0 B12R1.5 CCC1=CC=C(C(=O)NN)N=C1 BB17-2220 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.5 CNC(=O)C1=CC=C(CCl)C=C1 BB12-3362 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 BB12-3364 [0,0,0,0,0,0|3,0,0]=3 3 B12R1.5 COC(=O)C1=CC=C(CCl)C=C1 BB12-2994 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 BB26-0170 [0,0,0,0,0,0|2,0,0]=2 5 B12R1.5 N#CC1=CC=C(C(=O)NN)C=C1 BB12-2652 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 BB12-1599 [1,0,0,0,0,0|3,0,0]=4 7 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 BB53-1358 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 BB12-2672 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 BB56-2538 [1,0,0,0,0,0|2,0,0]=3 10 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 BB12-3514 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 BB53-4156 [1,0,0,0,0,0|2,0,0]=3 12 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 BB12-2577 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 BB17-2353 [1,0,0,0,0,0|2,0,0]=3 14 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 BB12-1843 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.22 COC(=O)C1=CC=C(O)C=N1 BB56-2624 [1,0,0,0,0,0|1,0,0]=2 16 B11R1.22 COC(=O)C1=NNC(=O)C=C1 BB10-0119 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 BB26-0169 [1,0,0,0,0,0|3,0,0]=4 18 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 BB12-2695 [1,0,0,0,0,0|3,0,0]=4 19 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 BB17-2382 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 BB01-6328 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 BB53-4155 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 BB20-3112 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 BB01-6260 [1,0,0,0,0,0|3,0,0]=4 24 B11R1.83 [C-]#[N+]CC1=CC=C(OC)C=C1 BB56-2858 [1,0,0,0,0,0|1,0,2]=4 25 B13R1.39 COC1=CC=C(\C(C#N)=C/[O-])C=C1 BB10-0859 [0,1,0,0,0,0|2,0,1]=4 26 B13R1.139 CNCC1=CC=C(C(=O)NC)C=C1 BB12-2997 [0,1,0,0,0,0|2,0,0]=3 27 B13R1.139 COC(=O)C1=CC=C(N=C=S)C=C1 BB53-1306 [0,1,0,0,0,0|1,0,1]=3 28 B13R1.452 CCOC(=O)C1=CC=C(CCl)C=C1 BB12-2992 [0,1,0,0,0,0|2,0,0]=3 29 B13R1.452 CCOC(=O)C1=CN=C(NN)C=C1 BB12-3542 [0,1,0,0,0,0|3,0,0]=4 30 B13R1.3088 CNC(C)C1=CC(F)=C(OC)C=C1 BB53-1614 [0,1,0,0,0,0|2,0,1]=4 31 B13R2.2130 COC1=CC=C2C(=O)COC2=C1 BB12-2913 [0,0,0,1,0,0|2,0,0]=3 32 B11R1.44 COC(=O)C1=CC(CN)=CS1 BB56-1936 [0,0,0,0,1,0|3,0,0]=4 33 B11R1.44 COC(=O)C1=CC=C(CCl)O1 BB12-3464 [0,0,0,0,1,0|3,0,0]=4 34 B13R1.5 CCC1=CC=C(NC(=O)CBr)C=C1 BB17-0234 [0,0,0,0,0,1|3,0,0]=4 35 B13R1.5 COC1=CC=C(C\C(N)=N\O)C=C1 BB01-3934 [0,0,0,0,0,1|3,0,0]=4 36 B10R1.3 COC1=CC=C(NN)C=C1 BB56-2536 [2,0,0,0,0,0|2,0,0]=4 37 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [2,0,0,0,0,0|1,0,0]=3 38 B10R1.13 CC1=CC=C(C(=N)N)C=C1 BB20-3270 [2,0,0,0,0,0|2,0,0]=4 39 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BB01-7654 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.13 O=C(O)C1=CC=C(O)C=N1 BB56-1848 [2,0,0,0,0,0|1,0,0]=3 41 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BB26-0398 [2,0,0,0,0,0|1,0,1]=4 42 B10R1.1 CNCC1=CC=C(O)C=C1 BB12-1375 [2,0,0,0,0,0|1,0,1]=4 43 B10R1.15 CCC(=O)C1=NC=CC=C1 BB12-2185 [2,0,0,0,0,0|2,0,0]=4 44 B10R1.15 COC(=O)C1=CC=NC=C1 BB20-4674 [2,0,0,0,0,0|1,0,0]=3 45 B10R1.15 NCC(=O)C1=CC=CC=C1 BB26-0680 [2,0,0,0,0,0|2,0,0]=4 46 B10R1.15 NNC(=O)C1=CC=CC=C1 BB20-4243 [2,0,0,0,0,0|2,0,0]=4 47 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 BB53-1298 [1,1,0,0,0,0|0,0,0]=2 48 B12R1.48 COC1=C(F)C=C(C(C)N)C=C1 BB53-1497 [1,1,0,0,0,0|1,0,1]=4 49 B12R1.48 COC1=C(N)C=C(C(C)=O)C=C1 BB12-0014 [1,1,0,0,0,0|0,0,0]=2 50 B12R1.48 COC1=CNC(C(=O)O)=CC1=O BB26-0368 [1,1,0,0,0,0|1,0,0]=3 51 B12R1.48 COC1=COC(C(=O)O)=CC1=O BB26-0367 [1,1,0,0,0,0|1,0,0]=3 52 B12R1.113 CC(=O)C1=CC=C(N=C=O)C=C1 BB01-6587 [1,1,0,0,0,0|1,0,1]=4 53 B12R1.113 CC(=O)C1=CC=C(N=C=S)C=C1 BB53-1311 [1,1,0,0,0,0|1,0,1]=4 54 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 BB12-2998 [1,1,0,0,0,0|1,0,0]=3 55 B12R1.256 CN(C)C1=NC=C(C(=O)O)C=C1 BB12-3628 [1,1,0,0,0,0|2,0,0]=4 56 B12R1.16 CCOC(=O)C1=CN=C(O)C=N1 BB20-4231 [1,1,0,0,0,0|2,0,0]=4 57 B12R1.367 CC1=C(C)C=C(C(=O)CCl)C=C1 BB12-1806 [1,1,0,0,0,0|2,0,0]=4 58 B12R1.367 COC(=O)C1=CC(Cl)=C(Br)C=C1 BB17-0831 [1,1,0,0,0,0|1,0,0]=3 59 B12R1.367 COC(=O)C1=CC=C(F)C(Cl)=C1 BB12-4595 [1,1,0,0,0,0|1,0,0]=3 60 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Cl)C=C1 BB12-2254 [1,1,0,0,0,0|2,0,0]=4 61 B12R1.1703 COC(=O)C1=C(Br)C=C(N)C=C1 BB17-0727 [1,1,0,0,0,0|1,0,0]=3 62 B12R1.1703 COC(=O)C1=C(O)N=C(C)N=C1 BB12-4464 [1,1,0,0,0,0|2,0,0]=4 63 B12R1.1703 COC(=O)C1=CN=C(C)NC1=O BB10-0287 [1,1,0,0,0,0|2,0,0]=4 64 B12R1.1703 NNC(=O)C1=C(O)C=C(O)C=C1 BB12-2197 [1,1,0,0,0,0|2,0,0]=4 65 B14R1.24 COC(=O)CC1=CC=C(N=C=S)C=C1 BB53-1505 [0,1,0,0,0,1|1,0,1]=4 66 B14R1.954 CCNC(=S)NC1=CC=C(OC)C=C1 BB17-0998 [0,1,0,0,0,1|1,1,0]=4 67 B14R1.954 COC1=CC=C(NC(=O)CC#N)C=C1 BB10-0022 [0,1,0,0,0,1|1,0,1]=4 68 B14R1.954 COC1=CC=C(NC(=O)CCN)C=C1 BB53-1849 [0,1,0,0,0,1|1,0,0]=3 69 B14R1.3276 COC1=C(Cl)C=C(NC(=O)CBr)C=C1 BB17-0230 [0,1,0,0,0,1|2,0,0]=4 70 B14R1.1128 COC(=O)C1=C(F)C=C([N+](=O)[O-])C=C1 BB20-3393 [0,2,0,0,0,0|2,0,0]=4 71 B14R1.2334 COC1=CC=C(C(=O)NN)C(OC)=C1 BB17-0305 [0,2,0,0,0,0|2,0,0]=4 72 B12R2.612 O=C1COC2=CC(O)=CC=C12 BB26-0144 [1,0,0,1,0,0|2,0,0]=4 73 B12R1.49 CC1=CC=C(NC(=O)CS)C=C1 BB12-3950 [1,0,0,0,0,1|2,0,0]=4 74 B12R1.49 CCC(=O)NC1=CC=C(N)C=C1 BB17-0336 [1,0,0,0,0,1|2,0,0]=4 75 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 BB01-6281 [1,0,0,0,0,1|1,0,0]=3 76 B12R1.435 COC(=O)C1=CC=CC(CN)=C1 BB20-4654 [0,0,0,0,1,1|2,0,0]=4 77 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 BB26-0152 [0,0,0,0,1,1|2,0,0]=4 78 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 BB01-6358 [0,0,0,0,1,1|2,0,0]=4 79 B14R1.5 COC1=CC=C(CNC(=O)CBr)C=C1 BB17-0261 [0,0,0,0,0,2|2,0,0]=4 80 B14R1.5 COC1=CC=C(COC(=O)CCl)C=C1 BB17-2021 [0,0,0,0,0,2|2,0,0]=4 81 B14R1.5 COC1=CC=C(NCC(=O)NN)C=C1 BB12-2518 [0,0,0,0,0,2|2,0,0]=4