0 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.13 CC(O)C1=CC=C(N)C=C1 BB12-2291 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.13 CC1=CC=C(C(=N)N)C=C1 BB20-3270 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.13 NC(=O)C1=CC=C(N)N=N1 BB01-7655 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.13 NC(=O)C1=NNC(=O)C=C1 BB10-0123 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BB01-7654 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.13 O=C(Cl)C1=NN=C(Cl)C=C1 BB10-0141 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.13 O=C(O)C1=CC=C(O)C=N1 BB56-1848 [0,0,0,0,0,0|1,0,0]=1 8 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BB26-0398 [0,0,0,0,0,0|1,0,1]=2 9 B10R1.13 O=C1C=CC(C(=O)O)=NN1 BB12-2030 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.13 O=[N+]([O-])C1=NC=C(Br)C=C1 BB12-2213 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.1 CC1=CN=C(C=O)C=C1 BB12-2174 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.1 NCC1=CC=C(O)C=C1 BB12-1603 [1,0,0,0,0,0|1,0,1]=3 13 B9R1.1 NNC1=CC=C(I)C=C1 BB56-2534 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.1 [C-]#[N+]C1=CC=C(Br)C=C1 BB56-0563 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.1 [C-]#[N+]C1=CC=C(Cl)C=C1 BB56-1817 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.1 [C-]#[N+]C1=CC=C(F)C=C1 BB56-1216 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.6 NC(=S)C1=CC=NC=C1 BB12-3482 [1,0,0,0,0,0|2,1,0]=4 18 B9R1.6 NC(=S)C1=CN=CC=C1 BB12-3483 [1,0,0,0,0,0|2,1,0]=4 19 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 BB12-1599 [0,1,0,0,0,0|1,0,1]=3 20 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 BB53-1358 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 BB12-2672 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 BB56-2538 [0,1,0,0,0,0|1,0,0]=2 23 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 BB12-3514 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.3 OCC1=CC=C(B(O)O)C=C1 BB12-2258 [0,1,0,0,0,0|1,0,1]=3 25 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 BB12-2899 [0,1,0,0,0,0|1,0,0]=2 26 B11R1.21 CC(N)C1=CC(F)=C(O)C=C1 BB53-1533 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.21 CC1=C(Br)C=C([N+](=O)[O-])C=C1 BB17-0720 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.21 CC1=C(Cl)C=CC([N+](=O)[O-])=C1 BB17-0545 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.21 NC1=C(O)C=C([N+](=O)[O-])C=C1 BB12-1569 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 BB12-4696 [0,1,0,0,0,0|1,0,0]=2 31 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 BB56-0403 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.21 OB(O)C1=CC=C(F)C(Cl)=C1 BB01-0065 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 BB53-4156 [0,1,0,0,0,0|2,0,0]=3 34 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 BB12-2577 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.22 CC1=CC=C(C(N)CO)C=C1 BB56-2094 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 BB17-2353 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 BB12-1843 [0,1,0,0,0,0|2,0,0]=3 38 B11R1.22 COC(=O)C1=CC=C(O)C=N1 BB56-2624 [0,1,0,0,0,0|1,0,0]=2 39 B11R1.22 COC(=O)C1=NNC(=O)C=C1 BB10-0119 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 BB56-2167 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 BB56-2226 [0,1,0,0,0,0|2,0,1]=4 42 B11R1.22 NC(CO)C1=CC=C(F)C=C1 BB12-1444 [0,1,0,0,0,0|2,0,1]=4 43 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 BB26-0169 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 BB12-2695 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 BB17-2382 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 BB01-6328 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 BB53-4155 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 BB20-3112 [0,1,0,0,0,0|2,0,0]=3 49 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 BB01-6260 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 BB12-2243 [0,1,0,0,0,0|1,0,0]=2 51 B11R1.166 NC1=C(C(=O)O)C=NC(=S)N1 BB52-2194 [0,1,0,0,0,0|2,1,0]=4 52 B11R1.166 NC1=C(C(=O)O)C=NC(O)=N1 BB12-4164 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.166 NC1=CC(Br)=C(C(=O)O)C=C1 BB17-0728 [0,1,0,0,0,0|1,0,0]=2 54 B11R1.166 NC1=NC(S)=NC=C1C(=O)O BB52-6462 [0,1,0,0,0,0|2,1,0]=4 55 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 BB20-4599 [0,1,0,0,0,0|1,0,0]=2 56 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 BB12-2552 [0,1,0,0,0,0|1,0,0]=2 57 B11R1.166 O=C(O)C1=C(O)C=C(O)N=C1 BB12-2178 [0,1,0,0,0,0|1,0,0]=2 58 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl BB12-2212 [0,1,0,0,0,0|2,0,0]=3 59 B9R1.35 CC1=CNC(C(=O)O)=N1 BB12-3671 [0,0,0,0,1,0|3,0,0]=4 60 B9R1.35 CC1=NC(C(=O)O)=CS1 BB01-2835 [0,0,0,0,1,0|3,0,0]=4 61 B9R1.35 NC1=CC(C(=O)O)=NN1 BB55-3807 [0,0,0,0,1,0|3,0,0]=4 62 B9R1.35 O=C1NC=C(C(=O)O)N1 BB26-0164 [0,0,0,0,1,0|2,0,1]=4 63 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 BB12-3713 [0,0,0,0,0,1|2,0,0]=3 64 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 BB12-3000 [0,0,0,0,0,1|2,0,0]=3 65 B11R1.20 CC1=CC=C(CC(N)=S)C=C1 BB20-4553 [0,0,0,0,0,1|2,1,0]=4 66 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [0,0,0,0,0,1|1,0,0]=2 67 B10R1.1 CNCC1=CC=C(O)C=C1 BB12-1375 [1,1,0,0,0,0|1,0,1]=4 68 B10R1.1 O\N=C\C1=CC=C(F)C=C1 BB12-1509 [1,1,0,0,0,0|1,0,0]=3 69 B10R1.3 COC1=CC=C(NN)C=C1 BB56-2536 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.3 NCC1=CC=C(CO)C=C1 BB12-1471 [1,1,0,0,0,0|1,0,1]=4 71 B10R1.25 NCC1=CC=C(O)C=C1O BB12-1397 [1,1,0,0,0,0|1,0,1]=4 72 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 BB56-1846 [1,1,0,0,0,0|1,0,0]=3 73 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 BB56-1915 [1,1,0,0,0,0|1,0,0]=3 74 B10R1.25 O=CC1=C(O)C=C(F)C=C1 BB20-3279 [1,1,0,0,0,0|1,0,0]=3 75 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 BB12-1260 [1,1,0,0,0,0|1,0,0]=3 76 B10R1.176 CC1=C(F)C=C(C=O)C=C1 BB12-2251 [1,1,0,0,0,0|1,0,0]=3 77 B10R1.176 O=CC1=CC(I)=C(O)C=C1 BB17-2246 [1,1,0,0,0,0|0,0,0]=2 78 B10R1.176 O=CC1=CC=C(F)C(Cl)=C1 BB12-4694 [1,1,0,0,0,0|1,0,0]=3 79 B10R1.15 CC(C=O)C1=CC=CC=C1 BB17-2274 [1,1,0,0,0,0|1,0,1]=4 80 B10R1.15 CCC(=O)C1=NC=CC=C1 BB12-2185 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.15 COC(=O)C1=CC=NC=C1 BB20-4674 [1,1,0,0,0,0|1,0,0]=3 82 B10R1.15 N=C(NO)C1=CC=CC=C1 BB20-3129 [1,1,0,0,0,0|1,0,0]=3 83 B10R1.15 N=C(NO)C1=CC=CN=C1 BB20-3167 [1,1,0,0,0,0|2,0,0]=4 84 B10R1.15 N=C(NO)C1=CC=NC=C1 BB20-3168 [1,1,0,0,0,0|2,0,0]=4 85 B10R1.15 NC(CO)C1=CC=CC=C1 BB01-6618 [1,1,0,0,0,0|1,0,1]=4 86 B10R1.15 NCC(=O)C1=CC=CC=C1 BB26-0680 [1,1,0,0,0,0|1,0,0]=3 87 B10R1.15 NNC(=O)C1=CC=CC=C1 BB20-4243 [1,1,0,0,0,0|1,0,0]=3 88 B10R1.15 N\C(=N/O)C1=NC=CC=C1 BB12-3473 [1,1,0,0,0,0|2,0,0]=4 89 B10R1.15 N\N=C(/N)C1=CC=CC=C1 BB10-1016 [1,1,0,0,0,0|2,0,0]=4 90 B10R1.61 NC1=C(C(=O)O)C=CN=C1 BB12-1728 [1,1,0,0,0,0|1,0,0]=3 91 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 BB12-3503 [1,1,0,0,0,0|2,0,0]=4 92 B10R1.61 O=C(O)C1=CN=CNC1=O BB10-0517 [1,1,0,0,0,0|2,0,0]=4 93 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 BB20-4612 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.113 NC1=CC=CC(B(O)O)=C1 BB12-2221 [1,1,0,0,0,0|1,0,1]=4 95 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 BB17-0499 [1,1,0,0,0,0|1,0,0]=3 96 B12R1.19 CC1=CC=C(CC(=O)O)C=C1C BB56-0554 [0,1,0,0,0,1|1,0,0]=3 97 B12R1.19 O=C(O)CC1=CC=C(F)C(F)=C1 BB56-0510 [0,1,0,0,0,1|1,0,0]=3 98 B12R1.20 CC(=O)N(C)C1=CC=C(Br)C=C1 BB12-4088 [0,1,0,0,0,1|2,0,0]=4 99 B12R1.20 NC(C(=O)O)C1=CC=C(Cl)C=C1 BB56-0268 [0,1,0,0,0,1|1,0,0]=3 100 B12R1.20 NC(C(=O)O)C1=CC=C(I)C=C1 BB56-0239 [0,1,0,0,0,1|1,0,0]=3 101 B12R1.49 CC1=CC=C(NC(=O)CS)C=C1 BB12-3950 [0,1,0,0,0,1|1,1,0]=4 102 B12R1.49 CCC(=O)NC1=CC=C(N)C=C1 BB17-0336 [0,1,0,0,0,1|2,0,0]=4 103 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 BB01-6281 [0,1,0,0,0,1|1,0,0]=3 104 B12R1.49 O=C(CS)NC1=CC=C(F)C=C1 BB12-3948 [0,1,0,0,0,1|1,1,0]=4 105 B12R1.233 CC(=O)NC1=C(N)C=C(Br)C=C1 BB12-1697 [0,1,0,0,0,1|2,0,0]=4 106 B12R1.233 CC(=O)NC1=C(N)C=C(C)C=C1 BB12-1696 [0,1,0,0,0,1|2,0,0]=4 107 B12R1.233 CC(=O)NC1=CC=C(C)C=C1O BB12-2649 [0,1,0,0,0,1|2,0,0]=4 108 B12R1.233 CC(=O)NC1=CC=C(N)C=C1Cl BB12-4714 [0,1,0,0,0,1|2,0,0]=4 109 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1F BB56-2547 [0,1,0,0,0,1|1,0,0]=3 110 B12R1.233 O=C(O)CC1=CC=C(F)C=C1Cl BB56-2649 [0,1,0,0,0,1|1,0,0]=3 111 B12R1.5 CNC(=O)C1=CC=C(CCl)C=C1 BB12-3362 [0,2,0,0,0,0|2,0,0]=4 112 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 BB12-3364 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.5 COC(=O)C1=CC=C(CCl)C=C1 BB12-2994 [0,2,0,0,0,0|1,0,0]=3 114 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 BB26-0170 [0,2,0,0,0,0|1,0,0]=3 115 B12R1.5 N#CC1=CC=C(C(=O)NN)C=C1 BB12-2652 [0,2,0,0,0,0|2,0,0]=4 116 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 BB53-1298 [0,2,0,0,0,0|1,0,0]=3 117 B12R1.48 COC1=C(N)C=C(C(C)=O)C=C1 BB12-0014 [0,2,0,0,0,0|1,0,0]=3 118 B12R1.48 COC1=CNC(C(=O)O)=CC1=O BB26-0368 [0,2,0,0,0,0|1,0,0]=3 119 B12R1.48 COC1=COC(C(=O)O)=CC1=O BB26-0367 [0,2,0,0,0,0|1,0,0]=3 120 B12R1.113 CC(=O)C1=CC=C(N=C=O)C=C1 BB01-6587 [0,2,0,0,0,0|1,0,1]=4 121 B12R1.113 CC(=O)C1=CC=C(N=C=S)C=C1 BB53-1311 [0,2,0,0,0,0|1,1,0]=4 122 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 BB12-2998 [0,2,0,0,0,0|1,0,0]=3 123 B12R1.256 CN(C)C1=NC=C(C(=O)O)C=C1 BB12-3628 [0,2,0,0,0,0|2,0,0]=4 124 B12R1.23 NC1=CC(S(N)(=O)=O)=CC=C1O BB12-2915 [0,2,0,0,0,0|1,0,1]=4 125 B12R1.23 NC1=CC=C(S(=O)(=O)O)C=C1Cl BB17-0785 [0,2,0,0,0,0|2,0,0]=4 126 B12R1.56 NNC1=CC(C(=O)O)=CC=C1Cl BB56-0613 [0,2,0,0,0,0|1,0,0]=3 127 B12R1.56 O=[N+]([O-])C1=CC=C(O)C(CCl)=C1 BB12-1837 [0,2,0,0,0,0|1,0,1]=4 128 B12R1.232 CC(=O)C1=CC(F)=C(F)C=C1F BB12-2273 [0,2,0,0,0,0|2,0,0]=4 129 B12R1.232 CC1=CC(O)=C(C(=O)O)C=C1C BB12-4724 [0,2,0,0,0,0|1,0,0]=3 130 B12R1.232 NC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 BB12-4680 [0,2,0,0,0,0|1,0,0]=3 131 B12R1.367 CC1=C(C)C=C(C(=O)CCl)C=C1 BB12-1806 [0,2,0,0,0,0|2,0,0]=4 132 B12R1.367 COC(=O)C1=CC(Cl)=C(Br)C=C1 BB17-0831 [0,2,0,0,0,0|1,0,0]=3 133 B12R1.367 COC(=O)C1=CC=C(F)C(Cl)=C1 BB12-4595 [0,2,0,0,0,0|1,0,0]=3 134 B12R1.893 CC1=C(C)C(O)=C(C(=O)O)C=C1 BB17-0815 [0,2,0,0,0,0|1,0,0]=3 135 B12R1.1005 CC1=C(Br)C=C(C(=O)O)C=C1Br BB12-4597 [0,2,0,0,0,0|1,0,0]=3 136 B12R1.1005 CC1=C(Cl)C=C(C(=O)O)C=C1N BB17-0446 [0,2,0,0,0,0|1,0,0]=3 137 B12R1.1005 CC1=C(N)C=C(C(=O)O)C=C1N BB12-4598 [0,2,0,0,0,0|1,0,0]=3 138 B12R1.1005 NC1=C(Cl)C(Cl)=CC(C(=O)O)=C1 BB12-4678 [0,2,0,0,0,0|1,0,0]=3 139 B12R1.1005 O=C(O)C1=CC(Cl)=C(Br)C(Cl)=C1 BB12-4611 [0,2,0,0,0,0|1,0,0]=3 140 B12R1.1005 O=C(O)C1=CC(Cl)=C(Cl)C(Cl)=C1 BB12-4610 [0,2,0,0,0,0|1,0,0]=3 141 B12R1.1005 O=C(O)C1=CC(Cl)=C(I)C(Cl)=C1 BB12-4720 [0,2,0,0,0,0|1,0,0]=3 142 B12R1.16 CCOC(=O)C1=CN=C(O)C=N1 BB20-4231 [0,2,0,0,0,0|2,0,0]=4 143 B12R1.16 N#CCC(=O)C1=CC=C(Cl)C=C1 BB12-1815 [0,2,0,0,0,0|2,0,0]=4 144 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Cl)C=C1 BB12-2254 [0,2,0,0,0,0|2,0,0]=4 145 B12R1.1703 COC(=O)C1=C(Br)C=C(N)C=C1 BB17-0727 [0,2,0,0,0,0|1,0,0]=3 146 B12R1.1703 NNC(=O)C1=C(O)C=C(O)C=C1 BB12-2197 [0,2,0,0,0,0|1,0,0]=3 147 B12R2.606 CC1=CC2=C(C=C1)N=C(N)O2 BB12-2735 [0,0,0,1,0,1|2,0,0]=4 148 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 BB56-2371 [0,0,0,1,0,1|2,0,0]=4 149 B12R2.606 CC1=CC=C2NC(=O)NC2=C1 BB12-2964 [0,0,0,1,0,1|2,0,0]=4 150 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 BB12-1457 [0,0,0,1,0,1|1,0,0]=3 151 B12R2.606 CC1=CC=C2OC(=O)NC2=C1 BB12-1458 [0,0,0,1,0,1|2,0,0]=4 152 B12R2.606 NC1=CC=C2NC(O)=NC2=C1 BB26-0788 [0,0,0,1,0,1|2,0,0]=4 153 B12R2.606 NC1=NC2=CC=C(Cl)C=C2O1 BB12-3087 [0,0,0,1,0,1|2,0,0]=4 154 B12R2.606 NC1=NC2=CC=C(F)C=C2O1 BB12-2723 [0,0,0,1,0,1|2,0,0]=4 155 B12R2.606 NC1=NC2=CC=C(O)C=C2S1 BB12-2129 [0,0,0,1,0,1|1,1,0]=4 156 B12R2.606 O=C1NC2=CC=C(F)C=C2O1 BB12-1459 [0,0,0,1,0,1|1,0,0]=3 157 B12R2.606 OC1=NC2=CC=C(F)C=C2N1 BB17-0211 [0,0,0,1,0,1|2,0,0]=4 158 B12R2.612 O=C1COC2=CC(O)=CC=C12 BB26-0144 [0,1,0,1,0,0|0,0,0]=2 159 B8R1.7 O=C(O)C1=CNN=C1 BB01-4399 [1,0,0,0,1,0|2,0,0]=4 160 B8R1.7 O=C(O)C1=NOC=C1 BB20-4533 [1,0,0,0,1,0|2,0,0]=4 161 B10R1.18 CC(=O)NC1=CC=CN=C1 BB12-1692 [1,0,0,0,0,1|2,0,0]=4 162 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 BB12-2588 [0,0,0,0,0,2|1,0,0]=3 163 B12R1.21 NC(=O)COC1=CC=C(N)C=C1 BB12-1839 [0,0,0,0,0,2|2,0,0]=4 164 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 BB12-1847 [0,0,0,0,0,2|1,0,0]=3 165 B12R1.21 O=C(O)\C=C\C1=CC=C(I)C=C1 BB17-2516 [0,0,0,0,0,2|1,0,0]=3