0 B10R1.20 CCC1=CC=CC=C1NN BB56-0047 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.20 COC1=CC=CC=C1NN BB56-0061 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.20 COC1=NC=CC=C1CN BB53-1722 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.20 CSC1=CC=CC=C1NN BB56-0754 [0,0,0,0,0,0|2,1,0]=3 4 B10R1.20 [C-]#[N+]C1=C(CC)C=CC=C1 BB56-1771 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.20 [C-]#[N+]C1=CC=CC=C1C#N BB56-1769 [0,0,0,0,0,0|2,0,2]=4 6 B10R1.20 [C-]#[N+]C1=CC=CC=C1OC BB56-1195 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.15 CNC1=C(C)C=CC=C1 BB01-7286 [1,0,0,0,0,0|1,0,1]=3 8 B9R1.15 CNC1=CC=CC=C1N BB12-2750 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.15 CNC1=CC=CN=C1N BB12-1643 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.15 CNC1=NC=CC=C1Cl BB12-1745 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.15 COC1=CC=CN=C1C BB17-0165 [1,0,0,0,0,0|1,0,1]=3 12 B9R1.15 NNC1=CC=CC=C1I BB56-0829 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.15 O=CC1=CC=CN=C1Br BB56-0225 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.15 [C-]#[N+]C1=C(I)C=CC=C1 BB56-0362 [1,0,0,0,0,0|2,0,1]=4 15 B11R1.37 CCC1=CC(Br)=CC=C1NN BB56-0059 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.37 COC1=C(C#N)C=C(N)C=C1 BB53-1291 [0,1,0,0,0,0|1,0,1]=3 17 B11R1.37 COC1=C(CO)C=C(Cl)C=C1 BB53-1861 [0,1,0,0,0,0|0,0,2]=3 18 B11R1.37 COC1=C(OC)C=C(I)C=C1 BB12-5007 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.37 COC1=CC=C(Cl)C=C1NN BB56-0969 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.41 CCOC1=CC=CC=C1NN BB56-0057 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.41 COC1=C(\C=N\O)C=CC=C1 BB20-3227 [0,1,0,0,0,0|0,0,1]=2 22 B11R1.53 CC(C)C1=CC=CC=C1NN BB56-0329 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.53 CNC1=CC=CC=C1[N+](=O)[O-] BB12-2791 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.53 CNC1=NC=CC=C1C(=O)O BB12-3552 [0,1,0,0,0,0|2,0,0]=3 25 B11R1.53 CNC1=NC=CC=C1[N+](=O)[O-] BB12-3019 [0,1,0,0,0,0|3,0,0]=4 26 B11R1.53 NCC1=C(C(N)=O)C=CC=C1 BB12-1453 [0,1,0,0,0,0|2,0,0]=3 27 B11R1.53 NNC1=CC=CC=C1C(=O)O BB12-2554 [0,1,0,0,0,0|2,0,0]=3 28 B11R1.265 CCC1=CC=CC(C)=C1NN BB56-0058 [0,1,0,0,0,0|3,0,0]=4 29 B11R2.1 NC1=NNC2=C1C=CC=C2 BB26-0849 [0,0,0,1,0,0|3,0,0]=4 30 B8R1.5 CC1=NC=CC=C1O BB17-0195 [2,0,0,0,0,0|1,0,1]=4 31 B8R1.5 NC1=C(O)N=CC=C1 BB12-2900 [2,0,0,0,0,0|2,0,0]=4 32 B8R1.5 OC1=CC=CN=C1Br BB12-1811 [2,0,0,0,0,0|2,0,0]=4 33 B10R1.2 CC1=C(C)C(NN)=CC=C1 BB56-2527 [1,1,0,0,0,0|2,0,0]=4 34 B10R1.2 COC1=C(C)C(C)=CC=C1 BB12-4726 [1,1,0,0,0,0|0,0,1]=3 35 B10R1.2 COC1=CC=C[N+]([O-])=C1Br BB12-1810 [1,1,0,0,0,0|2,0,0]=4 36 B10R1.4 CC1=CC=CC=C1CCN BB12-2271 [1,1,0,0,0,0|1,0,1]=4 37 B10R1.4 CCNC1=CC=CC=C1N BB12-3022 [1,1,0,0,0,0|2,0,0]=4 38 B10R1.25 CC1=CC(Cl)=CC=C1NN BB56-0333 [1,1,0,0,0,0|2,0,0]=4 39 B10R1.25 CC1=CC=C(NN)C(C)=C1 BB56-2530 [1,1,0,0,0,0|2,0,0]=4 40 B10R1.25 CNC1=C(C)C=C(Cl)C=C1 BB01-7288 [1,1,0,0,0,0|1,0,1]=4 41 B10R1.25 COC1=CNC(C)=CC1=O BB26-0387 [1,1,0,0,0,0|1,0,0]=3 42 B10R1.25 COC1=COC(C)=CC1=O BB26-0386 [1,1,0,0,0,0|1,0,0]=3 43 B10R1.25 NCC1=CC=C(O)C=C1O BB12-1397 [1,1,0,0,0,0|1,0,1]=4 44 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 BB56-1846 [1,1,0,0,0,0|1,0,0]=3 45 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 BB56-1915 [1,1,0,0,0,0|1,0,0]=3 46 B10R1.25 O=CC1=C(O)C=C(F)C=C1 BB20-3279 [1,1,0,0,0,0|0,0,0]=2 47 B10R1.25 [C-]#[N+]C1=C(C)C=C(Br)C=C1 BB56-1773 [1,1,0,0,0,0|2,0,0]=4 48 B10R1.25 [C-]#[N+]C1=C(C)C=C(Cl)C=C1 BB56-1818 [1,1,0,0,0,0|2,0,0]=4 49 B10R1.30 CC1=C(NN)C=C(F)C=C1 BB56-2635 [1,1,0,0,0,0|2,0,0]=4 50 B10R1.30 CC1=CC=C(C)C(NN)=C1 BB56-2533 [1,1,0,0,0,0|2,0,0]=4 51 B10R1.30 CC1=CC=C(Cl)C=C1NN BB56-0049 [1,1,0,0,0,0|2,0,0]=4 52 B10R1.30 CCC1=C(N)C=CC(I)=C1 BB17-0313 [1,1,0,0,0,0|2,0,0]=4 53 B10R1.30 CNC1=C(C)C=CC(Cl)=C1 BB01-7292 [1,1,0,0,0,0|1,0,1]=4 54 B10R1.30 CNC1=C(Cl)C=CC(F)=C1 BB01-7287 [1,1,0,0,0,0|2,0,0]=4 55 B10R1.30 O=CC1=C(O)C=CC(Br)=C1 BB17-1585 [1,1,0,0,0,0|0,0,0]=2 56 B10R1.30 O=CC1=CC(I)=CC=C1O BB12-2260 [1,1,0,0,0,0|0,0,0]=2 57 B10R1.30 [C-]#[N+]C1=C(C)C=CC(Cl)=C1 BB56-1772 [1,1,0,0,0,0|2,0,0]=4 58 B10R1.61 CN(C)C1=C(N)C=CC=C1 BB12-1582 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.61 NC1=C(C(=O)O)C=CN=C1 BB12-1728 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 BB12-3503 [1,1,0,0,0,0|2,0,0]=4 61 B10R1.61 O=[N+]([O-])C1=NC=CC=C1O BB01-6547 [1,1,0,0,0,0|2,0,0]=4 62 B10R1.245 CC1=CC=CC(C)=C1NN BB56-0064 [1,1,0,0,0,0|2,0,0]=4 63 B10R1.245 COC1=C(N)C=CN=C1C BB17-0194 [1,1,0,0,0,0|1,0,1]=4 64 B10R1.245 N#CC1=C(O)C=CC=C1F BB12-1060 [1,1,0,0,0,0|1,0,1]=4 65 B10R1.245 O=CC1=C(Br)C=NC=C1Br BB20-3286 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.245 [C-]#[N+]C1=C(C)C=CC=C1C BB56-1199 [1,1,0,0,0,0|2,0,0]=4 67 B12R1.46 COC1=C(C(=O)O)C=C(Cl)C=C1 BB17-0434 [0,2,0,0,0,0|0,0,0]=2 68 B12R1.46 COC1=C(C(N)=O)C=C(Cl)C=C1 BB17-0436 [0,2,0,0,0,0|0,0,0]=2 69 B12R1.46 COC1=C(C(N)=O)C=C(N)C=C1 BB53-1550 [0,2,0,0,0,0|0,0,0]=2 70 B12R1.78 COC1=NC(OC)=C(C=O)C=N1 BB12-1732 [0,2,0,0,0,0|2,0,0]=4 71 B12R1.78 [C-]#[N+]C1=C(OC)C=C(OC)C=C1 BB56-1820 [0,2,0,0,0,0|2,0,0]=4 72 B12R1.112 CCOC1=C(C#N)C=C(N)C=C1 BB53-1290 [0,2,0,0,0,0|1,0,1]=4 73 B12R1.234 COC1=C(C=O)C=C(Br)C=C1Br BB17-0630 [0,2,0,0,0,0|0,0,0]=2 74 B12R1.234 COC1=C(C=O)C=C(Br)C=C1Cl BB17-2509 [0,2,0,0,0,0|0,0,0]=2 75 B12R1.234 COC1=C(C=O)C=C(I)C=C1I BB17-1444 [0,2,0,0,0,0|0,0,0]=2 76 B12R1.268 COC1=C(N=C=S)C=C(Cl)C=C1 BB53-1308 [0,2,0,0,0,0|0,1,1]=4 77 B12R1.75 COC1=C(CC(=O)Cl)C=CC=C1 BB20-1618 [0,2,0,0,0,0|0,0,0]=2 78 B12R1.75 COC1=C(NC(C)=O)C=CC=C1 BB12-5051 [0,2,0,0,0,0|0,0,0]=2 79 B12R1.77 COC1=CC=CC=C1C(N)CO BB56-2225 [0,2,0,0,0,0|0,0,2]=4 80 B12R1.77 COC1=NC=CC=C1C(=N)NO BB12-3913 [0,2,0,0,0,0|1,0,1]=4 81 B12R1.121 C#CCOC1=C(C=O)C=CC=C1 BB17-1435 [0,2,0,0,0,0|0,0,0]=2 82 B12R1.283 CCNC1=CC=CC=C1[N+](=O)[O-] BB12-3021 [0,2,0,0,0,0|2,0,0]=4 83 B12R1.87 COC1=C(C(N)=O)C=CC=C1C BB17-0496 [0,2,0,0,0,0|0,0,0]=2 84 B12R1.87 O=CC1=C([N+](=O)[O-])C=CC=C1Cl BB17-2249 [0,2,0,0,0,0|2,0,0]=4 85 B12R1.261 CN(C)C1=NC=CC=C1C(=O)O BB12-3630 [0,2,0,0,0,0|2,0,0]=4 86 B12R2.24 O=C1COC2=CC=CN=C2N1 BB12-2193 [0,1,0,1,0,0|1,0,0]=3 87 B12R2.24 O=C1CSC2=CC=CC=C2N1 BB20-4697 [0,1,0,1,0,0|0,1,0]=3 88 B12R2.24 S=C1COC2=CC=CC=C2N1 BB10-0259 [0,1,0,1,0,0|0,1,0]=3 89 B12R2.612 O=C1COC2=CC(O)=CC=C12 BB26-0144 [0,1,0,1,0,0|0,0,0]=2 90 B12R2.1 O\N=C1/COC2=CC=CC=C21 BB12-2095 [0,1,0,1,0,0|0,0,1]=3 91 B12R2.18 CC1CC2=CC=CC=C2C1=O BB12-2283 [0,1,0,1,0,0|1,0,0]=3 92 B12R2.18 CN1C2=CC=CC=C2N=C1Cl BB12-1469 [0,1,0,1,0,0|2,0,0]=4 93 B12R2.1081 O=C1NN=CC2=CC=CC=C12 BB20-3474 [0,1,0,1,0,0|2,0,0]=4 94 B12R2.196 CN1C=CC2=C(N)C=CC=C21 BB26-0150 [0,1,0,1,0,0|2,0,0]=4 95 B12R2.203 NC1=NOC2=CC=CC(F)=C21 BB01-1948 [0,1,0,1,0,0|2,0,0]=4 96 B8R1.11 CC1=C(C=O)NC=N1 BB12-3119 [1,0,0,0,1,0|2,0,0]=4 97 B8R1.11 CN1N=CC=C1C=O BB55-3814 [1,0,0,0,1,0|2,0,0]=4