0 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 BB12-2243 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.166 NC1=C(C(=O)O)C=NC(=S)N1 BB52-2194 [0,0,0,0,0,0|3,1,0]=4 2 B11R1.166 NC1=C(C(=O)O)C=NC(O)=N1 BB12-4164 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.166 NC1=CC(Br)=C(C(=O)O)C=C1 BB17-0728 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.166 NC1=NC(S)=NC=C1C(=O)O BB52-6462 [0,0,0,0,0,0|3,1,0]=4 5 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 BB20-4599 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 BB12-2552 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.166 O=C(O)C1=C(O)C=C(O)N=C1 BB12-2178 [0,0,0,0,0,0|1,0,0]=1 8 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl BB12-2212 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.13 CC(O)C1=CC=C(N)C=C1 BB12-2291 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.13 CC1=CC=C(C(=N)N)C=C1 BB20-3270 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BB01-7654 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.13 O=C(O)C1=CC=C(O)C=N1 BB56-1848 [1,0,0,0,0,0|1,0,0]=2 14 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BB26-0398 [1,0,0,0,0,0|1,0,1]=3 15 B10R1.13 O=C1C=CC(C(=O)O)=NN1 BB12-2030 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.25 NCC1=CC=C(O)C=C1O BB12-1397 [1,0,0,0,0,0|1,0,1]=3 17 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 BB56-1846 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 BB56-1915 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.25 O=CC1=C(O)C=C(F)C=C1 BB20-3279 [1,0,0,0,0,0|1,0,0]=2 20 B10R1.61 NC1=C(C(=O)O)C=CN=C1 BB12-1728 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 BB12-3503 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.61 O=C(O)C1=CN=CNC1=O BB10-0517 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.61 O=[N+]([O-])C1=NC=CC=C1O BB01-6547 [1,0,0,0,0,0|2,0,1]=4 24 B12R1.232 CC(=O)C1=CC(F)=C(F)C=C1F BB12-2273 [0,1,0,0,0,0|3,0,0]=4 25 B12R1.232 CC1=CC(O)=C(C(=O)O)C=C1C BB12-4724 [0,1,0,0,0,0|1,0,0]=2 26 B12R1.232 NC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 BB12-4680 [0,1,0,0,0,0|2,0,0]=3 27 B12R1.893 CC1=C(C)C(O)=C(C(=O)O)C=C1 BB17-0815 [0,1,0,0,0,0|1,0,0]=2 28 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Cl)C=C1 BB12-2254 [0,1,0,0,0,0|3,0,0]=4 29 B12R1.1703 COC(=O)C1=C(Br)C=C(N)C=C1 BB17-0727 [0,1,0,0,0,0|2,0,0]=3 30 B12R1.1703 COC(=O)C1=C(O)N=C(C)N=C1 BB12-4464 [0,1,0,0,0,0|3,0,0]=4 31 B12R1.1703 NNC(=O)C1=C(O)C=C(O)C=C1 BB12-2197 [0,1,0,0,0,0|1,0,0]=2 32 B12R2.612 O=C1COC2=CC(O)=CC=C12 BB26-0144 [0,0,0,1,0,0|1,0,0]=2 33 B12R1.233 CC(=O)NC1=C(N)C=C(Br)C=C1 BB12-1697 [0,0,0,0,0,1|3,0,0]=4 34 B12R1.233 CC(=O)NC1=C(N)C=C(C)C=C1 BB12-1696 [0,0,0,0,0,1|3,0,0]=4 35 B12R1.233 CC(=O)NC1=CC=C(C)C=C1O BB12-2649 [0,0,0,0,0,1|2,0,0]=3 36 B12R1.233 CC(=O)NC1=CC=C(N)C=C1Cl BB12-4714 [0,0,0,0,0,1|3,0,0]=4 37 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1F BB56-2547 [0,0,0,0,0,1|2,0,0]=3 38 B12R1.233 O=C(O)CC1=CC=C(F)C=C1Cl BB56-2649 [0,0,0,0,0,1|2,0,0]=3 39 B9R1.1 CC1=CN=C(C=O)C=C1 BB12-2174 [2,0,0,0,0,0|2,0,0]=4 40 B9R1.1 NCC1=CC=C(O)C=C1 BB12-1603 [2,0,0,0,0,0|1,0,1]=4 41 B9R1.15 O=CC1=CC=CN=C1Br BB56-0225 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.69 NC1=CC=C(F)C=C1O BB12-2894 [2,0,0,0,0,0|2,0,0]=4 43 B9R1.69 OC1=CC=C(F)C(Cl)=C1 BB12-4695 [2,0,0,0,0,0|2,0,0]=4 44 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 BB12-1599 [1,1,0,0,0,0|1,0,1]=4 45 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 BB53-1358 [1,1,0,0,0,0|2,0,0]=4 46 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 BB12-2672 [1,1,0,0,0,0|2,0,0]=4 47 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 BB56-2538 [1,1,0,0,0,0|1,0,0]=3 48 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 BB12-3514 [1,1,0,0,0,0|2,0,0]=4 49 B11R1.3 OCC1=CC=C(B(O)O)C=C1 BB12-2258 [1,1,0,0,0,0|1,0,1]=4 50 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 BB12-2899 [1,1,0,0,0,0|1,0,0]=3 51 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 BB12-4696 [1,1,0,0,0,0|1,0,0]=3 52 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 BB53-4156 [1,1,0,0,0,0|2,0,0]=4 53 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 BB12-2577 [1,1,0,0,0,0|2,0,0]=4 54 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 BB17-2353 [1,1,0,0,0,0|2,0,0]=4 55 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 BB12-1843 [1,1,0,0,0,0|2,0,0]=4 56 B11R1.22 COC(=O)C1=CC=C(O)C=N1 BB56-2624 [1,1,0,0,0,0|1,0,0]=3 57 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 BB26-0169 [1,1,0,0,0,0|2,0,0]=4 58 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 BB12-2695 [1,1,0,0,0,0|2,0,0]=4 59 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 BB17-2382 [1,1,0,0,0,0|2,0,0]=4 60 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 BB01-6328 [1,1,0,0,0,0|2,0,0]=4 61 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 BB53-4155 [1,1,0,0,0,0|2,0,0]=4 62 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 BB20-3112 [1,1,0,0,0,0|2,0,0]=4 63 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 BB01-6260 [1,1,0,0,0,0|2,0,0]=4 64 B11R1.81 CC1=CC(C)=C(\C=N\O)C=C1 BB20-3236 [1,1,0,0,0,0|2,0,0]=4 65 B11R1.277 CC1=CC(O)=C(C=O)C=C1Br BB17-1091 [1,1,0,0,0,0|1,0,0]=3 66 B11R1.277 O=CC1=CC(O)=C(Br)C=C1Br BB17-2302 [1,1,0,0,0,0|2,0,0]=4 67 B11R1.464 CC1=CC(O)=CC(O)=C1C=O BB17-2252 [1,1,0,0,0,0|0,0,0]=2 68 B11R1.53 CNC1=NC=CC=C1C(=O)O BB12-3552 [1,1,0,0,0,0|2,0,0]=4 69 B11R1.53 NCC1=C(C(N)=O)C=CC=C1 BB12-1453 [1,1,0,0,0,0|2,0,0]=4 70 B11R1.53 NNC1=CC=CC=C1C(=O)O BB12-2554 [1,1,0,0,0,0|1,0,0]=3 71 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Br BB20-4624 [1,1,0,0,0,0|1,0,0]=3 72 B11R1.159 CN1C=CC=C(C(=O)O)C1=O BB12-3383 [1,1,0,0,0,0|1,0,1]=4 73 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 BB12-4608 [1,1,0,0,0,0|0,0,0]=2 74 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 BB12-4662 [1,1,0,0,0,0|0,0,0]=2 75 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 BB53-1900 [1,1,0,0,0,0|1,0,0]=3 76 B11R1.167 CC(O)C1=C(O)C=CC(Br)=C1 BB53-1844 [1,1,0,0,0,0|1,0,1]=4 77 B11R1.167 NC(=O)C1=C(Br)C=CC(I)=C1 BB17-0460 [1,1,0,0,0,0|2,0,0]=4 78 B11R1.167 NC(=O)C1=C(Cl)C=CC(Br)=C1 BB17-0366 [1,1,0,0,0,0|2,0,0]=4 79 B11R1.222 CC1=C(\C(N)=N\O)C=CC=C1 BB12-3478 [1,1,0,0,0,0|2,0,0]=4 80 B11R1.222 COC(=O)C1=C(O)N=CN=C1 BB12-4463 [1,1,0,0,0,0|2,0,0]=4 81 B11R1.222 COC(=O)C1=C(S)C=CC=C1 BB12-1508 [1,1,0,0,0,0|0,1,0]=3 82 B11R1.222 COC(=O)C1=NC=CC=C1O BB17-0205 [1,1,0,0,0,0|1,0,0]=3 83 B11R1.222 N\C(=N/O)C1=CC=CC=C1F BB10-0059 [1,1,0,0,0,0|2,0,0]=4 84 B13R1.51 COC1=C(NC(C)=O)C=CC(Br)=C1 BB12-5052 [0,1,0,0,0,1|2,0,0]=4 85 B13R1.51 COC1=CC(N)=CC=C1NC(C)=O BB12-4711 [0,1,0,0,0,1|2,0,0]=4 86 B13R1.163 CC1=CC=C(C(N)C(=O)O)C(C)=C1 BB56-0186 [0,1,0,0,0,1|2,0,0]=4 87 B13R1.653 COC1=CC(Br)=C(CC(=O)O)C=C1 BB56-1063 [0,1,0,0,0,1|1,0,0]=3 88 B13R1.876 CC1=CC(C)=C(C)C=C1CC(=O)O BB56-2602 [0,1,0,0,0,1|2,0,0]=4 89 B13R1.2808 CC1=CC(C)=C(CC(=O)O)C(C)=C1 BB56-0553 [0,1,0,0,0,1|2,0,0]=4 90 B13R1.652 COC1=CN(C)C(C(=O)O)=CC1=O BB26-0366 [0,2,0,0,0,0|2,0,0]=4 91 B13R1.2811 CC1=C(C)C(O)=C(C(=O)O)C=C1Br BB17-2157 [0,2,0,0,0,0|1,0,0]=3 92 B13R1.2811 CC1=CC(C(=O)O)=C(O)C(N)=C1C BB17-0689 [0,2,0,0,0,0|1,0,0]=3 93 B13R1.2811 NC1=C(Cl)C(N)=C(Cl)C(C(=O)O)=C1 BB12-4679 [0,2,0,0,0,0|2,0,0]=4 94 B13R1.3230 CC1=C(C#N)C(O)=NC=C1C(=O)O BB12-4437 [0,2,0,0,0,0|2,0,0]=4 95 B13R1.1511 CCOC(=O)C1=C(O)C=C(O)N=C1 BB12-2179 [0,2,0,0,0,0|1,0,0]=3 96 B13R2.3683 CC1=CC=C2NC(=O)COC2=C1 BB10-0258 [0,0,0,1,0,1|2,0,0]=4 97 B13R2.3683 O=C1COC2=CC(Cl)=CC=C2N1 BB10-0256 [0,0,0,1,0,1|2,0,0]=4 98 B13R2.5187 O=C1OC(=O)C2=CC(F)=CC=C12 BB56-2046 [0,1,0,1,0,0|1,0,1]=4 99 B13R2.2130 COC1=CC=C2C(=O)COC2=C1 BB12-2913 [0,1,0,1,0,0|1,0,0]=3 100 B13R2.11642 O=C1COC2=CC(O)=CC(O)=C12 BB26-0241 [0,1,0,1,0,0|0,0,0]=2 101 B9R1.41 NC1=C(C(=O)O)SC=C1 BB53-1404 [1,0,0,0,1,0|2,0,0]=4 102 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 BB12-3713 [1,0,0,0,0,1|2,0,0]=4 103 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 BB12-3000 [1,0,0,0,0,1|2,0,0]=4 104 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [1,0,0,0,0,1|1,0,0]=3 105 B11R1.86 CC(=O)NC1=CC=CC=C1S BB12-2835 [1,0,0,0,0,1|1,1,0]=4 106 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 BB10-1202 [0,0,0,0,1,1|1,0,0]=3 107 B13R1.164 CC1=CC(Br)=C(\C=C\C(=O)O)C=C1 BB56-1347 [0,0,0,0,0,2|2,0,0]=4