0 B10R1.22 CC1=C(N)C(Br)=CC(N)=C1 BB17-2060 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.22 CC1=CC(Br)=CC(C)=C1O BB17-2769 [0,0,0,0,0,0|1,0,0]=1 2 B10R1.22 CC1=CC(Cl)=CC(N)=C1N BB12-1718 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.22 CC1=CC(N)=C(N)C(Br)=C1 BB17-2458 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.22 CC1=CC(N)=C(N)C(Cl)=C1 BB17-2762 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.22 CC1=CC(N)=CC(Br)=C1O BB17-0893 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.22 CC1=CC(N)=CC(N)=C1C BB17-1834 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.22 NC1=C(Br)C=C(Br)C=C1Br BB12-3102 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.22 NC1=C(Cl)C=C(Br)C=C1Br BB17-0601 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.22 NC1=C(F)C=C(Br)C=C1Br BB12-1455 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.22 NC1=C(N)C(Br)=CC(Br)=C1 BB17-2721 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.22 NC1=C(N)C(Br)=CC(Cl)=C1 BB17-2731 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.22 NC1=C(N)C(Cl)=CC(Br)=C1 BB12-4668 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.22 NC1=CC(Br)=C(N)C(Br)=C1 BB17-0534 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.22 NC1=CC(Cl)=CC(Cl)=C1O BB12-2895 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.3 CC1=C(N)C(N)=CC=C1 BB12-3003 [1,0,0,0,0,0|2,0,0]=3 16 B9R1.3 NC1=C(O)C(Cl)=CC=C1 BB12-1563 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.34 CC1=CC(C)=NC(S)=N1 BB12-2677 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.34 CC1=NC(C)=NC(O)=C1 BB12-0059 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.34 ClC1=CC(Cl)=CC(I)=C1 BB20-4731 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.69 CC1=CC(=O)C(O)=CN1 BB26-0805 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.69 CC1=CC(=O)C(O)=CO1 BB26-0385 [1,0,0,0,0,0|2,0,0]=3 22 B9R1.69 CC1=CC=C(N)C(N)=C1 BB56-0557 [1,0,0,0,0,0|2,0,0]=3 23 B9R1.69 CC1=CC=C(N)C(S)=C1 BB17-0861 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.69 NC1=CC=C(F)C=C1N BB12-3004 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.69 NC1=CC=C(F)C=C1O BB12-2894 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.69 NC1=CC=C(F)C=C1S BB17-0700 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.69 OC1=CC=C(F)C(Cl)=C1 BB12-4695 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.69 OC1=NC=C(I)C=C1I BB56-0642 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.8 CC1=CC(=O)C(O)=C(CO)O1 BB26-0388 [0,1,0,0,0,0|2,0,0]=3 30 B11R1.8 CC1=CC(Br)=CC(C=O)=C1O BB17-1050 [0,1,0,0,0,0|1,0,1]=3 31 B11R1.8 CC1=CC(Br)=CC(CO)=C1O BB17-1051 [0,1,0,0,0,0|1,0,0]=2 32 B11R1.8 CC1=CC(C=O)=C(O)C(Br)=C1 BB17-1086 [0,1,0,0,0,0|1,0,1]=3 33 B11R1.8 CC1=CC(I)=CC(C=O)=C1O BB17-1054 [0,1,0,0,0,0|1,0,1]=3 34 B11R1.8 CC1=CC(I)=CC(CO)=C1O BB17-1055 [0,1,0,0,0,0|1,0,0]=2 35 B11R1.8 CC1=CC(N)=CC(CO)=C1O BB17-1071 [0,1,0,0,0,0|1,0,0]=2 36 B11R1.8 COC1=C(O)C(Br)=CC(Br)=C1 BB17-1853 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.8 O=CC1=C(O)C(Cl)=CC(Cl)=C1 BB17-1073 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.8 OCC1=C(O)C(Cl)=CC(Cl)=C1 BB17-1072 [0,1,0,0,0,0|2,0,0]=3 39 B11R1.14 CCC1=CC(N)=C(O)C(Br)=C1 BB17-0378 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.14 COC1=CC(N)=C(N)C(Br)=C1 BB17-2184 [0,1,0,0,0,0|3,0,0]=4 41 B11R1.14 O=CC1=CC(Br)=C(O)C(Br)=C1 BB12-2867 [0,1,0,0,0,0|2,0,1]=4 42 B11R1.14 O=CC1=CC(Br)=C(O)C(Cl)=C1 BB17-1454 [0,1,0,0,0,0|2,0,1]=4 43 B11R1.32 CC1=C(N)C(Br)=C(N)C(Br)=C1 BB17-2686 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.32 CC1=CC(O)=C(N)C(C)=C1Cl BB17-0383 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.464 CC1=CC(C)=C(C#N)C(=S)N1 BB12-1863 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.464 CC1=CC(C)=C(C#N)C(Cl)=C1 BB20-3162 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.464 CC1=CC(C)=C(NN)C(C)=C1 BB56-0330 [0,1,0,0,0,0|1,0,0]=2 48 B11R1.464 CC1=CC(O)=CC(O)=C1C=O BB17-2252 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.464 COC1=C(C)C=C(Br)C=C1Br BB17-0672 [0,1,0,0,0,0|2,0,0]=3 50 B8R1.5 CC1=NC=CC=C1O BB17-0195 [2,0,0,0,0,0|1,0,0]=3 51 B8R1.5 NC1=C(O)N=CC=C1 BB12-2900 [2,0,0,0,0,0|2,0,0]=4 52 B8R1.5 OC1=CC=CN=C1Br BB12-1811 [2,0,0,0,0,0|2,0,0]=4 53 B8R1.3 CC1=CN=C(O)N=C1 BB12-3539 [2,0,0,0,0,0|2,0,0]=4 54 B10R1.2 CC1=C(C)C(NN)=CC=C1 BB56-2527 [1,1,0,0,0,0|2,0,0]=4 55 B10R1.2 COC1=C(C)C(C)=CC=C1 BB12-4726 [1,1,0,0,0,0|1,0,0]=3 56 B10R1.119 CC1=CC=C(N)C(N)=C1C BB12-2656 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.245 CC1=CC=CC(C)=C1NN BB56-0064 [1,1,0,0,0,0|1,0,0]=3 58 B10R1.245 COC1=C(N)C=CN=C1C BB17-0194 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.245 [C-]#[N+]C1=C(C)C=CC=C1C BB56-1199 [1,1,0,0,0,0|1,0,0]=3 60 B10R1.8 CC1=CC(C)=CC(NN)=C1 BB56-0332 [1,1,0,0,0,0|1,0,0]=3 61 B10R1.8 [C-]#[N+]C1=CC(C)=CC(C)=C1 BB56-1197 [1,1,0,0,0,0|0,0,1]=3 62 B10R1.25 CC1=CC(Cl)=CC=C1NN BB56-0333 [1,1,0,0,0,0|2,0,0]=4 63 B10R1.25 CC1=CC=C(NN)C(Br)=C1 BB56-0056 [1,1,0,0,0,0|2,0,0]=4 64 B10R1.25 CC1=CC=C(NN)C(C)=C1 BB56-2530 [1,1,0,0,0,0|1,0,0]=3 65 B10R1.25 CNC1=C(C)C=C(Cl)C=C1 BB01-7288 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.25 COC1=CNC(C)=CC1=O BB26-0387 [1,1,0,0,0,0|2,0,0]=4 67 B10R1.25 COC1=COC(C)=CC1=O BB26-0386 [1,1,0,0,0,0|2,0,0]=4 68 B10R1.25 [C-]#[N+]C1=C(C)C=C(Br)C=C1 BB56-1773 [1,1,0,0,0,0|2,0,0]=4 69 B10R1.25 [C-]#[N+]C1=C(C)C=C(Cl)C=C1 BB56-1818 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.30 CC1=CC=C(C)C(NN)=C1 BB56-2533 [1,1,0,0,0,0|2,0,0]=4 71 B10R1.30 CC1=CC=C(F)C(NN)=C1 BB56-2743 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.30 CC1=CC=C(O)C(CO)=N1 BB12-2201 [1,1,0,0,0,0|1,0,0]=3 73 B10R1.30 CCC1=C(N)C=CC(I)=C1 BB17-0313 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.30 CNC1=C(C)C=CC(Cl)=C1 BB01-7292 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.30 CNC1=C(Cl)C=CC(F)=C1 BB01-7287 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.30 O=CC1=C(O)C=CC(Br)=C1 BB17-1585 [1,1,0,0,0,0|1,0,1]=4 77 B10R1.30 O=CC1=CC(I)=CC=C1O BB12-2260 [1,1,0,0,0,0|1,0,1]=4 78 B10R1.118 CC1=C(N)C=C(N)C(Br)=C1 BB17-2667 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.118 CC1=CC(=O)C(O)=CN1C BB26-0384 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.118 CC1=CC(N)=C(C)C=C1I BB17-0382 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.118 CC1=CC(N)=C(N)C=C1Cl BB12-4584 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.118 CC1=CC(N)=C(O)C=C1C BB12-4604 [1,1,0,0,0,0|1,0,0]=3 83 B10R1.118 OC1=CC(F)=C(F)C=C1Br BB12-2290 [1,1,0,0,0,0|2,0,0]=4 84 B10R1.176 CC1=CC(NN)=CC=C1Br BB56-0331 [1,1,0,0,0,0|2,0,0]=4 85 B10R1.176 CC1=CC=C(NN)C=C1C BB56-2531 [1,1,0,0,0,0|2,0,0]=4 86 B10R1.176 O=C1C=C(CCl)OC=C1O BB26-0808 [1,1,0,0,0,0|2,0,0]=4 87 B10R1.176 O=CC1=CC(I)=C(O)C=C1 BB17-2246 [1,1,0,0,0,0|1,0,1]=4 88 B10R1.176 [C-]#[N+]C1=CC=C(C)C(C)=C1 BB56-1194 [1,1,0,0,0,0|1,0,1]=4 89 B12R1.235 COC1=C(O)C(CO)=CC(Br)=C1 BB53-1955 [0,2,0,0,0,0|1,0,0]=3 90 B12R1.511 CC1=CC(Br)=CC(C(=O)O)=C1O BB12-4699 [0,2,0,0,0,0|1,0,1]=4 91 B12R1.511 CC1=CC(Cl)=CC(C(=O)O)=C1O BB17-0394 [0,2,0,0,0,0|1,0,1]=4 92 B12R1.511 CC1=CC(I)=CC(C(=O)O)=C1O BB17-1056 [0,2,0,0,0,0|1,0,1]=4 93 B12R1.511 CC1=CC(N)=CC(C(=O)O)=C1O BB17-0393 [0,2,0,0,0,0|1,0,1]=4 94 B12R1.511 CC1=CC([N+](=O)[O-])=C(N)C(C)=C1 BB12-4749 [0,2,0,0,0,0|2,0,0]=4 95 B12R1.1005 CC(C)C1=CC(N)=C(O)C(Br)=C1 BB17-0377 [0,2,0,0,0,0|2,0,0]=4 96 B12R1.98 CC1=CC(O)=C(CO)C(C)=C1Cl BB17-1846 [0,2,0,0,0,0|1,0,0]=3 97 B12R1.3795 CC1=C(Cl)C(C)=C(Br)C(O)=C1N BB17-1947 [0,2,0,0,0,0|2,0,0]=4 98 B12R1.3795 CC1=C(Cl)C(C)=C(Cl)C(O)=C1N BB17-1946 [0,2,0,0,0,0|2,0,0]=4 99 B12R1.3795 CC1=C(N)C(C)=C(N)C(C)=C1N BB55-3971 [0,2,0,0,0,0|1,0,0]=3 100 B12R1.1000 CC1=CC(C)=C(B(O)O)C(C)=C1 BB12-2222 [0,2,0,0,0,0|0,0,0]=2