0 B9R1.3 CC1=C(N)C(N)=CC=C1 BB12-3003 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.3 CC1=C(N)C=CC=C1Cl BB01-7502 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.3 CC1=CC=CC(N)=C1O BB55-6937 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.3 NC1=C(O)C(Cl)=CC=C1 BB12-1563 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.3 NC1=C(O)C(Cl)=NC=N1 BB32-1716 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.3 NC1=C(S)C=CC=C1Cl BB58-3419 [0,0,0,0,0,0|3,1,0]=4 6 B9R1.3 NC1=CC=CC(Cl)=C1N BB54-5122 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.3 NC1=CC=CC(N)=C1N BB54-2647 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.4 BrC1=CC(I)=CC=N1 BB54-2251 [1,0,0,0,0,0|3,0,0]=4 9 B8R1.4 BrC1=CC=NC(Br)=C1 BB54-2256 [1,0,0,0,0,0|3,0,0]=4 10 B8R1.4 CC1=NC(Cl)=CC=N1 BB58-3773 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.4 CC1=NC=CC(N)=C1 BB54-4750 [1,0,0,0,0,0|2,0,0]=3 12 B8R1.4 ClC1=CC=NC(Cl)=C1 BB54-2258 [1,0,0,0,0,0|3,0,0]=4 13 B8R1.4 FC1=CC=NC(Cl)=C1 BB54-2257 [1,0,0,0,0,0|3,0,0]=4 14 B8R1.5 CC1=C(N)C=CN=C1 BB54-4818 [1,0,0,0,0,0|3,0,0]=4 15 B8R1.5 CC1=NC=CC=C1O BB17-0195 [1,0,0,0,0,0|1,0,0]=2 16 B8R1.5 CC1=NC=CN=C1Br BB55-8855 [1,0,0,0,0,0|3,0,0]=4 17 B8R1.5 C[N+]1=C(Cl)C=CC=C1 BB57-2946 [1,0,0,0,0,0|3,0,0]=4 18 B8R1.5 ClC1=C(I)C=CC=N1 BB54-2259 [1,0,0,0,0,0|3,0,0]=4 19 B8R1.5 NC1=C(Br)C=CC=N1 BB54-2201 [1,0,0,0,0,0|3,0,0]=4 20 B8R1.5 NC1=C(Br)C=NC=C1 BB54-4293 [1,0,0,0,0,0|3,0,0]=4 21 B8R1.5 NC1=C(O)N=CC=C1 BB12-2900 [1,0,0,0,0,0|3,0,0]=4 22 B8R1.5 NC1=CC=CNC1=O BB54-0381 [1,0,0,0,0,0|3,0,0]=4 23 B8R1.5 OC1=C(I)C=CN=C1 BB20-3208 [1,0,0,0,0,0|2,0,0]=3 24 B8R1.5 OC1=CC=CN=C1Br BB12-1811 [1,0,0,0,0,0|2,0,0]=3 25 B10R1.2 CC1=C(C)C(NN)=CC=C1 BB01-6537 [0,1,0,0,0,0|3,0,0]=4 26 B10R1.2 CC1=C(C)C(NN)=CC=C1 BB56-2527 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.2 CN1C=CC=C(C=O)C1=O BB58-0319 [0,1,0,0,0,0|2,0,1]=4 28 B10R1.2 COC1=C(C)C(C)=CC=C1 BB12-4726 [0,1,0,0,0,0|2,0,1]=4 29 B10R1.2 O=CC1=CC=CC(F)=C1O BB01-7911 [0,1,0,0,0,0|2,0,0]=3 30 B10R1.22 CC1=C(Br)C(=O)NC(=O)N1 BB57-3608 [0,1,0,0,0,0|3,0,0]=4 31 B10R1.22 CC1=C(N)C(Br)=CC(N)=C1 BB17-2060 [0,1,0,0,0,0|3,0,0]=4 32 B10R1.22 CC1=CC(=O)N(N)C(C)=C1 BB05-1512 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.22 CC1=CC(Br)=CC(C)=C1N BB54-0492 [0,1,0,0,0,0|3,0,0]=4 34 B10R1.22 CC1=CC(Br)=CC(C)=C1O BB17-2769 [0,1,0,0,0,0|2,0,0]=3 35 B10R1.22 CC1=CC(C)=C(N)C(=O)N1 BB54-0121 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.22 CC1=CC(C)=C(N)C(N)=C1 BB57-2918 [0,1,0,0,0,0|3,0,0]=4 37 B10R1.22 CC1=CC(Cl)=CC(N)=C1N BB12-1718 [0,1,0,0,0,0|3,0,0]=4 38 B10R1.22 CC1=CC(F)=CC(Cl)=C1N BB32-1890 [0,1,0,0,0,0|3,0,0]=4 39 B10R1.22 CC1=CC(N)=C(O)C(C)=C1 BB57-6513 [0,1,0,0,0,0|2,0,0]=3 40 B10R1.22 CC1=CC(N)=CC(Br)=C1O BB17-0893 [0,1,0,0,0,0|2,0,0]=3 41 B10R1.22 CC1=CC(N)=CC(C)=C1O BB55-4899 [0,1,0,0,0,0|2,0,0]=3 42 B10R1.22 CC1=CC(N)=CC(N)=C1C BB17-1834 [0,1,0,0,0,0|3,0,0]=4 43 B10R1.22 CC1=CC(O)=CC(C)=C1N BB57-6336 [0,1,0,0,0,0|3,0,0]=4 44 B10R1.22 CC1=NC(O)=CC(C)=C1N BB58-3636 [0,1,0,0,0,0|3,0,0]=4 45 B10R1.22 NC1=CC(Cl)=CC(Cl)=C1O BB12-2895 [0,1,0,0,0,0|3,0,0]=4 46 B10R1.119 CC1=C(C)C(O)=C(N)C=C1 BB55-6938 [0,1,0,0,0,0|2,0,0]=3 47 B10R1.119 CC1=C(Cl)C(N)=CC=C1Cl BB55-4792 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.119 CC1=C(N)C=CC(Br)=C1C BB57-1072 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.119 CC1=CC=C(N)C(N)=C1C BB12-2656 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.245 CC1=CC=CC(C)=C1NN BB54-0301 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.245 CC1=CC=CC(C)=C1NN BB56-0064 [0,1,0,0,0,0|3,0,0]=4 52 B10R1.245 COC1=C(C)NC=CC1=O BB58-0783 [0,1,0,0,0,0|1,0,0]=2 53 B10R1.245 COC1=C(C)OC=CC1=O BB58-0781 [0,1,0,0,0,0|0,0,0]=1 54 B10R1.245 COC1=C(Cl)C=CN=C1C BB58-0786 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.245 COC1=C(N)C=CC=C1Cl BB54-2443 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.245 COC1=C(N)C=CN=C1C BB17-0194 [0,1,0,0,0,0|2,0,0]=3 57 B10R1.245 CSC1=C(C)C=CC=C1O BB57-5597 [0,1,0,0,0,0|1,1,1]=4 58 B10R1.245 [C-]#[N+]C1=C(C)C=CC=C1C BB56-1199 [0,1,0,0,0,0|3,0,0]=4 59 B8R1.50 CC1=C(Br)C(O)=NO1 BB57-3977 [0,0,0,0,1,0|2,0,1]=4 60 B8R1.50 CC1=NNC(C)=C1O BB57-3410 [0,0,0,0,1,0|3,0,0]=4 61 B8R1.50 CC1=NOC(C)=C1Cl BB55-4174 [0,0,0,0,1,0|3,0,0]=4 62 B8R1.50 CC1=NOC(C)=C1N BB05-2978 [0,0,0,0,1,0|3,0,0]=4 63 B7R1.3 CC1=CC=NC=N1 BB17-0193 [2,0,0,0,0,0|2,0,0]=4 64 B9R1.2 CC1=CC(NN)=CC=C1 BB56-2532 [1,1,0,0,0,0|2,0,0]=4 65 B9R1.2 CNC1=CC(C)=CC=C1 BB01-7304 [1,1,0,0,0,0|2,0,0]=4 66 B9R1.2 CNC1=CC(F)=CC=C1 BB01-7291 [1,1,0,0,0,0|2,0,0]=4 67 B9R1.2 NCC1=CC=CC(Cl)=C1 BB01-4636 [1,1,0,0,0,0|2,0,0]=4 68 B9R1.69 CC1=CC(=O)C(O)=CN1 BB26-0805 [1,1,0,0,0,0|1,0,0]=3 69 B9R1.69 CC1=CC(=O)C(O)=CO1 BB26-0385 [1,1,0,0,0,0|0,0,0]=2 70 B9R1.69 CC1=CC=C(N)C(N)=C1 BB56-0557 [1,1,0,0,0,0|2,0,0]=4 71 B9R1.69 CC1=CC=C(N)C(S)=C1 BB17-0861 [1,1,0,0,0,0|1,1,0]=4 72 B9R1.69 CC1=CN=C(C)C=C1N BB32-1073 [1,1,0,0,0,0|2,0,0]=4 73 B9R1.15 CC1=C(CBr)N=CC=C1 BB05-1496 [1,1,0,0,0,0|2,0,0]=4 74 B9R1.15 CC1=NC=CC=C1CCl BB57-4147 [1,1,0,0,0,0|2,0,0]=4 75 B9R1.15 CNC1=C(C)C=CC=C1 BB01-7286 [1,1,0,0,0,0|2,0,0]=4 76 B9R1.15 CNC1=CC=CC=C1N BB12-2750 [1,1,0,0,0,0|2,0,0]=4 77 B9R1.15 CNC1=NC=CC=C1Cl BB12-1745 [1,1,0,0,0,0|2,0,0]=4 78 B9R1.15 COC1=CC=CN=C1C BB17-0165 [1,1,0,0,0,0|1,0,0]=3 79 B9R1.15 CSC1=NC=CC=C1N BB58-0115 [1,1,0,0,0,0|2,0,0]=4 80 B9R1.15 O=CC1=C(O)C=CN=C1 BB31-4787 [1,1,0,0,0,0|2,0,0]=4 81 B9R1.15 OCC1=CC=CN=C1Cl BB12-3681 [1,1,0,0,0,0|2,0,0]=4 82 B9R1.132 CC1=CNC(C=O)=C1C BB01-5084 [0,1,0,0,1,0|2,0,0]=4 83 B11R1.8 CC1=CC(=O)C(O)=C(CO)O1 BB26-0388 [0,2,0,0,0,0|0,0,0]=2 84 B11R1.8 CC1=CC(Br)=CC(C=O)=C1O BB17-1050 [0,2,0,0,0,0|1,0,0]=3 85 B11R1.8 CC1=CC(Br)=CC(CO)=C1O BB17-1051 [0,2,0,0,0,0|1,0,1]=4 86 B11R1.8 CC1=CC(C=O)=C(O)C(Br)=C1 BB17-1086 [0,2,0,0,0,0|2,0,0]=4 87 B11R1.8 CC1=CC(I)=CC(C=O)=C1O BB17-1054 [0,2,0,0,0,0|1,0,0]=3 88 B11R1.8 CC1=CC(I)=CC(CO)=C1O BB17-1055 [0,2,0,0,0,0|1,0,1]=4 89 B11R1.8 CC1=CC(N)=CC(CO)=C1O BB17-1071 [0,2,0,0,0,0|1,0,1]=4 90 B11R1.8 COC1=C(O)C(Br)=CC(Br)=C1 BB17-1853 [0,2,0,0,0,0|2,0,0]=4 91 B11R1.8 O=CC1=C(O)C(Cl)=CC(Cl)=C1 BB17-1073 [0,2,0,0,0,0|2,0,0]=4 92 B11R1.8 O=CC1=C(O)C(I)=CC(Br)=C1 BB17-1085 [0,2,0,0,0,0|2,0,0]=4 93 B11R1.8 O=CC1=CC(I)=CC(I)=C1O BB20-6927 [0,2,0,0,0,0|2,0,0]=4 94 B11R1.8 OCC1=C(O)C(Cl)=CC(Cl)=C1 BB17-1072 [0,2,0,0,0,0|2,0,0]=4 95 B11R1.159 NC1=C(O)C(C(=O)O)=CC=C1 BB54-0431 [0,2,0,0,0,0|2,0,0]=4 96 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 BB12-4608 [0,2,0,0,0,0|2,0,0]=4 97 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 BB12-4662 [0,2,0,0,0,0|2,0,0]=4 98 B11R1.267 CCC1=CC=CC(CC)=C1O BB12-1897 [0,2,0,0,0,0|2,0,0]=4 99 B11R1.14 CC1=CC(CO)=CC(C)=C1O BB55-8695 [0,2,0,0,0,0|2,0,0]=4 100 B11R1.464 COC1=C(C)C=C(Br)C=C1Br BB17-0672 [0,2,0,0,0,0|2,0,0]=4 101 B11R1.464 COC1=C(C)C=C(N)C=C1C BB54-2247 [0,2,0,0,0,0|2,0,0]=4 102 B9R1.41 CC1=C(C(=O)O)N=CO1 BB57-4109 [0,0,1,1,0,0|2,0,0]=4 103 B9R1.1 CC1=CN=C(C=O)C=C1 BB12-2174 [0,0,1,1,0,0|2,0,0]=4 104 B9R1.1 CC1=CN=C(C=O)C=N1 BB58-1329 [0,0,1,1,0,0|2,0,0]=4 105 B7R1.2 CC1=CC(C)=NO1 BB01-6357 [1,0,0,0,1,0|2,0,0]=4 106 B7R1.2 CC1=CC=C(N)S1 BB55-4553 [1,0,0,0,1,0|2,0,0]=4 107 B7R1.2 NC1=CC(=O)NO1 BB54-5766 [1,0,0,0,1,0|2,0,0]=4