,0,1,0,0|2,0,0]=4 216 B7R1.1 CN[C@@H]1CCOC1 9048AH [0,1,0,1,0,0|2,0,0]=4 217 B7R1.1 CN[C@H]1CCOC1 2048AJ [0,1,0,1,0,0|2,0,0]=4 218 B7R1.1 COC1CCNC1 Z4122 [0,1,0,1,0,0|2,0,0]=4 219 B7R1.1 ClCC1CCOC1 2028AJ [0,1,0,1,0,0|2,0,0]=4 220 B7R1.1 NCC1OCCO1 6055AB [0,1,0,1,0,0|2,0,0]=4 221 B7R1.1 NC[C@@H]1CCCO1 Z5557 [0,1,0,1,0,0|2,0,0]=4 222 B7R1.1 NNC1CCOC1 4448AJ [0,1,0,1,0,0|2,0,0]=4 223 B7R1.1 NNC1CCOC1 9248AH [0,1,0,1,0,0|2,0,0]=4 224 B7R1.1 OCC1CCNC1 W6601 [0,1,0,1,0,0|2,0,0]=4 225 B7R1.1 OCC1CCNC1 W7609 [0,1,0,1,0,0|2,0,0]=4 226 B7R1.1 OC[C@@H]1CCNC1 4311AA [0,1,0,1,0,0|2,0,0]=4 227 B7R1.1 OC[C@@H]1CCOC1 3014AD [0,1,0,1,0,0|1,0,0]=3 228 B7R1.1 OC[C@H]1CCOC1 3025AD [0,1,0,1,0,0|1,0,0]=3 229 B7R1.2 N[C@H]1CC[C@@H](O)C1 2029AA [0,1,0,1,0,0|2,0,0]=4 230 B7R1.2 O[C@@H]1C=C[C@H](O)C1 3216AL [0,1,0,1,0,0|1,0,1]=4 231 B7R1.3 BrC1CCCOC1 X9769 [0,1,0,1,0,0|2,0,0]=4 232 B7R1.3 CC1CCOCO1 8171AJ [0,1,0,1,0,0|2,0,0]=4 233 B7R1.3 IC1CCOCC1 W4893 [0,1,0,1,0,0|2,0,0]=4 234 B7R1.3 NC1CCCOC1 X9447 [0,1,0,1,0,0|2,0,0]=4 235 B7R1.4 C[C@@H]1CCC[C@@H]1O 3213AL [0,1,0,1,0,0|2,0,0]=4 236 B7R1.4 ClC1CCOC1Cl 5221AL [0,1,0,1,0,0|2,0,0]=4 237 B7R1.4 NC1COCC1O 5780AA [0,1,0,1,0,0|1,0,0]=3 238 B7R1.4 NC1CSCC1O 0027AD [0,1,0,1,0,0|1,1,0]=4 239 B7R1.4 N[C@@H]1COC[C@H]1O 8700AH [0,1,0,1,0,0|1,0,0]=3 240 B7R1.4 N[C@H]1COC[C@@H]1O 4688AJ [0,1,0,1,0,0|1,0,0]=3 241 B7R1.4 N[C@H]1COC[C@@H]1O 8683AH [0,1,0,1,0,0|1,0,0]=3 242 B7R1.4 O=C1OCC[C@H]1O 8329AB [0,1,0,1,0,0|0,0,2]=4 243 B7R1.4 O[C@H]1CCC[C@H]1O 0705AP [0,1,0,1,0,0|1,0,0]=3 244 B7R1.4 O[C@H]1CNC[C@@H]1O Z4539 [0,1,0,1,0,0|1,0,0]=3 245 B7R1.6 OCCC1COC1 1983AB [0,1,0,1,0,0|1,0,0]=3 246 B7R1.10 NCC1CC(O)C1 3176AF [0,1,0,1,0,0|2,0,0]=4 247 B7R1.22 NC(CO)C1CC1 HTS033190 [0,1,0,1,0,0|2,0,0]=4 248 B7R1.25 CC1(CCl)COC1 2252AL [0,1,0,1,0,0|2,0,0]=4 249 B7R1.25 CC1(CO)CSC1 5905AE [0,1,0,1,0,0|1,1,0]=4 250 B7R1.25 FC1(CBr)COC1 1016AF [0,1,0,1,0,0|2,0,0]=4 251 B7R1.25 NC1(CO)CCC1 9457AA [0,1,0,1,0,0|2,0,0]=4 252 B7R1.25 NCC1(O)CCC1 HTS033072 [0,1,0,1,0,0|2,0,0]=4 253 B7R1.18 O=C(O)C1CCO1 3540AC [0,1,0,1,0,0|1,0,1]=4 254 B7R1.18 O=C(O)C1COC1 X3417 [0,1,0,1,0,0|1,0,1]=4 255 B7R1.23 OCC1CC1(Cl)Cl Y9378 [0,1,0,1,0,0|2,0,0]=4 256 B7R1.23 OCC1CC1(F)F X8433 [0,1,0,1,0,0|2,0,0]=4