0 B10R1.1 CC1=CC=C(CCBr)C=C1 W7663 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.1 CC1=CC=C(CCN)C=C1 1184AJ [0,0,0,0,0,0|1,0,0]=1 2 B10R1.1 CC1=CC=C(NC=O)C=C1 6608AL [0,0,0,0,0,0|3,0,1]=4 3 B10R1.1 CCCC1=CC=C(Cl)C=C1 5012AE [0,0,0,0,0,0|2,0,0]=2 4 B10R1.1 CCCC1=CN=C(Cl)N=C1 7472AD [0,0,0,0,0,0|4,0,0]=4 5 B10R1.1 CCOC1=CN=C(Br)C=C1 V5913 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.1 CCOC1=NC=C(F)C=C1 3377AC [0,0,0,0,0,0|4,0,0]=4 7 B10R1.1 CCSC1=CC=C(Br)C=C1 9641AD [0,0,0,0,0,0|3,0,0]=3 8 B10R1.1 CNCC1=CC=C(Br)C=C1 7292AJ [0,0,0,0,0,0|3,0,0]=3 9 B10R1.1 CNCC1=CC=C(C)C=C1 7294AJ [0,0,0,0,0,0|3,0,0]=3 10 B10R1.1 CNCC1=CC=C(C)C=C1 W7964 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.1 CNCC1=CC=C(Cl)C=C1 7293AJ [0,0,0,0,0,0|3,0,0]=3 12 B10R1.1 COCC1=CC=C(Br)C=C1 Z0209 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.1 COCC1=CC=C(N)C=C1 V7837 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.1 CSCC1=CN=C(Cl)C=C1 7608AC [0,0,0,0,0,0|4,0,0]=4 15 B10R1.1 N#CCC1=CC=C(Cl)C=N1 9688AA [0,0,0,0,0,0|2,0,2]=4 16 B10R1.1 N#CCC1=CC=C(I)C=C1 X2663 [0,0,0,0,0,0|1,0,2]=3 17 B10R1.1 N#CCC1=CC=C(N)C=C1 4180AB [0,0,0,0,0,0|1,0,2]=3 18 B10R1.1 N#CCC1=NC=C(Br)C=C1 W5332 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.1 N#CCC1=NC=C(N)C=C1 V8617 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.1 NCCC1=CC=C(Br)C=C1 0590AB [0,0,0,0,0,0|1,0,0]=1 21 B10R1.1 NNCC1=CC=C(Br)C=C1 3948AE [0,0,0,0,0,0|2,0,0]=2 22 B10R1.1 NNCC1=CC=C(F)C=C1 Z3849 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.1 NOCC1=CC=C(F)C=C1 9348AA [0,0,0,0,0,0|2,0,0]=2 24 B10R1.1 O=CCC1=CC=C(Br)C=C1 W5028 [0,0,0,0,0,0|2,0,1]=3 25 B10R1.1 O=CCC1=CC=C(Cl)C=C1 W6225 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.1 O=CCC1=CC=C(F)C=C1 8959AA [0,0,0,0,0,0|2,0,1]=3 27 B10R1.1 O=CNC1=CC=C(Cl)C=C1 3649AL [0,0,0,0,0,0|3,0,1]=4 28 B10R1.1 O=CNC1=CC=C(F)C=C1 8342AL [0,0,0,0,0,0|3,0,1]=4 29 B10R1.1 OC1=CC=C(CCBr)C=C1 6870AA [0,0,0,0,0,0|1,0,0]=1 30 B10R1.1 OCCC1=CC=C(Cl)N=C1 1226AJ [0,0,0,0,0,0|3,0,0]=3 31 B10R1.1 OCCC1=CC=C(I)C=C1 W6745 [0,0,0,0,0,0|2,0,0]=2 32 B10R1.1 OCCC1=NC=C(Br)C=C1 3590AA [0,0,0,0,0,0|3,0,0]=3 33 B9R1.1 C#CC1=CC=C(O)N=C1 3388AA [1,0,0,0,0,0|1,0,2]=4 34 B9R1.1 CC1=CC=C(CS)C=C1 7913AF [1,0,0,0,0,0|2,0,0]=3 35 B9R1.1 CC1=CN=C(CCl)C=C1 Y5002 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.1 CC1=CN=C(CO)C=C1 1457AB [1,0,0,0,0,0|3,0,0]=4 37 B9R1.1 CC1=NC=C(CCl)C=C1 Z3855 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.1 CC1=NC=C(NN)C=C1 W9248 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.1 CCC1=CC=C(Br)N=C1 0198AB [1,0,0,0,0,0|2,0,0]=3 40 B9R1.1 CCC1=CC=C(Cl)C=C1 6872AE [1,0,0,0,0,0|1,0,0]=2 41 B9R1.1 CCC1=CC=C(F)C=C1 W6384 [1,0,0,0,0,0|1,0,0]=2 42 B9R1.1 CCC1=CN=C(N)C=C1 Y5080 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.1 CCC1=NC=C(Br)C=C1 W5934 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.1 CNC1=CC=C(Br)C=C1 Z5039 [1,0,0,0,0,0|2,0,0]=3 45 B9R1.1 CNC1=CC=C(O)C=C1 V3446 [1,0,0,0,0,0|1,0,0]=2 46 B9R1.1 CNC1=CN=C(Cl)C=C1 3620AA [1,0,0,0,0,0|3,0,0]=4 47 B9R1.1 CNC1=NC=C(Br)C=C1 W8725 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.1 CNC1=NC=C(F)C=C1 Z2980 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.1 COC1=CC=[N+]([O-])C=C1 5637AH [1,0,0,0,0,0|2,0,1]=4 50 B9R1.1 COC1=CN=C(F)C=C1 Z0149 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.1 COC1=CN=C(I)C=C1 V3638 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.1 COC1=CN=C(N)C=C1 X3522 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.1 COC1=NC=C(F)C=C1 C523 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.1 COC1=NC=C(O)C=N1 5238AC [1,0,0,0,0,0|3,0,0]=4 55 B9R1.1 CSC1=CC=C(C)C=C1 I356 [1,0,0,0,0,0|2,0,0]=3 56 B9R1.1 CSC1=CN=C(N)C=C1 2168AC [1,0,0,0,0,0|3,0,0]=4 57 B9R1.1 ClC1=NC=C(CBr)C=C1 X4352 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.1 ClCC1=NC=C(Br)C=C1 8626AA [1,0,0,0,0,0|3,0,0]=4 59 B9R1.1 FC1=NC=C(CBr)C=C1 Y6935 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.1 N#CC1=CC=C(S)C=C1 V7013 [1,0,0,0,0,0|0,1,2]=4 61 B9R1.1 N#CC1=NC=C(O)C=C1 Y5593 [1,0,0,0,0,0|1,0,2]=4 62 B9R1.1 NCC1=CC=C(Br)N=C1 X9441 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.1 NCC1=CC=C(N)C=N1 2034AC [1,0,0,0,0,0|2,0,0]=3 64 B9R1.1 NCC1=CC=C(O)C=C1 X6145 [1,0,0,0,0,0|0,0,0]=1 65 B9R1.1 NCC1=CN=C(Cl)C=C1 8881AH [1,0,0,0,0,0|2,0,0]=3 66 B9R1.1 NCC1=CN=C(F)C=C1 0174AP [1,0,0,0,0,0|2,0,0]=3 67 B9R1.1 NCC1=NC=C(Cl)C=C1 Y9067 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.1 NNC1=CC=C(Br)C=C1 V2246 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.1 NNC1=CC=C(Cl)C=C1 2700AL [1,0,0,0,0,0|2,0,0]=3 70 B9R1.1 NNC1=CC=C(Cl)C=C1 6459AL [1,0,0,0,0,0|2,0,0]=3 71 B9R1.1 NNC1=CC=C(I)C=C1 0740AP [1,0,0,0,0,0|2,0,0]=3 72 B9R1.1 NNC1=CC=C(I)C=C1 H231 [1,0,0,0,0,0|2,0,0]=3 73 B9R1.1 O=CC1=CC=C([O-])C=C1 6126AE [1,0,0,0,0,0|1,0,2]=4 74 B9R1.1 O=CC1=NC=C(O)C=C1 Y8673 [1,0,0,0,0,0|2,0,1]=4 75 B9R1.1 OCC1=NC=C(Cl)C=C1 Y8215 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.1 OCC1=NC=C(F)C=C1 W8534 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.1 [O-][N+]1=CC=C(CO)C=C1 1337AQ [1,0,0,0,0,0|2,0,1]=4 78 B9R1.8 BrCCC1=NC=CC=C1 W8132 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.8 BrCC[N+]1=CC=CC=C1 V0516 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.8 C=COC1=CC=CC=C1 1277AQ [1,0,0,0,0,0|2,0,1]=4 81 B9R1.8 CC#CC1=CC=CC=C1 4952AL [1,0,0,0,0,0|1,0,2]=4 82 B9R1.8 CCCC1=NC=CC=C1 C946 [1,0,0,0,0,0|2,0,0]=3 83 B9R1.8 CCCC1=NC=CN=C1 6087AD [1,0,0,0,0,0|3,0,0]=4 84 B9R1.8 CCNC1=CC=CC=N1 5047AL [1,0,0,0,0,0|3,0,0]=4 85 B9R1.8 CNCC1=CN=CC=C1 7435AH [1,0,0,0,0,0|3,0,0]=4 86 B9R1.8 COCC1=CC=CN=C1 5231AH [1,0,0,0,0,0|3,0,0]=4 87 B9R1.8 COCC1=CC=NC=C1 5493AH [1,0,0,0,0,0|3,0,0]=4 88 B9R1.8 COCC1=NC=CC=C1 V2195 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.8 CSCC1=CC=CC=C1 7914AF [1,0,0,0,0,0|2,0,0]=3 90 B9R1.8 C\C=C/C1=CC=CC=C1 7457AL [1,0,0,0,0,0|1,0,2]=4 91 B9R1.8 C\N=C\C1=CC=CC=C1 R179 [1,0,0,0,0,0|2,0,1]=4 92 B9R1.8 ClCCC1=NC=CC=C1 W3687 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.8 ICCC1=CC=CC=C1 4037AL [1,0,0,0,0,0|1,0,0]=2 94 B9R1.8 N#COC1=CC=CC=C1 3790AL [1,0,0,0,0,0|1,0,2]=4 95 B9R1.8 NCCC1=CC=CC=C1 5784AL [1,0,0,0,0,0|0,0,0]=1 96 B9R1.8 NCCC1=CC=CN=C1 9756AD [1,0,0,0,0,0|1,0,0]=2 97 B9R1.8 NCCC1=CC=CN=C1 W8702 [1,0,0,0,0,0|1,0,0]=2 98 B9R1.8 NCCC1=CC=NC=C1 W7604 [1,0,0,0,0,0|1,0,0]=2 99 B9R1.8 NNCC1=CC=NC=C1 2364AF [1,0,0,0,0,0|2,0,0]=3 100 B9R1.8 N\N=C\C1=CC=CC=C1 7871AF [1,0,0,0,0,0|1,0,1]=3 101 B9R1.8 O=S=NC1=CC=CC=C1 8948AJ [1,0,0,0,0,0|3,0,0]=4 102 B9R1.8 OCCC1=CC=CC=C1 V0900 [1,0,0,0,0,0|1,0,0]=2 103 B9R1.8 OCCC1=CC=CN=C1 Y9667 [1,0,0,0,0,0|2,0,0]=3 104 B9R1.8 OCCC1=CC=NC=C1 6680AL [1,0,0,0,0,0|2,0,0]=3 105 B9R1.8 ONCC1=CC=CC=C1 9353AB [1,0,0,0,0,0|2,0,0]=3 106 B9R1.8 [C-]#[N+]CC1=NC=CC=C1 Y9586 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.8 [CH2][CH][CH]C1=CC=CC=C1 8736AL [1,0,0,0,0,0|1,0,2]=4 108 B11R1.1 BrCCOC1=CC=C(Br)C=C1 Z0310 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.1 C=CCCC1=CC=C(F)C=C1 7681AD [0,1,0,0,0,0|2,0,0]=3 110 B11R1.1 C=CCOC1=CC=C(C)C=C1 7037AL [0,1,0,0,0,0|2,0,1]=4 111 B11R1.1 CC1=CC=C(CN=C=O)C=C1 5756AE [0,1,0,0,0,0|2,0,1]=4 112 B11R1.1 CC1=CC=C(CN=C=S)C=C1 Y8894 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.1 CC1=CC=C(OCCN)C=C1 Y8506 [0,1,0,0,0,0|1,0,0]=2 114 B11R1.1 CC1=CC=C(OCCO)C=C1 7911AL [0,1,0,0,0,0|2,0,0]=3 115 B11R1.1 CC1=CC=C(SCC#N)C=C1 1025AB [0,1,0,0,0,0|1,0,2]=4 116 B11R1.1 CCCCC1=CC=C(Cl)C=C1 4800AL [0,1,0,0,0,0|2,0,0]=3 117 B11R1.1 CCCOC1=CC=C(Br)C=C1 Z0571 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.1 CCCOC1=NC=C(Cl)C=C1 Y3728 [0,1,0,0,0,0|3,0,0]=4 119 B11R1.1 CCNCC1=CC=C(Cl)C=C1 7274AJ [0,1,0,0,0,0|2,0,0]=3 120 B11R1.1 CCNCC1=CC=C(Cl)C=C1 7613AC [0,1,0,0,0,0|2,0,0]=3 121 B11R1.1 CNCCC1=CC=C(Cl)C=C1 2068AE [0,1,0,0,0,0|1,0,0]=2 122 B11R1.1 CNCCC1=CC=C(O)C=C1 R512 [0,1,0,0,0,0|0,0,0]=1 123 B11R1.1 ClC1=CC=C(CCCBr)C=C1 V7097 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.1 ClCCCC1=CC=C(Cl)C=C1 7334AE [0,1,0,0,0,0|2,0,0]=3 125 B11R1.1 FC1=CC=C(OCCBr)C=C1 0479AE [0,1,0,0,0,0|2,0,0]=3 126 B11R1.1 N#CCCC1=CC=C(Br)C=C1 8533AB [0,1,0,0,0,0|1,0,1]=3 127 B11R1.1 N#CCCC1=CC=C(Cl)C=C1 0196AE [0,1,0,0,0,0|1,0,1]=3 128 B11R1.1 N#CCOC1=CC=C(Br)C=C1 V5695 [0,1,0,0,0,0|1,0,2]=4 129 B11R1.1 N#CCSC1=CC=C(Cl)C=C1 6217AD [0,1,0,0,0,0|1,0,2]=4 130 B11R1.1 N#CSCC1=CC=C(Cl)C=C1 7087AD [0,1,0,0,0,0|1,0,2]=4 131 B11R1.1 N(CC)CC1=CC=C(F)C=C1 7275AJ [0,1,0,0,0,0|2,0,0]=3 132 B11R1.1 NCCOC1=CC=C(Cl)C=C1 V4925 [0,1,0,0,0,0|1,0,0]=2 133 B11R1.1 NCCOC1=CC=C(F)C=C1 Y9609 [0,1,0,0,0,0|1,0,0]=2 134 B11R1.1 O=CCCC1=CC=C(Br)C=C1 2565AC [0,1,0,0,0,0|2,0,0]=3 135 B11R1.1 O=CCCC1=CC=C(F)C=C1 W7539 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.1 OCCCC1=CC=C(O)C=C1 W2096 [0,1,0,0,0,0|1,0,0]=2 137 B11R1.1 OCCOC1=CC=C(Br)C=C1 V5363 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.1 OCCSC1=CC=C(Cl)C=C1 6217AA [0,1,0,0,0,0|2,0,0]=3 139 B11R1.1 OCCSC1=NC=C(Cl)C=C1 Y7869 [0,1,0,0,0,0|3,0,0]=4 140 B11R1.1 OC\C=C\C1=CC=C(Br)C=C1 8226AC [0,1,0,0,0,0|2,0,1]=4 141 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 9287AB [0,1,0,0,0,0|2,0,1]=4 142 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 7126AD [0,1,0,0,0,0|2,0,1]=4 143 B11R1.20 CC(=O)CC1=CC=C(I)C=C1 1094AB [0,1,0,0,0,0|2,0,1]=4 144 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 Q226 [0,1,0,0,0,0|1,0,1]=3 145 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 3597AB [0,1,0,0,0,0|2,0,1]=4 146 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 V4230 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.20 CC(C)CC1=CC=C(N)C=C1 3122AB [0,1,0,0,0,0|2,0,0]=3 148 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 Z8271 [0,1,0,0,0,0|3,0,0]=4 149 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 Z0788 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.20 CC(C)OC1=CC=C(N)C=C1 V4472 [0,1,0,0,0,0|3,0,0]=4 151 B11R1.20 CC(C)OC1=CC=C(O)C=C1 Y9996 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.20 CC1=CC=C(OC(F)F)C=C1 4991AD [0,1,0,0,0,0|3,0,0]=4 153 B11R1.20 FC(F)OC1=CC=C(Cl)C=C1 0130AF [0,1,0,0,0,0|3,0,0]=4 154 B11R1.20 FC(F)OC1=CC=C(I)C=C1 X8132 [0,1,0,0,0,0|3,0,0]=4 155 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 1638AC [0,1,0,0,0,0|1,0,1]=3 156 B11R1.20 NC(=O)CC1=CC=C(Cl)C=C1 Y6115 [0,1,0,0,0,0|1,0,1]=3 157 B11R1.20 NC(=O)NC1=CC=C(Br)C=C1 6622AD [0,1,0,0,0,0|2,0,1]=4 158 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 V3810 [0,1,0,0,0,0|1,0,1]=3 159 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 5630AH [0,1,0,0,0,0|1,1,1]=4 160 B11R1.20 OC1=CC=C(OC(F)F)C=C1 V8554 [0,1,0,0,0,0|2,0,0]=3 161 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 5818AB [0,1,0,0,0,0|1,0,2]=4 162 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 1635AE [0,1,0,0,0,0|2,0,1]=4 163 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 9145AE [0,1,0,0,0,0|2,0,0]=3 164 B11R1.22 CCN(C)C1=CC=C(N)C=C1 9950AH [0,1,0,0,0,0|3,0,0]=4 165 B11R1.22 C\C(=N/O)C1=CC=C(O)C=C1 6535AL [0,1,0,0,0,0|2,0,1]=4 166 B11R1.22 NC(CO)C1=CC=C(F)C=C1 4163AD [0,1,0,0,0,0|2,0,0]=3 167 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 Y5103 [0,1,0,0,0,0|1,0,1]=3 168 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 L165 [0,1,0,0,0,0|1,0,1]=3 169 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 W8329 [0,1,0,0,0,0|1,0,1]=3 170 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 X8275 [0,1,0,0,0,0|2,0,1]=4 171 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 X6772 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 0082AE [0,1,0,0,0,0|2,0,1]=4 173 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 5413AB [0,1,0,0,0,0|2,0,1]=4 174 B11R1.22 OC(CCl)C1=CC=C(Cl)C=C1 2026AL [0,1,0,0,0,0|2,0,0]=3 175 B11R1.81 CC1=CC(Br)=CC=C1CC#N 0971AB [0,1,0,0,0,0|1,0,2]=4 176 B11R1.81 CC1=CC=C(CCN)C(C)=C1 1998AC [0,1,0,0,0,0|1,0,0]=2 177 B11R1.81 CCCC1=C(O)C=C(O)C=C1 9885AA [0,1,0,0,0,0|1,0,0]=2 178 B11R1.81 CCNC1=CC=C(Br)C=C1F Z8384 [0,1,0,0,0,0|3,0,0]=4 179 B11R1.81 CCOC1=C(N)C=C(C)C=C1 7117AE [0,1,0,0,0,0|3,0,0]=4 180 B11R1.81 CCOC1=CC=C(Br)C=C1C Z0852 [0,1,0,0,0,0|3,0,0]=4 181 B11R1.81 CCOC1=CC=C(F)C=C1Br Z0512 [0,1,0,0,0,0|3,0,0]=4 182 B11R1.81 CNCC1=CC=C(Cl)C=C1Cl W6552 [0,1,0,0,0,0|3,0,0]=4 183 B11R1.81 CNCC1=CC=C(Cl)C=C1Cl W9307 [0,1,0,0,0,0|3,0,0]=4 184 B11R1.81 N#CCC1=C(Br)C=C(F)C=C1 X2196 [0,1,0,0,0,0|1,0,2]=4 185 B11R1.81 N#CCC1=C(F)C=C(Cl)C=C1 X2194 [0,1,0,0,0,0|1,0,2]=4 186 B11R1.81 N#CCC1=CC=C(Br)C=C1F A886 [0,1,0,0,0,0|1,0,2]=4 187 B11R1.81 NOCC1=C(Cl)C=C(F)C=C1 3474AB [0,1,0,0,0,0|2,0,0]=3 188 B11R1.81 NOCC1=CC=C(Cl)C=C1Cl 4710AE [0,1,0,0,0,0|2,0,0]=3 189 B11R1.81 OCCC1=C(Cl)C=C(Cl)C=C1 X2190 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.83 C#CC1=CC=C(CC#N)C=C1 W5671 [0,1,0,0,0,0|1,0,2]=4 191 B11R1.83 CCC1=CC=C(CNC)C=C1 V6675 [0,1,0,0,0,0|3,0,0]=4 192 B11R1.83 CCCC1=CC=C(C=O)C=C1 X2736 [0,1,0,0,0,0|1,0,1]=3 193 B11R1.83 CCCC1=CC=C(CN)C=C1 Z4846 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.83 CCCC1=CC=C(OC)C=C1 5719AF [0,1,0,0,0,0|1,0,0]=2 195 B11R1.83 CCNC1=CC=C(C#N)C=C1 V6077 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.83 CCNC1=CC=C(C=O)C=C1 2473AC [0,1,0,0,0,0|2,0,1]=4 197 B11R1.83 CCOC1=CC=C(CBr)C=C1 2225AB [0,1,0,0,0,0|3,0,0]=4 198 B11R1.83 CCOC1=CC=C(CC)C=C1 6498AL [0,1,0,0,0,0|3,0,0]=4 199 B11R1.83 CCOC1=CC=C(CN)C=C1 V7284 [0,1,0,0,0,0|3,0,0]=4 200 B11R1.83 CNCC1=CC=C(C#N)C=C1 V5324 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.83 CNCC1=CC=C(OC)C=C1 W8997 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.83 COC1=CC=C(CC#N)C=N1 1227AJ [0,1,0,0,0,0|1,0,2]=4 203 B11R1.83 COC1=CC=C(CC=O)C=C1 8366AB [0,1,0,0,0,0|1,0,1]=3 204 B11R1.83 COC1=CC=C(CNN)C=C1 4174AD [0,1,0,0,0,0|1,0,0]=2 205 B11R1.83 COC1=CC=C(CNN)C=C1 9971AL [0,1,0,0,0,0|1,0,0]=2 206 B11R1.83 COCC1=CC=C(CN)C=C1 6002AA [0,1,0,0,0,0|3,0,0]=4 207 B11R1.83 CSC1=CC=C(CC#N)C=C1 2273AE [0,1,0,0,0,0|0,1,2]=4 208 B11R1.83 N#CC1=CC=C(CCBr)C=C1 Z5069 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.83 OCCC1=CC=C(CO)C=C1 6635AB [0,1,0,0,0,0|1,0,0]=2 210 B11R1.192 CC1=C(F)C=C(CC#N)C=C1 2281AB [0,1,0,0,0,0|1,0,2]=4 211 B11R1.192 CC1=CC(SC#N)=CC=C1O 4825AB [0,1,0,0,0,0|1,0,2]=4 212 B11R1.192 CC1=CC=C(CCN)C=C1C 8902AA [0,1,0,0,0,0|1,0,0]=2 213 B11R1.192 CCCC1=CC=C(Br)C(F)=C1 W3658 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.192 CCNC1=CC(Cl)=C(Cl)C=C1 4258AH [0,1,0,0,0,0|3,0,0]=4 215 B11R1.192 CCOC1=CC=C(Br)C(C)=C1 W7841 [0,1,0,0,0,0|3,0,0]=4 216 B11R1.192 CCOC1=CC=C(Br)C(Cl)=C1 W5338 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.192 CCOC1=CC=C(Br)C(F)=C1 Y3634 [0,1,0,0,0,0|3,0,0]=4 218 B11R1.192 CCOC1=CC=C(F)C(F)=C1 Z0247 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.192 CNCC1=CC(C)=C(C)C=C1 8414AA [0,1,0,0,0,0|3,0,0]=4 220 B11R1.192 CNCC1=CC=C(O)C(O)=C1 6058AJ [0,1,0,0,0,0|2,0,0]=3 221 B11R1.192 FC1=CC=C(CCBr)C=C1F Z4292 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.192 N#CCC1=CC=C(Cl)C(F)=C1 W4837 [0,1,0,0,0,0|1,0,2]=4 223 B11R1.192 N#CCC1=CC=C(F)C(Br)=C1 V6223 [0,1,0,0,0,0|1,0,2]=4 224 B11R1.192 OCCC1=CC(Cl)=C(F)C=C1 4055AB [0,1,0,0,0,0|2,0,0]=3 225 B11R1.192 OCCC1=CC=C(Cl)C(Cl)=C1 X8265 [0,1,0,0,0,0|2,0,0]=3 226 B11R2.34 BrC1=CC=C(C2CC2)C=C1 2180AA [0,0,0,1,0,0|2,0,0]=3 227 B11R2.34 FC1=NC=C(C2CC2)C=C1 Y3567 [0,0,0,1,0,0|3,0,0]=4 228 B11R2.34 OC1=CC=C(C2CC2)C=C1 Z3817 [0,0,0,1,0,0|1,0,0]=2 229 B11R2.36 BrC1=CC2=C(C=C1)CCC2 W7361 [0,0,0,1,0,0|2,0,0]=3 230 B11R2.36 BrC1=CC2=C(C=C1)CCO2 9851AA [0,0,0,1,0,0|2,0,0]=3 231 B11R2.36 BrC1=CC2=C(C=C1)CNC2 W9520 [0,0,0,1,0,0|3,0,0]=4 232 B11R2.36 BrC1=CC2=C(C=C1)CNC2 X9690 [0,0,0,1,0,0|3,0,0]=4 233 B11R2.36 BrC1=CC=C2CC=CC2=C1 1731AC [0,0,0,1,0,0|2,0,1]=4 234 B11R2.36 BrC1=CC=C2N=CNC2=C1 Z8414 [0,0,0,1,0,0|2,0,1]=4 235 B11R2.36 CC1=CC2=C(C=C1)C=NN2 Y5523 [0,0,0,1,0,0|2,0,1]=4 236 B11R2.36 CC1=CC2=C(C=C1)CCN2 3678AC [0,0,0,1,0,0|1,0,0]=2 237 B11R2.36 CC1=CC2=C(C=C1)OCO2 3348AH [0,0,0,1,0,0|3,0,0]=4 238 B11R2.36 ClC1=CC2=C(C=C1)C=NN2 W7956 [0,0,0,1,0,0|2,0,1]=4 239 B11R2.36 ClC1=CC2=C(C=C1)CCN2 W6731 [0,0,0,1,0,0|1,0,0]=2 240 B11R2.36 ClC1=CC2=C(C=C1)CCN2 W9278 [0,0,0,1,0,0|1,0,0]=2 241 B11R2.36 ClC1=CC2=C(C=C1)NCC2 U905 [0,0,0,1,0,0|3,0,0]=4 242 B11R2.36 ClC1=CC2=C(C=C1)NCC2 X8558 [0,0,0,1,0,0|3,0,0]=4 243 B11R2.36 ClC1=CC2=C(C=C1)OCO2 8706AE [0,0,0,1,0,0|3,0,0]=4 244 B11R2.36 ClC1=CC=C2CCCC2=N1 2919AA [0,0,0,1,0,0|3,0,0]=4 245 B11R2.36 FC1=CC2=C(C=C1)C=NN2 W5643 [0,0,0,1,0,0|2,0,1]=4 246 B11R2.36 FC1=CC2=C(C=C1)CNC2 W7863 [0,0,0,1,0,0|3,0,0]=4 247 B11R2.36 FC1=CC=C2NCCC2=C1 1560AB [0,0,0,1,0,0|3,0,0]=4 248 B11R2.36 IC1=CC2=C(C=C1)CCN2 Y5205 [0,0,0,1,0,0|1,0,0]=2 249 B11R2.36 IC1=CC2=C(C=C1)N=CN2 2310AC [0,0,0,1,0,0|2,0,1]=4 250 B11R2.36 IC1=CC2=C(C=CN2)C=C1 Z3913 [0,0,0,1,0,0|1,0,2]=4 251 B11R2.36 IC1=CC2=C(CCC2)N=C1 4912AA [0,0,0,1,0,0|3,0,0]=4 252 B11R2.36 IC1=CC=C2OCCC2=C1 5975AA [0,0,0,1,0,0|3,0,0]=4 253 B11R2.36 IC1=CC=C2OCOC2=C1 Y6308 [0,0,0,1,0,0|3,0,0]=4 254 B11R2.36 NC1=CC2=C(C=C1)COC2 Z4952 [0,0,0,1,0,0|3,0,0]=4 255 B11R2.36 NC1=CC=C2OCCC2=C1 V2390 [0,0,0,1,0,0|3,0,0]=4 256 B11R2.36 OC1=CC2=C(C=C1)C=NO2 W7691 [0,0,0,1,0,0|2,0,1]=4 257 B11R2.36 OC1=CC2=C(C=C1)CCC2 X3320 [0,0,0,1,0,0|1,0,0]=2 258 B11R2.36 OC1=CC2=C(C=C1)NCC2 8845AA [0,0,0,1,0,0|2,0,0]=3 259 B11R2.36 OC1=CC2=C(C=C1)SC=N2 1985AC [0,0,0,1,0,0|1,0,2]=4 260 B11R2.36 OC1=CC2=NON=C2C=C1 Y4040 [0,0,0,1,0,0|2,0,1]=4 261 B11R2.36 OC1=CC=C2C=COC2=C1 5917AA [0,0,0,1,0,0|1,0,2]=4 262 B11R2.36 OC1=CC=C2N=CSC2=C1 X9934 [0,0,0,1,0,0|2,0,1]=4 263 B11R2.36 OC1=CC=C2NC=NC2=C1 Y7586 [0,0,0,1,0,0|1,0,2]=4 264 B9R1.7 NCCC1=CC=C(Br)S1 1208AJ [0,0,0,0,1,0|2,0,0]=3 265 B8R1.2 BrCC1=CC=NC=C1 Y7030 [2,0,0,0,0,0|2,0,0]=4 266 B8R1.2 CSC1=NC=CC=C1 L314 [2,0,0,0,0,0|2,0,0]=4 267 B8R1.2 Cl[Hg]C1=CC=CC=C1 7627AF [2,0,0,0,0,0|2,0,0]=4 268 B8R1.2 N#CC1=CC=CC=C1 E085 [2,0,0,0,0,0|0,0,2]=4 269 B8R1.2 NCC1=CC=NC=C1 Z3385 [2,0,0,0,0,0|1,0,0]=3 270 B8R1.2 NCC1=CN=CN=C1 W4845 [2,0,0,0,0,0|2,0,0]=4 271 B8R1.2 NCC1=NC=CN=C1 W5959 [2,0,0,0,0,0|2,0,0]=4 272 B8R1.2 NCC1=NC=NC=C1 9281AB [2,0,0,0,0,0|2,0,0]=4 273 B8R1.2 NNC1=CC=CN=C1 Z1664 [2,0,0,0,0,0|2,0,0]=4 274 B8R1.3 CC1=CC=C(F)C=N1 I740 [2,0,0,0,0,0|2,0,0]=4 275 B8R1.3 CC1=NC=C(Cl)C=C1 V7477 [2,0,0,0,0,0|2,0,0]=4 276 B8R1.3 CC1=NC=C(O)C=N1 W5688 [2,0,0,0,0,0|2,0,0]=4 277 B8R1.3 NC1=CN=C(O)C=C1 V5265 [2,0,0,0,0,0|1,0,0]=3 278 B8R1.3 NC1=NC=C(O)C=C1 V8126 [2,0,0,0,0,0|1,0,0]=3 279 B8R1.3 OC1=CN=C(I)C=C1 5466AA [2,0,0,0,0,0|2,0,0]=4 280 B8R1.3 [O-]C1=CC=C(Cl)C=C1 3305AA [2,0,0,0,0,0|1,0,1]=4 281 B10R1.3 C=CC1=CC=C(CN)C=C1 X4444 [1,1,0,0,0,0|1,0,0]=3 282 B10R1.3 CCC1=CC=C(C=O)N=C1 5847AH [1,1,0,0,0,0|1,0,1]=4 283 B10R1.3 CNC1=CC=C(C#N)C=C1 V6076 [1,1,0,0,0,0|2,0,0]=4 284 B10R1.3 CNC1=CC=C(OC)C=C1 Z6803 [1,1,0,0,0,0|1,0,0]=3 285 B10R1.3 COC1=CC=C(CN)C=N1 8647AA [1,1,0,0,0,0|1,0,0]=3 286 B10R1.3 COC1=CC=C(NN)C=C1 4215AB [1,1,0,0,0,0|1,0,0]=3 287 B10R1.3 COC1=CC=C(SC)C=C1 I355 [1,1,0,0,0,0|1,0,0]=3 288 B10R1.3 COC1=CN=C(CCl)C=C1 1704AC [1,1,0,0,0,0|2,0,0]=4 289 B10R1.3 COC1=CN=C(CN)C=C1 4773AJ [1,1,0,0,0,0|1,0,0]=3 290 B10R1.3 COC1=CN=C(CO)C=C1 X9716 [1,1,0,0,0,0|2,0,0]=4 291 B10R1.3 COC1=NC=C(CCl)C=C1 0532AA [1,1,0,0,0,0|2,0,0]=4 292 B10R1.3 COC1=NC=C(CN)C=C1 3334AC [1,1,0,0,0,0|1,0,0]=3 293 B10R1.3 COC1=NC=C(CN)C=N1 6170AC [1,1,0,0,0,0|2,0,0]=4 294 B10R1.3 CSC1=CC=C(CBr)C=C1 1120AQ [1,1,0,0,0,0|1,1,0]=4 295 B10R1.3 CSC1=CC=C(CN)C=C1 0258AF [1,1,0,0,0,0|0,1,0]=3 296 B10R1.3 N#CC1=CC=C(CN)C=C1 X8693 [1,1,0,0,0,0|1,0,0]=3 297 B10R1.3 NCC1=CC=C(CO)C=C1 W6028 [1,1,0,0,0,0|0,0,0]=2 298 B10R1.13 CC(=O)C1=CC=C(O)N=C1 X9010 [1,1,0,0,0,0|1,0,1]=4 299 B10R1.13 CC(=O)C1=NC=C(O)C=C1 0360AC [1,1,0,0,0,0|1,0,1]=4 300 B10R1.13 CC(Br)C1=CC=C(F)C=C1 9966AB [1,1,0,0,0,0|1,0,0]=3 301 B10R1.13 CC(C)C1=CC=C(N)C=N1 Z4708 [1,1,0,0,0,0|2,0,0]=4 302 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 Z2196 [1,1,0,0,0,0|1,0,0]=3 303 B10R1.13 CC(N)C1=CC=C(Br)C=C1 V8869 [1,1,0,0,0,0|1,0,0]=3 304 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 V6495 [1,1,0,0,0,0|1,0,0]=3 305 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 Y9670 [1,1,0,0,0,0|1,0,0]=3 306 B10R1.13 CC(N)C1=CC=C(F)C=C1 V5775 [1,1,0,0,0,0|1,0,0]=3 307 B10R1.13 CC(O)C1=CC=C(O)C=C1 Z4466 [1,1,0,0,0,0|0,0,0]=2 308 B10R1.13 CC(O)C1=NC=C(Br)C=C1 8022AA [1,1,0,0,0,0|2,0,0]=4 309 B10R1.13 CC1=CC=C(C(=N)N)C=C1 2887AJ [1,1,0,0,0,0|1,0,1]=4 310 B10R1.13 CC1=CC=C(C(C)N)C=C1 8708AB [1,1,0,0,0,0|1,0,0]=3 311 B10R1.13 CC1=NC=C(C(C)O)C=C1 0117AA [1,1,0,0,0,0|2,0,0]=4 312 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 6145AJ [1,1,0,0,0,0|2,0,0]=4 313 B10R1.13 CN(C)C1=CC=C(F)C=C1 2692AE [1,1,0,0,0,0|2,0,0]=4 314 B10R1.13 CN(C)C1=CC=C(O)C=C1 Z4951 [1,1,0,0,0,0|1,0,0]=3 315 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 V9278 [1,1,0,0,0,0|2,0,0]=4 316 B10R1.13 CS(=O)C1=CC=C(F)C=C1 7689AJ [1,1,0,0,0,0|2,0,0]=4 317 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 4787AJ [1,1,0,0,0,0|1,0,0]=3 318 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 X9175 [1,1,0,0,0,0|1,0,0]=3 319 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 W5396 [1,1,0,0,0,0|1,0,0]=3 320 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 1808AC [1,1,0,0,0,0|1,0,0]=3 321 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 X8527 [1,1,0,0,0,0|1,0,0]=3 322 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 6983AC [1,1,0,0,0,0|1,0,0]=3 323 B10R1.13 C[S+](C)C1=CC=C(O)C=C1 6544AL [1,1,0,0,0,0|1,0,0]=3 324 B10R1.13 FC(F)C1=CC=C(Br)C=C1 X0133 [1,1,0,0,0,0|2,0,0]=4 325 B10R1.13 FC1=CC=C(C(Cl)Cl)C=C1 V6035 [1,1,0,0,0,0|2,0,0]=4 326 B10R1.13 FC1=CC=C(C(F)F)C=C1 8605AD [1,1,0,0,0,0|2,0,0]=4 327 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 1266AB [1,1,0,0,0,0|1,0,1]=4 328 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 C099 [1,1,0,0,0,0|1,0,1]=4 329 B10R1.13 N=C(N)C1=CC=C(I)C=C1 2845AJ [1,1,0,0,0,0|1,0,1]=4 330 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 V4765 [1,1,0,0,0,0|1,0,1]=4 331 B10R1.25 CC1=C(CBr)C=CC(F)=C1 3485AC [1,1,0,0,0,0|2,0,0]=4 332 B10R1.25 CC1=CC(C)=C(NN)C=C1 9955AL [1,1,0,0,0,0|2,0,0]=4 333 B10R1.25 CC1=CC(Cl)=CC=C1CO Z0039 [1,1,0,0,0,0|2,0,0]=4 334 B10R1.25 CC1=CC(F)=C(NN)C=C1 6959AB [1,1,0,0,0,0|2,0,0]=4 335 B10R1.25 CC1=CC(O)=CC=C1C=O W6182 [1,1,0,0,0,0|1,0,1]=4 336 B10R1.25 CC1=CC=C(CN)C(Cl)=C1 0833AC [1,1,0,0,0,0|1,0,0]=3 337 B10R1.25 CC1=CC=C(CO)C(N)=C1 2629AC [1,1,0,0,0,0|2,0,0]=4 338 B10R1.25 CC1=CC=C(NN)C(Cl)=C1 W4649 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.25 CCC1=C(F)C=C(Br)C=C1 9478AB [1,1,0,0,0,0|1,0,0]=3 340 B10R1.25 CCC1=CN=C(C)C=C1Br 6901AC [1,1,0,0,0,0|2,0,0]=4 341 B10R1.25 CNC1=C(F)C=C(F)C=C1 1904AL [1,1,0,0,0,0|2,0,0]=4 342 B10R1.25 CNC1=C(N)C=C(Br)C=C1 2680AJ [1,1,0,0,0,0|2,0,0]=4 343 B10R1.25 CNC1=CC=C(Cl)C=C1Cl V5409 [1,1,0,0,0,0|2,0,0]=4 344 B10R1.25 CNC1=CC=C(F)C=C1Br Y6882 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.25 COC1=C(Br)C=C(F)C=C1 H620 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.25 COC1=C(I)C=C(C)C=C1 X4546 [1,1,0,0,0,0|2,0,0]=4 347 B10R1.25 COC1=C(O)C=C(O)C=C1 9124AB [1,1,0,0,0,0|1,0,0]=3 348 B10R1.25 COC1=CC=C(Br)C=C1Cl Z0644 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.25 COC1=CC=C(Br)C=C1I Z5421 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.25 COC1=CC=C(Cl)C=C1I N695 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.25 COC1=CC=C(Cl)C=C1O 4776AB [1,1,0,0,0,0|2,0,0]=4 352 B10R1.25 COC1=CC=C(F)C=C1Cl X4244 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.25 COC1=CC=C(F)C=C1N V5190 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.25 COC1=CC=C(I)C=C1C X8379 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.25 COC1=CC=C(I)C=C1N X5382 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.25 COC1=CC=C(N)C=C1C Y6043 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.25 COC1=CC=C(N)C=C1Cl 5846AJ [1,1,0,0,0,0|2,0,0]=4 358 B10R1.25 COC1=CC=C(N)C=C1N 5296AL [1,1,0,0,0,0|2,0,0]=4 359 B10R1.25 COC1=CC=C(N)C=C1N N030 [1,1,0,0,0,0|2,0,0]=4 360 B10R1.25 COC1=CC=C(O)C=C1C Z0198 [1,1,0,0,0,0|1,0,0]=3 361 B10R1.25 COC1=CC=C(S)C=C1F 5336AH [1,1,0,0,0,0|1,1,0]=4 362 B10R1.25 CSC1=CC=C(Br)C=C1Cl Y3518 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.25 CSC1=CC=C(Br)C=C1F Z0393 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.25 CSC1=CC=C(F)C=C1Br Z1091 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.25 CSC1=CC=C(F)C=C1C Z0086 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.25 CSC1=CC=C(F)C=C1F Z0047 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.25 N#CC1=CC=C(O)C=C1O W7608 [1,1,0,0,0,0|0,0,2]=4 368 B10R1.25 NC1=CC(Br)=CC=C1CO V9454 [1,1,0,0,0,0|2,0,0]=4 369 B10R1.25 NCC1=C(C)C=C(Br)C=C1 9535AF [1,1,0,0,0,0|1,0,0]=3 370 B10R1.25 NCC1=C(Cl)C=C(Br)C=C1 8749AH [1,1,0,0,0,0|1,0,0]=3 371 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 1211AC [1,1,0,0,0,0|1,0,0]=3 372 B10R1.25 NCC1=CC=C(Br)C=C1F X8114 [1,1,0,0,0,0|1,0,0]=3 373 B10R1.25 NNC1=C(Cl)C=C(F)C=C1 3334AA [1,1,0,0,0,0|2,0,0]=4 374 B10R1.25 NNC1=CC=C(F)C=C1F U214 [1,1,0,0,0,0|2,0,0]=4 375 B10R1.25 NNC1=CC=C(I)C=C1Cl Z3996 [1,1,0,0,0,0|2,0,0]=4 376 B10R1.25 O=CC1=CC=C(O)C=C1Br Z4448 [1,1,0,0,0,0|1,0,1]=4 377 B10R1.25 O=CC1=CC=C(O)C=C1I 4988AC [1,1,0,0,0,0|1,0,1]=4 378 B10R1.25 OCC1=C(O)C=C(Br)C=C1 8742AA [1,1,0,0,0,0|2,0,0]=4 379 B10R1.25 OCC1=CC=C(Br)C=C1Br V7191 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.25 OCC1=CC=C(Br)C=C1Cl Z0302 [1,1,0,0,0,0|2,0,0]=4 381 B10R1.176 CC1=C(Br)C=CC(CBr)=C1 2629AB [1,1,0,0,0,0|2,0,0]=4 382 B10R1.176 CC1=C(C)C=C(NN)C=C1 3967AD [1,1,0,0,0,0|2,0,0]=4 383 B10R1.176 CC1=CC(CCl)=CC=C1Br V3412 [1,1,0,0,0,0|2,0,0]=4 384 B10R1.176 CC1=CC(CO)=CC=C1Br W3250 [1,1,0,0,0,0|2,0,0]=4 385 B10R1.176 CC1=CC(CO)=CC=C1F V4762 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.176 CC1=CC=C(CN)C=C1Cl W7826 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.176 CC1=CC=C(CO)C=C1Br Z0777 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.176 CCC1=CC(Br)=C(O)C=C1 7273AE [1,1,0,0,0,0|0,0,0]=2 389 B10R1.176 CCC1=CC(O)=C(O)C=C1 2184AA [1,1,0,0,0,0|0,0,0]=2 390 B10R1.176 CCC1=CC=C(Br)C(F)=C1 W9564 [1,1,0,0,0,0|1,0,0]=3 391 B10R1.176 CCC1=CC=C(N)C(O)=C1 1522AJ [1,1,0,0,0,0|1,0,0]=3 392 B10R1.176 CNC1=CC=C(C)C(Br)=C1 Z8003 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.176 COC1=CC(N)=C(F)C=C1 9367AB [1,1,0,0,0,0|2,0,0]=4 394 B10R1.176 COC1=CC(N)=C(O)C=C1 0175AE [1,1,0,0,0,0|1,0,0]=3 395 B10R1.176 COC1=CC(O)=C(N)C=C1 5590AB [1,1,0,0,0,0|2,0,0]=4 396 B10R1.176 COC1=CC=C(Br)C(I)=C1 6659AB [1,1,0,0,0,0|2,0,0]=4 397 B10R1.176 COC1=CC=C(Br)C(O)=C1 W7550 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.176 COC1=CC=C(F)C(C)=C1 1547AB [1,1,0,0,0,0|2,0,0]=4 399 B10R1.176 COC1=CC=C(F)C(Cl)=C1 V4191 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.176 COC1=CC=C(F)C(I)=C1 Y3551 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.176 COC1=CC=C(F)C(O)=C1 Y3754 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.176 COC1=CC=C(I)C(N)=C1 W3349 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.176 COC1=CC=C(I)C(O)=C1 5618AB [1,1,0,0,0,0|2,0,0]=4 404 B10R1.176 COC1=CC=C(N)C(F)=C1 V8518 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.176 COC1=CC=C(N)C(I)=C1 W4105 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.176 COC1=CC=C(N)C(N)=C1 1452AA [1,1,0,0,0,0|2,0,0]=4 407 B10R1.176 COC1=CC=C(N)C(O)=C1 Z4697 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.176 COC1=CC=C(O)C(C)=C1 Y5462 [1,1,0,0,0,0|1,0,0]=3 409 B10R1.176 NC1=C(F)C=CC(CO)=C1 7761AD [1,1,0,0,0,0|2,0,0]=4 410 B10R1.176 NC1=CC(CO)=CC=C1Br Z9064 [1,1,0,0,0,0|2,0,0]=4 411 B10R1.176 NC1=CC=C(CO)C=C1F 7228AA [1,1,0,0,0,0|2,0,0]=4 412 B10R1.176 NCC1=CC=C(Cl)C(Br)=C1 V7987 [1,1,0,0,0,0|1,0,0]=3 413 B10R1.176 NCC1=CC=C(Cl)C(F)=C1 X8372 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.176 NCC1=CC=C(F)C(Br)=C1 2384AL [1,1,0,0,0,0|1,0,0]=3 415 B10R1.176 NCC1=CC=C(F)C(Br)=C1 X3002 [1,1,0,0,0,0|1,0,0]=3 416 B10R1.176 NNC1=CC=C(F)C(Cl)=C1 N648 [1,1,0,0,0,0|2,0,0]=4 417 B10R1.176 NNC1=CC=C(F)C(F)=C1 I601 [1,1,0,0,0,0|2,0,0]=4 418 B10R1.176 OCC1=CC(O)=C(O)C=C1 5062AB [1,1,0,0,0,0|1,0,0]=3 419 B10R1.176 OCC1=CC=C(Br)C(Cl)=C1 Y3805 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.176 OCC1=CC=C(Cl)C(Br)=C1 X8250 [1,1,0,0,0,0|2,0,0]=4 421 B10R1.4 BrCCC1=CC=CC=C1Br Z7172 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.4 C=CCC1=C(C)C=CC=C1 7968AA [1,1,0,0,0,0|1,0,1]=4 423 B10R1.4 CC1=CC=CC=C1CCN S579 [1,1,0,0,0,0|0,0,0]=2 424 B10R1.4 CCCC1=CC=NC=C1C 1078AE [1,1,0,0,0,0|2,0,0]=4 425 B10R1.4 CCNC1=CC=CC=C1F 8903AD [1,1,0,0,0,0|2,0,0]=4 426 B10R1.4 CCOC1=C(Cl)C=CC=C1 9221AB [1,1,0,0,0,0|2,0,0]=4 427 B10R1.4 CCOC1=CC=CC=C1F Z0605 [1,1,0,0,0,0|2,0,0]=4 428 B10R1.4 CCOC1=CC=CC=C1N 8719AL [1,1,0,0,0,0|2,0,0]=4 429 B10R1.4 CNCC1=C(O)C=CC=C1 5657AL [1,1,0,0,0,0|2,0,0]=4 430 B10R1.4 CNCC1=CC=CC=C1F W6033 [1,1,0,0,0,0|2,0,0]=4 431 B10R1.4 COCC1=C(O)C=CC=C1 5292AJ [1,1,0,0,0,0|2,0,0]=4 432 B10R1.4 COCC1=CC=CC=C1Br Z0660 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.4 ClC1=C(CCBr)C=CC=C1 8570AA [1,1,0,0,0,0|1,0,0]=3 434 B10R1.4 FC1=CC=CC=C1CCBr W9375 [1,1,0,0,0,0|1,0,0]=3 435 B10R1.4 N#CCC1=C(N)C=CC=C1 5596AB [1,1,0,0,0,0|0,0,2]=4 436 B10R1.4 NCCC1=CC=CC=C1Br Z8825 [1,1,0,0,0,0|0,0,0]=2 437 B10R1.4 NCCC1=CC=CC=C1N X9142 [1,1,0,0,0,0|0,0,0]=2 438 B10R1.4 NNCC1=CC=CC=C1F 9039AF [1,1,0,0,0,0|1,0,0]=3 439 B10R1.10 BrCCC1=CC=CC(Br)=C1 1605AL [1,1,0,0,0,0|1,0,0]=3 440 B10R1.10 C=CCC1=CC(F)=CC=C1 9816AD [1,1,0,0,0,0|1,0,1]=4 441 B10R1.10 C=CCC1=CC=CC(Cl)=C1 2150AE [1,1,0,0,0,0|1,0,1]=4 442 B10R1.10 CCCC1=CC(F)=CC=C1 2809AB [1,1,0,0,0,0|1,0,0]=3 443 B10R1.10 CCCC1=CC(N)=NC=C1 2922AJ [1,1,0,0,0,0|2,0,0]=4 444 B10R1.10 CCCC1=CC=CC(N)=N1 5785AB [1,1,0,0,0,0|2,0,0]=4 445 B10R1.10 CCNC1=CC=CC(O)=C1 9329AB [1,1,0,0,0,0|2,0,0]=4 446 B10R1.10 CCSC1=CC(Br)=CC=C1 V3919 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.10 CNCC1=CC=CC(Br)=C1 7287AJ [1,1,0,0,0,0|2,0,0]=4 448 B10R1.10 CNCC1=CC=CC(C)=C1 5109AB [1,1,0,0,0,0|2,0,0]=4 449 B10R1.10 CNCC1=CC=CC(Cl)=C1 7403AJ [1,1,0,0,0,0|2,0,0]=4 450 B10R1.10 COCC1=CC(Br)=CC=C1 Z0210 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.10 COCC1=CC(N)=CC=C1 V6465 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.10 ClC1=CC(CCBr)=CC=C1 4892AJ [1,1,0,0,0,0|1,0,0]=3 453 B10R1.10 N#CCC1=CC(I)=CC=C1 5596AA [1,1,0,0,0,0|0,0,2]=4 454 B10R1.10 N#CCC1=CC=CC(N)=C1 Z4772 [1,1,0,0,0,0|0,0,2]=4 455 B10R1.10 NC1=CC(CCO)=CC=C1 7359AB [1,1,0,0,0,0|1,0,0]=3 456 B10R1.10 NCCC1=CC=CC(Br)=C1 V4368 [1,1,0,0,0,0|0,0,0]=2 457 B10R1.10 NNCC1=CC(Cl)=CC=C1 7157AB [1,1,0,0,0,0|1,0,0]=3 458 B10R1.10 NNCC1=CC=CC(O)=C1 W8565 [1,1,0,0,0,0|1,0,0]=3 459 B10R1.10 NOCC1=CC=CC(F)=C1 7198AB [1,1,0,0,0,0|1,0,0]=3 460 B10R1.10 OCCC1=CC(O)=CC=C1 X9865 [1,1,0,0,0,0|1,0,0]=3 461 B10R1.10 OCCC1=CC=CC(Cl)=C1 X8323 [1,1,0,0,0,0|1,0,0]=3 462 B10R1.10 OCCC1=NC(Br)=CC=C1 X5060 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.15 C=C(CC)C1=CC=CC=C1 0460AB [1,1,0,0,0,0|1,0,1]=4 464 B10R1.15 CC(CBr)C1=CC=CC=C1 Y3159 [1,1,0,0,0,0|1,0,0]=3 465 B10R1.15 CC(CN)C1=CC=CC=C1 W4299 [1,1,0,0,0,0|0,0,0]=2 466 B10R1.15 CCC(N)C1=CC=NC=C1 4998AJ [1,1,0,0,0,0|2,0,0]=4 467 B10R1.15 CCC(N)C1=NC=CC=C1 4914AJ [1,1,0,0,0,0|2,0,0]=4 468 B10R1.15 CCN(C)C1=CC=CC=C1 W7366 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.15 CCN(N)C1=CC=CC=C1 4841AL [1,1,0,0,0,0|2,0,0]=4 470 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 7435AJ [1,1,0,0,0,0|1,0,0]=3 471 B10R1.15 CNC(C)C1=CC=CC=C1 V5180 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 V5313 [1,1,0,0,0,0|0,0,0]=2 473 B10R1.15 NC(CO)C1=CC=CC=N1 1465AJ [1,1,0,0,0,0|2,0,0]=4 474 B10R1.15 NCC(N)C1=CC=CC=C1 8461AA [1,1,0,0,0,0|0,0,0]=2 475 B10R1.15 NCC(O)C1=CC=CN=C1 5727AC [1,1,0,0,0,0|1,0,0]=3 476 B10R1.15 NCC(O)C1=NC=CC=C1 4964AH [1,1,0,0,0,0|1,0,0]=3 477 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 X3539 [1,1,0,0,0,0|0,0,0]=2 478 B10R1.17 BrCCSC1=CC=CC=C1 5534AL [1,1,0,0,0,0|1,0,0]=3 479 B10R1.17 C#CCOC1=CC=CC=C1 3952AD [1,1,0,0,0,0|1,0,1]=4 480 B10R1.17 C=CCSC1=CC=CC=C1 7036AL [1,1,0,0,0,0|1,0,1]=4 481 B10R1.17 C=COCC1=CC=CC=C1 1335AL [1,1,0,0,0,0|1,0,1]=4 482 B10R1.17 CCOCC1=CC=CC=C1 S562 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.17 CNCCC1=CC=NC=C1 5553AE [1,1,0,0,0,0|1,0,0]=3 484 B10R1.17 COCSC1=CC=CC=C1 8208AL [1,1,0,0,0,0|2,0,0]=4 485 B10R1.17 ClCC#CC1=CC=CC=C1 U705 [1,1,0,0,0,0|1,0,1]=4 486 B10R1.17 ClCSCC1=CC=CC=C1 2470AE [1,1,0,0,0,0|1,0,0]=3 487 B10R1.17 NCCCC1=CC=CN=C1 X2118 [1,1,0,0,0,0|1,0,0]=3 488 B10R1.17 NCCCC1=CC=NC=C1 3209AB [1,1,0,0,0,0|1,0,0]=3 489 B10R1.17 NCCOC1=NC=CC=C1 W5199 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.17 NNCCC1=CC=CC=C1 4752AE [1,1,0,0,0,0|0,0,0]=2 491 B10R1.17 OCCNC1=CC=CC=C1 V7623 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.18 CC(Br)CC1=CC=CC=C1 0794AB [1,1,0,0,0,0|1,0,0]=3 493 B10R1.18 CC(N)CC1=CC=CN=C1 V7434 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.18 NC(=O)CC1=CC=CN=C1 4754AB [1,1,0,0,0,0|1,0,1]=4 495 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 4299AL [1,1,0,0,0,0|1,0,1]=4 496 B10R1.18 NC(=O)OC1=CC=CC=C1 7861AF [1,1,0,0,0,0|1,0,1]=4 497 B12R1.1 CC1=CC=C(CCN=C=S)C=C1 3730AD [0,2,0,0,0,0|1,0,1]=4 498 B12R1.1 CCCCCC1=CC=C(Cl)C=C1 9802AE [0,2,0,0,0,0|2,0,0]=4 499 B12R1.1 CCCCCC1=CC=C(I)C=C1 0657AF [0,2,0,0,0,0|2,0,0]=4 500 B12R1.1 COCCOC1=CC=C(N)C=C1 Z4603 [0,2,0,0,0,0|2,0,0]=4 501 B12R1.1 COCCOC1=CC=C(O)C=C1 7293AB [0,2,0,0,0,0|1,0,0]=3 502 B12R1.1 ClC1=CC=C(OCCCBr)C=C1 9050AD [0,2,0,0,0,0|2,0,0]=4 503 B12R1.1 ClCCCSC1=CC=C(Br)C=C1 1124AL [0,2,0,0,0,0|2,0,0]=4 504 B12R1.1 N#CCCOC1=CC=C(Br)C=C1 5650AJ [0,2,0,0,0,0|1,0,1]=4 505 B12R1.1 NCCCOC1=CC=C(Cl)C=C1 4535AE [0,2,0,0,0,0|1,0,0]=3 506 B12R1.1 NCCSCC1=CC=C(F)C=C1 9785AC [0,2,0,0,0,0|1,0,0]=3 507 B12R1.1 OCCOCC1=CC=C(Cl)C=C1 0828AD [0,2,0,0,0,0|2,0,0]=4 508 B12R1.16 CC1=CC=C(C(N)CCO)C=C1 Z3667 [0,2,0,0,0,0|2,0,0]=4 509 B12R1.16 CC1=CC=C(N(C)CCO)C=C1 2784AB [0,2,0,0,0,0|2,0,0]=4 510 B12R1.16 CCCC(=O)C1=CC=C(Br)C=C1 V6195 [0,2,0,0,0,0|2,0,0]=4 511 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 5727AB [0,2,0,0,0,0|2,0,0]=4 512 B12R1.16 CCCC(=O)C1=CC=C(Cl)C=C1 V1725 [0,2,0,0,0,0|2,0,0]=4 513 B12R1.16 CCCC(=O)C1=CC=C(N)C=C1 8631AA [0,2,0,0,0,0|2,0,0]=4 514 B12R1.16 CCC[C@H](N)C1=CC=C(F)C=C1 X9684 [0,2,0,0,0,0|2,0,0]=4 515 B12R1.16 NC(CCO)C1=CC=C(F)C=C1 W7350 [0,2,0,0,0,0|2,0,0]=4 516 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 W9123 [0,2,0,0,0,0|2,0,0]=4 517 B12R1.21 CC(C)COC1=CC=C(N)C=C1 4819AE [0,2,0,0,0,0|2,0,0]=4 518 B12R1.21 CC1=CC=C(CNC(C)C)C=C1 8511AE [0,2,0,0,0,0|2,0,0]=4 519 B12R1.21 CC1=CC=C(CNC(N)=S)C=C1 7823AC [0,2,0,0,0,0|1,0,1]=4 520 B12R1.21 CN(C)CCC1=CC=C(N)C=C1 5530AH [0,2,0,0,0,0|1,0,0]=3 521 B12R1.21 N=C(N)SCC1=CC=C(Cl)C=C1 7680AH [0,2,0,0,0,0|1,0,1]=4 522 B12R1.49 CC1=CC=C(OC(=O)CN)C=C1 X9825 [0,2,0,0,0,0|1,0,1]=4 523 B12R1.49 NC(CO)CC1=CC=C(Cl)C=C1 6147AJ [0,2,0,0,0,0|1,0,0]=3 524 B12R1.49 NC(CO)CC1=CC=C(Cl)C=C1 W5702 [0,2,0,0,0,0|1,0,0]=3 525 B12R1.49 N[C@@H](CO)CC1=CC=C(O)C=C1 5559AB [0,2,0,0,0,0|0,0,0]=2 526 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 6908AB [0,2,0,0,0,0|0,0,0]=2 527 B12R1.49 N\C(CC1=CC=C(Br)C=C1)=N\O 3085AE [0,2,0,0,0,0|1,0,1]=4 528 B12R1.71 CCCCC1=CC=C(C#N)C=C1 6992AD [0,2,0,0,0,0|2,0,0]=4 529 B12R1.71 CCCCC1=CC=C(C=O)C=C1 6440AL [0,2,0,0,0,0|1,0,1]=4 530 B12R1.71 CCCNC1=CC=C(C#N)C=C1 V6078 [0,2,0,0,0,0|2,0,0]=4 531 B12R1.71 CCNCC1=CC=C(OC)C=C1 V4536 [0,2,0,0,0,0|1,0,0]=3 532 B12R1.71 CCNCC1=CC=C(OC)C=C1 V8907 [0,2,0,0,0,0|1,0,0]=3 533 B12R1.71 CNCCC1=CC=C(OC)C=C1 Z3352 [0,2,0,0,0,0|0,0,0]=2 534 B12R1.71 COC1=CC=C(CCC=O)C=C1 0461AB [0,2,0,0,0,0|1,0,0]=3 535 B12R1.71 COC1=CC=C(CCCBr)C=C1 0984AQ [0,2,0,0,0,0|1,0,0]=3 536 B12R1.71 COC1=CC=C(CCCN)C=C1 Z2630 [0,2,0,0,0,0|0,0,0]=2 537 B12R1.71 COC1=CC=C(OCC#N)C=C1 7675AD [0,2,0,0,0,0|0,0,2]=4 538 B12R1.71 COC1=CC=C(OCCBr)C=C1 7812AD [0,2,0,0,0,0|1,0,0]=3 539 B12R1.71 CSC1=CC=C(OCCN)C=C1 3517AA [0,2,0,0,0,0|0,1,0]=3 540 B12R1.71 N#CC1=CC=C(OCCBr)C=C1 V5559 [0,2,0,0,0,0|2,0,0]=4 541 B12R1.71 N#CC1=CC=C(OCCN)C=C1 V7223 [0,2,0,0,0,0|1,0,0]=3 542 B12R1.385 CCCOC1=CC=C(Br)C(C)=C1 Z7469 [0,2,0,0,0,0|2,0,0]=4 543 B12R1.4 COC1=CC=C(NC(N)=S)C=C1 Y8351 [0,2,0,0,0,0|1,0,1]=4 544 B12R1.19 CC1=C(O)C=CC(CC(=O)O)=C1 2940AB [0,2,0,0,0,0|1,0,1]=4 545 B12R1.19 O=C(O)CC1=CC=C(O)C(F)=C1 W6378 [0,2,0,0,0,0|1,0,1]=4 546 B12R1.106 CC(C)(C)OC1=CC=C(O)C=C1 8269AD [0,2,0,0,0,0|2,0,0]=4 547 B12R1.106 FC(F)(F)CC1=CC=C(Br)C=C1 7819AA [0,2,0,0,0,0|2,0,0]=4 548 B12R1.106 FC1=CC=C(CC(F)(F)F)C=C1 4463AE [0,2,0,0,0,0|2,0,0]=4 549 B12R1.233 O=C(O)CC1=CC=C(O)C=C1F W7884 [0,2,0,0,0,0|1,0,1]=4 550 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 7913AD [0,2,0,0,0,0|1,0,0]=3 551 B12R1.9 CC(C)(CO)C1=CC=C(Cl)C=C1 2572AC [0,2,0,0,0,0|2,0,0]=4 552 B12R1.9 CC(C)(CO)C1=CC=C(N)C=C1 W4047 [0,2,0,0,0,0|2,0,0]=4 553 B12R1.367 CCC(N)C1=CC(C)=C(C)C=C1 4088AE [0,2,0,0,0,0|2,0,0]=4 554 B12R1.1703 CCC(=O)C1=C(O)C=C(O)C=C1 Y1973 [0,2,0,0,0,0|1,0,1]=4 555 B12R1.544 CCOC1=C(F)C(F)=C(O)C=C1 5054AA [0,2,0,0,0,0|2,0,0]=4 556 B12R1.113 CCNC1=CC=C(C(=O)O)C=C1 Y9966 [0,2,0,0,0,0|2,0,0]=4 557 B12R1.113 CN(C)C1=CC=C(CCO)C=C1 Z4804 [0,2,0,0,0,0|2,0,0]=4 558 B12R1.113 N#CCC1=CC=C(B(O)O)C=C1 N874 [0,2,0,0,0,0|0,0,2]=4 559 B12R1.113 N#CCC1=CC=C(C(=O)O)C=C1 Y6260 [0,2,0,0,0,0|0,0,2]=4 560 B12R1.113 NCCC1=CC=C([N+](=O)[O-])C=C1 1934AB [0,2,0,0,0,0|0,0,1]=3 561 B12R1.113 OCCC1=CC=C(B(O)O)C=C1 X0518 [0,2,0,0,0,0|1,0,0]=3 562 B12R1.116 CCCC1=CC=C(CCC)C=C1 4636AL [0,2,0,0,0,0|2,0,0]=4 563 B12R1.116 CCOC1=CC=C(CC#N)C=C1 0441AC [0,2,0,0,0,0|0,0,2]=4 564 B12R1.116 CCOC1=CC=C(CCN)C=C1 7005AE [0,2,0,0,0,0|0,0,0]=2 565 B12R1.288 COC1=C(F)C=C(CC#N)C=C1 X2198 [0,2,0,0,0,0|0,0,2]=4 566 B10R2.6 C1=CC=C(C2CC2)C=C1 V8423 [1,0,0,1,0,0|1,0,0]=3 567 B10R2.7 C1=CC2=C(C=C1)COC2 6725AB [1,0,0,1,0,0|2,0,0]=4 568 B10R2.7 C1=CC2=C(N=C1)NCC2 X8780 [1,0,0,1,0,0|1,0,0]=3 569 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 X9385 [0,1,0,1,0,0|1,0,0]=3 570 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 W4543 [0,1,0,1,0,0|1,0,0]=3 571 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 W4477 [0,1,0,1,0,0|2,0,0]=4 572 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 W4639 [0,1,0,1,0,0|2,0,0]=4 573 B12R2.24 BrC1=CC2=C(C=C1)NCCC2 W4577 [0,1,0,1,0,0|2,0,0]=4 574 B12R2.24 BrC1=CC2=C(N=C1)OCCN2 3669AJ [0,1,0,1,0,0|2,0,0]=4 575 B12R2.24 BrC1=CC=C2NCCOC2=C1 X9901 [0,1,0,1,0,0|2,0,0]=4 576 B12R2.24 BrC1=CC=C2OCCNC2=C1 X8770 [0,1,0,1,0,0|1,0,0]=3 577 B12R2.24 CC1=CC2=C(C=C1)CCNC2 W4357 [0,1,0,1,0,0|1,0,0]=3 578 B12R2.24 CC1=CC=C2CNCCC2=C1 6012AH [0,1,0,1,0,0|2,0,0]=4 579 B12R2.24 CC1=CC=C2NCCOC2=C1 V7446 [0,1,0,1,0,0|2,0,0]=4 580 B12R2.24 CC1=NC2=C(C=C1)CCCN2 Y8529 [0,1,0,1,0,0|2,0,0]=4 581 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 1343AC [0,1,0,1,0,0|1,0,0]=3 582 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 X4674 [0,1,0,1,0,0|1,0,0]=3 583 B12R2.24 ClC1=CC2=C(C=C1)CNCC2 3925AB [0,1,0,1,0,0|2,0,0]=4 584 B12R2.24 ClC1=CC2=C(C=C1)CNCC2 W5519 [0,1,0,1,0,0|2,0,0]=4 585 B12R2.24 ClC1=CC=C2CCCNC2=C1 5077AC [0,1,0,1,0,0|1,0,0]=3 586 B12R2.24 ClC1=CC=C2NCCOC2=C1 X9067 [0,1,0,1,0,0|2,0,0]=4 587 B12R2.24 FC1=CC2=C(C=C1)CNCC2 2484AC [0,1,0,1,0,0|2,0,0]=4 588 B12R2.24 FC1=CC2=C(C=C1)NCCO2 5699AE [0,1,0,1,0,0|2,0,0]=4 589 B12R2.24 NC1=CC2=C(C=C1)CCNC2 4601AH [0,1,0,1,0,0|1,0,0]=3 590 B12R2.24 NC1=CC2=C(C=C1)CCNC2 9210AA [0,1,0,1,0,0|1,0,0]=3 591 B12R2.24 NC1=CC=C2CCCCC2=C1 X6988 [0,1,0,1,0,0|2,0,0]=4 592 B12R2.24 OC1=CC2=C(C=C1)CNCC2 W7258 [0,1,0,1,0,0|1,0,0]=3 593 B12R2.24 OC1=CC=C2OCCOC2=C1 X8632 [0,1,0,1,0,0|1,0,0]=3 594 B12R2.132 NC1=CC2=C(C=C1)CCC2=O S967 [0,1,0,1,0,0|2,0,0]=4 595 B12R2.294 IC1=CC=C(OC2CC2)C=C1 4594AA [0,1,0,1,0,0|2,0,0]=4 596 B12R2.2302 FC1=CC=C(C2CNC2)C=C1 2234AL [0,1,0,1,0,0|1,0,0]=3 597 B12R2.606 CC1=CC2=C(C=C(O)C=C2)N1 7904AB [0,1,0,1,0,0|0,0,2]=4 598 B12R2.606 CC1=CC2=C(C=C1)CC(=O)N2 W7006 [0,1,0,1,0,0|1,0,1]=4 599 B12R2.606 CC1=NC2=C(C=C(O)C=C2)N1 5686AB [0,1,0,1,0,0|1,0,1]=4 600 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 Z4195 [0,1,0,1,0,0|1,0,1]=4 601 B12R2.606 NC1=NC2=CC(O)=CC=C2S1 Y5222 [0,1,0,1,0,0|1,0,1]=4 602 B12R2.606 O=C1CC2=C(C=C(O)C=C2)N1 Y9822 [0,1,0,1,0,0|0,0,1]=3 603 B12R2.606 OC1CC2=C(C=C(Br)C=C2)C1 W8856 [0,1,0,1,0,0|2,0,0]=4 604 B12R2.290 CC1=CC=C(C2(N)CC2)C=C1 9971AH [0,1,0,1,0,0|2,0,0]=4 605 B12R2.290 NC1(C2=CC=C(Br)C=C2)CC1 9464AH [0,1,0,1,0,0|2,0,0]=4 606 B12R2.290 NC1(C2=CC=C(Cl)C=C2)CC1 Z6326 [0,1,0,1,0,0|2,0,0]=4 607 B12R2.290 NC1(C2=CC=C(F)C=C2)CC1 X2091 [0,1,0,1,0,0|2,0,0]=4 608 B12R2.612 NC1CCC2=CC(Br)=CC=C21 3110AJ [0,1,0,1,0,0|2,0,0]=4 609 B12R2.246 ClC1=CC2=C(CCN2)C(Cl)=C1 3680AA [0,1,0,1,0,0|1,0,0]=3 610 B12R2.9 O=CC1=CC=C(C2CC2)C=C1 9503AJ [0,1,0,1,0,0|1,0,1]=4 611 B12R2.44 COC1=CC2=C(C=C1)CCN2 V2361 [0,1,0,1,0,0|0,0,0]=2 612 B12R2.44 COC1=CC2=C(C=C1)CNC2 X9691 [0,1,0,1,0,0|2,0,0]=4 613 B12R2.44 COC1=CC2=C(C=C1)CNC2 Z3916 [0,1,0,1,0,0|2,0,0]=4 614 B12R2.44 COC1=CC=C2C=NNC2=C1 L862 [0,1,0,1,0,0|1,0,1]=4 615 B12R2.44 NNC1=CC2=C(C=C1)CCC2 0066AD [0,1,0,1,0,0|2,0,0]=4 616 B12R2.44 O=CC1=CC2=C(C=C1)CCC2 3119AB [0,1,0,1,0,0|1,0,1]=4 617 B12R2.44 OCC1=CC2=C(C=C1)C=NN2 Y5655 [0,1,0,1,0,0|1,0,1]=4 618 B12R2.100 FC1=CC2=C(C=C1F)NCC2 W9745 [0,1,0,1,0,0|1,0,0]=3 619 B12R2.100 OC1=CC2=C(C=C1O)NC=C2 Z1653 [0,1,0,1,0,0|0,0,2]=4 620 B8R1.1 NCC1=CC=C(Br)S1 Z6237 [1,0,0,0,1,0|2,0,0]=4 621 B8R1.8 NCCC1=CN=CN1 Y9749 [1,0,0,0,1,0|2,0,0]=4 622 B8R1.8 NCCC1=CSC=C1 Y8818 [1,0,0,0,1,0|1,0,0]=3 623 B8R1.8 NCCC1=NC=CS1 Y1661 [1,0,0,0,1,0|2,0,0]=4 624 B8R1.8 NCCC1=NC=CS1 Y8064 [1,0,0,0,1,0|2,0,0]=4 625 B8R1.8 NCCN1C=CN=C1 V2457 [1,0,0,0,1,0|2,0,0]=4