0 B10R1.113 CC(N)C1=CC(Br)=CC=C1 BB53-1527 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 BB20-4612 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.113 NC1=CC=CC(B(O)O)=C1 BB12-2221 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 BB17-0499 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.2 CC1=CC(NN)=CC=C1 BB56-2532 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.2 CNC1=CC(F)=CC=C1 BB01-7291 [1,0,0,0,0,0|3,0,0]=4 6 B9R1.2 N#CC1=CC(O)=CC=C1 BB20-4617 [1,0,0,0,0,0|1,0,1]=3 7 B9R1.2 NCC1=CC=CC(Cl)=C1 BB01-4636 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.2 NNC1=CC(Br)=CC=C1 BB56-0176 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.2 NNC1=CC=CC(Cl)=C1 BB56-0328 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.2 NNC1=CC=CC(F)=C1 BB56-0065 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.2 [C-]#[N+]C1=CC=CC(Cl)=C1 BB56-1196 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.6 NC(=S)C1=CC=NC=C1 BB12-3482 [1,0,0,0,0,0|2,1,0]=4 13 B9R1.6 NC(=S)C1=CN=CC=C1 BB12-3483 [1,0,0,0,0,0|2,1,0]=4 14 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 BB12-2899 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.21 CC1=C(Br)C=C([N+](=O)[O-])C=C1 BB17-0720 [0,1,0,0,0,0|2,0,1]=4 16 B11R1.21 CC1=C(Cl)C=CC([N+](=O)[O-])=C1 BB17-0545 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.21 NC1=C(O)C=C([N+](=O)[O-])C=C1 BB12-1569 [0,1,0,0,0,0|1,0,1]=3 18 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 BB12-4696 [0,1,0,0,0,0|1,0,0]=2 19 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 BB56-0403 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.21 OB(O)C1=CC=C(F)C(Cl)=C1 BB01-0065 [0,1,0,0,0,0|2,0,1]=4 21 B11R1.23 CC1=CC(C(=O)NN)=CC=C1 BB12-2533 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.23 CNC(=O)C1=CC=NC(Cl)=C1 BB12-3222 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.23 NNC(=O)C1=CC(N)=NC=C1 BB12-2161 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.23 N\C(=N/O)C1=CC(Cl)=NC=C1 BB12-3492 [0,1,0,0,0,0|3,0,0]=4 25 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 BB10-1202 [0,1,0,0,0,0|1,0,0]=2 26 B11R1.159 CN1C=CC=C(C(=O)O)C1=O BB12-3383 [0,1,0,0,0,0|2,0,0]=3 27 B11R1.159 NC1=C([N+](=O)[O-])C=CC=C1Cl BB17-0461 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 BB12-4608 [0,1,0,0,0,0|1,0,0]=2 29 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 BB12-4662 [0,1,0,0,0,0|1,0,0]=2 30 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 BB53-1900 [0,1,0,0,0,0|2,0,0]=3 31 B11R1.167 CC(O)C1=C(O)C=CC(Br)=C1 BB53-1844 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.167 CC1=NNC(=O)C(C(=O)O)=C1 BB17-0297 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.167 NC(=O)C1=C(Br)C=CC(I)=C1 BB17-0460 [0,1,0,0,0,0|2,0,0]=3 34 B11R1.167 NC(=O)C1=C(Cl)C=CC(Br)=C1 BB17-0366 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.167 NC1=C([N+](=O)[O-])C=C(Br)C=C1 BB12-2921 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.167 NC1=C([N+](=O)[O-])C=C(Cl)C=C1 BB12-1688 [0,1,0,0,0,0|2,0,1]=4 37 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(F)=C1 BB53-1950 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.167 OB(O)C1=CC(F)=CC=C1F BB12-2208 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.266 CCC1=NC=CC(C(=O)O)=C1 BB12-2280 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.266 N#CC1=CC=CC(C(N)=O)=C1 BB12-1669 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.266 NCC1=CC([N+](=O)[O-])=CC=C1 BB12-2269 [0,1,0,0,0,0|2,0,1]=4 42 B9R1.35 CC1=CNC(C(=O)O)=N1 BB12-3671 [0,0,0,0,1,0|3,0,0]=4 43 B9R1.35 CC1=NC(C(=O)O)=CS1 BB01-2835 [0,0,0,0,1,0|3,0,0]=4 44 B9R1.35 NC1=CC(C(=O)O)=NN1 BB55-3807 [0,0,0,0,1,0|3,0,0]=4 45 B9R1.35 O=C1NC=C(C(=O)O)N1 BB26-0164 [0,0,0,0,1,0|2,0,1]=4 46 B9R1.41 CC1=C(C(=O)O)N=CN1 BB12-2055 [0,0,0,0,1,0|3,0,0]=4 47 B9R1.41 CC1=C(C(=O)O)N=CS1 BB26-0189 [0,0,0,0,1,0|3,0,0]=4 48 B9R1.41 CC1=C(C(=O)O)SC=N1 BB12-3519 [0,0,0,0,1,0|3,0,0]=4 49 B9R1.41 NC1=C(C(=O)O)NN=C1 BB55-4193 [0,0,0,0,1,0|3,0,0]=4 50 B9R1.41 NC1=C(C(=O)O)SC=C1 BB53-1404 [0,0,0,0,1,0|2,0,0]=3 51 B9R1.41 O=C(O)C1=C(Br)C=NN1 BB55-3823 [0,0,0,0,1,0|3,0,0]=4 52 B9R1.41 O=C(O)C1=C(Cl)C=NN1 BB56-2893 [0,0,0,0,1,0|3,0,0]=4 53 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 BB12-2255 [0,0,0,0,0,1|2,0,0]=3 54 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 BB53-1496 [0,0,0,0,0,1|3,0,0]=4 55 B10R1.10 CC1=CC(\C=N\O)=CC=C1 BB20-3238 [1,1,0,0,0,0|1,0,0]=3 56 B10R1.10 CNCC1=CC(O)=CC=C1 BB12-1357 [1,1,0,0,0,0|1,0,1]=4 57 B10R1.30 O=CC1=C(O)C=CC(Br)=C1 BB17-1585 [1,1,0,0,0,0|1,0,0]=3 58 B10R1.30 O=CC1=CC(I)=CC=C1O BB12-2260 [1,1,0,0,0,0|1,0,0]=3 59 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 BB12-1260 [1,1,0,0,0,0|1,0,0]=3 60 B10R1.176 CC1=C(F)C=C(C=O)C=C1 BB12-2251 [1,1,0,0,0,0|1,0,0]=3 61 B10R1.176 O=CC1=CC(I)=C(O)C=C1 BB17-2246 [1,1,0,0,0,0|1,0,0]=3 62 B10R1.176 O=CC1=CC=C(F)C(Cl)=C1 BB12-4694 [1,1,0,0,0,0|1,0,0]=3 63 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [1,1,0,0,0,0|1,0,0]=3 64 B10R1.13 CC(O)C1=CC=C(N)C=C1 BB12-2291 [1,1,0,0,0,0|1,0,1]=4 65 B10R1.13 CC1=CC=C(C(=N)N)C=C1 BB20-3270 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BB01-7654 [1,1,0,0,0,0|1,0,0]=3 67 B10R1.13 O=C(O)C1=CC=C(O)C=N1 BB56-1848 [1,1,0,0,0,0|1,0,0]=3 68 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BB26-0398 [1,1,0,0,0,0|1,0,0]=3 69 B10R1.13 O=C1C=CC(C(=O)O)=NN1 BB12-2030 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.15 CC(C=O)C1=CC=CC=C1 BB17-2274 [1,1,0,0,0,0|1,0,1]=4 71 B10R1.15 CCC(=O)C1=NC=CC=C1 BB12-2185 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.15 COC(=O)C1=CC=NC=C1 BB20-4674 [1,1,0,0,0,0|1,0,0]=3 73 B10R1.15 N=C(NO)C1=CC=CC=C1 BB20-3129 [1,1,0,0,0,0|1,0,0]=3 74 B10R1.15 N=C(NO)C1=CC=CN=C1 BB20-3167 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.15 N=C(NO)C1=CC=NC=C1 BB20-3168 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.15 NC(CO)C1=CC=CC=C1 BB01-6618 [1,1,0,0,0,0|1,0,1]=4 77 B10R1.15 NCC(=O)C1=CC=CC=C1 BB26-0680 [1,1,0,0,0,0|1,0,0]=3 78 B10R1.15 NNC(=O)C1=CC=CC=C1 BB20-4243 [1,1,0,0,0,0|1,0,0]=3 79 B10R1.15 N\C(=N/O)C1=NC=CC=C1 BB12-3473 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.15 N\N=C(/N)C1=CC=CC=C1 BB10-1016 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.61 NC1=C(C(=O)O)C=CN=C1 BB12-1728 [1,1,0,0,0,0|1,0,0]=3 82 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 BB12-3503 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.61 O=C(O)C1=CN=CNC1=O BB10-0517 [1,1,0,0,0,0|2,0,0]=4 84 B10R1.149 COC(=O)C1=C(Br)C=CS1 BB20-4653 [0,1,0,0,1,0|2,0,0]=4 85 B12R1.19 CC1=CC=C(CC(=O)O)C=C1C BB56-0554 [0,1,0,0,0,1|1,0,0]=3 86 B12R1.19 O=C(O)CC1=CC=C(F)C(F)=C1 BB56-0510 [0,1,0,0,0,1|1,0,0]=3 87 B12R1.50 O=C(CCl)NC1=CC(I)=CC=C1 BB17-1406 [0,1,0,0,0,1|2,0,0]=4 88 B12R1.101 CC1=CC(CC(=O)O)=CC(F)=C1 BB56-2546 [0,1,0,0,0,1|1,0,0]=3 89 B12R1.101 CC1=NC(CC(=O)O)=CC(O)=N1 BB12-2024 [0,1,0,0,0,1|2,0,0]=4 90 B12R1.127 CC(=O)NC1=C(N)C=CC(C)=C1 BB12-1695 [0,1,0,0,0,1|2,0,0]=4 91 B12R1.127 CC(=O)NC1=CC(N)=CC=C1O BB17-2624 [0,1,0,0,0,1|2,0,0]=4 92 B12R1.127 CC1=CC=C(C)C(CC(=O)O)=C1 BB56-0458 [0,1,0,0,0,1|1,0,0]=3 93 B12R1.127 CC1=CC=C(Cl)C(CC(=O)O)=C1 BB56-1010 [0,1,0,0,0,1|1,0,0]=3 94 B12R1.224 CC(=O)NC1=C(C)C(C)=CC=C1 BB17-0870 [0,1,0,0,0,1|2,0,0]=4 95 B12R1.224 CC(=O)NC1=CC=CC(N)=C1C BB17-0584 [0,1,0,0,0,1|2,0,0]=4 96 B12R1.23 NC1=CC=C(S(=O)(=O)O)C=C1Cl BB17-0785 [0,2,0,0,0,0|2,0,0]=4 97 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 BB53-1298 [0,2,0,0,0,0|2,0,0]=4 98 B12R1.48 COC1=C(N)C=C(C(C)=O)C=C1 BB12-0014 [0,2,0,0,0,0|2,0,0]=4 99 B12R1.48 COC1=CNC(C(=O)O)=CC1=O BB26-0368 [0,2,0,0,0,0|1,0,1]=4 100 B12R1.48 COC1=COC(C(=O)O)=CC1=O BB26-0367 [0,2,0,0,0,0|1,0,1]=4 101 B12R1.56 COC1=C(I)C=CC([N+](=O)[O-])=C1 BB12-4663 [0,2,0,0,0,0|1,0,1]=4 102 B12R1.56 NNC1=CC(C(=O)O)=CC=C1Cl BB56-0613 [0,2,0,0,0,0|1,0,0]=3 103 B12R1.232 CC(=O)C1=CC(F)=C(F)C=C1F BB12-2273 [0,2,0,0,0,0|2,0,0]=4 104 B12R1.232 CC1=CC(O)=C(C(=O)O)C=C1C BB12-4724 [0,2,0,0,0,0|1,0,0]=3 105 B12R1.232 NC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 BB12-4680 [0,2,0,0,0,0|1,0,0]=3 106 B12R1.367 CC1=C(C)C=C(C(=O)CCl)C=C1 BB12-1806 [0,2,0,0,0,0|2,0,0]=4 107 B12R1.367 COC(=O)C1=CC(Cl)=C(Br)C=C1 BB17-0831 [0,2,0,0,0,0|1,0,0]=3 108 B12R1.367 COC(=O)C1=CC=C(F)C(Cl)=C1 BB12-4595 [0,2,0,0,0,0|1,0,0]=3 109 B12R1.893 CC1=C(C)C(O)=C(C(=O)O)C=C1 BB17-0815 [0,2,0,0,0,0|1,0,0]=3 110 B12R1.1005 CC1=C(Br)C=C(C(=O)O)C=C1Br BB12-4597 [0,2,0,0,0,0|1,0,0]=3 111 B12R1.1005 CC1=C(Cl)C=C(C(=O)O)C=C1N BB17-0446 [0,2,0,0,0,0|1,0,0]=3 112 B12R1.1005 CC1=C(N)C=C(C(=O)O)C=C1N BB12-4598 [0,2,0,0,0,0|1,0,0]=3 113 B12R1.1005 NC1=C(Cl)C(Cl)=CC(C(=O)O)=C1 BB12-4678 [0,2,0,0,0,0|1,0,0]=3 114 B12R1.1005 O=C(O)C1=CC(Cl)=C(Br)C(Cl)=C1 BB12-4611 [0,2,0,0,0,0|1,0,0]=3 115 B12R1.1005 O=C(O)C1=CC(Cl)=C(Cl)C(Cl)=C1 BB12-4610 [0,2,0,0,0,0|1,0,0]=3 116 B12R1.1005 O=C(O)C1=CC(Cl)=C(I)C(Cl)=C1 BB12-4720 [0,2,0,0,0,0|1,0,0]=3 117 B12R1.354 NNC(=O)C1=C(O)C=CC(Br)=C1 BB12-2571 [0,2,0,0,0,0|2,0,0]=4 118 B12R1.435 CNC(=O)C1=CC=CC(C#N)=C1 BB12-3385 [0,2,0,0,0,0|2,0,0]=4 119 B12R1.435 CNC(=O)C1=CC=CC(C=O)=C1 BB17-2997 [0,2,0,0,0,0|1,0,1]=4 120 B12R1.435 COC(=O)C1=CC=CC(CN)=C1 BB20-4654 [0,2,0,0,0,0|1,0,0]=3 121 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 BB26-0152 [0,2,0,0,0,0|1,0,0]=3 122 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 BB01-6358 [0,2,0,0,0,0|1,0,0]=3 123 B12R1.435 N#CC1=CC(C(=O)NN)=CC=C1 BB12-2651 [0,2,0,0,0,0|2,0,0]=4 124 B12R1.11 COC1=CC(N)=CC([N+](=O)[O-])=C1 BB12-1977 [0,2,0,0,0,0|1,0,1]=4 125 B12R1.511 CC1=CC(Br)=CC(C(=O)O)=C1O BB12-4699 [0,2,0,0,0,0|1,0,0]=3 126 B12R1.511 CC1=CC(Cl)=CC(C(=O)O)=C1O BB17-0394 [0,2,0,0,0,0|1,0,0]=3 127 B12R1.511 CC1=CC(I)=CC(C(=O)O)=C1O BB17-1056 [0,2,0,0,0,0|1,0,0]=3 128 B12R1.511 CC1=CC(N)=CC(C(=O)O)=C1O BB17-0393 [0,2,0,0,0,0|1,0,0]=3 129 B12R1.511 NC(=O)C1=C(I)C(Cl)=CC(Cl)=C1 BB17-0766 [0,2,0,0,0,0|2,0,0]=4 130 B12R1.511 NC1=C(C(=O)O)C=C(Br)C=C1Cl BB17-0405 [0,2,0,0,0,0|1,0,0]=3 131 B12R1.511 NC1=CC(C(=O)O)=C(O)C(Br)=C1 BB12-4652 [0,2,0,0,0,0|1,0,0]=3 132 B12R1.511 NC1=CC(Cl)=CC(C(=O)O)=C1O BB17-0739 [0,2,0,0,0,0|1,0,0]=3 133 B12R1.511 O=C(O)C1=C(Br)C(Cl)=CC(Cl)=C1 BB12-5104 [0,2,0,0,0,0|1,0,0]=3 134 B12R1.511 O=C(O)C1=C(I)C(Cl)=CC(Cl)=C1 BB17-0679 [0,2,0,0,0,0|1,0,0]=3 135 B12R1.511 O=C(O)C1=C(O)C(Br)=CC(Cl)=C1 BB12-4702 [0,2,0,0,0,0|1,0,0]=3 136 B12R1.511 O=C(O)C1=C(O)C(Cl)=CC(Cl)=C1 BB17-0687 [0,2,0,0,0,0|1,0,0]=3 137 B12R1.87 COC1=C(C(N)=O)C=CC=C1C BB17-0496 [0,2,0,0,0,0|2,0,0]=4 138 B12R1.46 COC1=C(C(=O)O)C=C(Cl)C=C1 BB17-0434 [0,2,0,0,0,0|1,0,0]=3 139 B12R1.46 COC1=C(C(N)=O)C=C(Cl)C=C1 BB17-0436 [0,2,0,0,0,0|2,0,0]=4 140 B12R1.46 COC1=C(C(N)=O)C=C(N)C=C1 BB53-1550 [0,2,0,0,0,0|2,0,0]=4 141 B12R1.453 COC1=CC(C(=O)O)=C(O)C=C1 BB12-4643 [0,2,0,0,0,0|0,0,0]=2 142 B12R1.453 COC1=CC([N+](=O)[O-])=C(Cl)C=C1 BB17-0386 [0,2,0,0,0,0|1,0,1]=4 143 B12R1.453 NNC1=CC(C(=O)O)=C(Cl)C=C1 BB17-0985 [0,2,0,0,0,0|1,0,0]=3 144 B12R1.279 CC(=O)C1=CC(N=C=O)=CC=C1 BB01-6564 [0,2,0,0,0,0|1,0,1]=4 145 B12R1.279 O=C(O)C1=CC(N=C=S)=CC=C1 BB12-1379 [0,2,0,0,0,0|0,1,0]=3 146 B10R1.66 CC(=O)\C=C\C1=CC=CO1 BB12-2961 [0,0,1,1,0,0|1,0,0]=3 147 B12R2.202 CC1=C2OC(N)=NC2=CC=C1 BB17-0771 [0,0,0,1,0,1|2,0,0]=4 148 B12R2.202 CC1=CC2=CC=CC(N)=C2O1 BB12-1928 [0,0,0,1,0,1|2,0,0]=4 149 B12R2.202 SC1=NC2=C(O1)C(Cl)=CC=C2 BB12-1564 [0,0,0,1,0,1|1,1,0]=4 150 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 BB56-2371 [0,0,0,1,0,1|2,0,0]=4 151 B12R2.606 CC1=CC2=CC(N)=CC=C2O1 BB12-1929 [0,0,0,1,0,1|2,0,0]=4 152 B12R2.606 CC1=CC=C2NC(=O)NC2=C1 BB12-2964 [0,0,0,1,0,1|2,0,0]=4 153 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 BB12-1457 [0,0,0,1,0,1|2,0,0]=4 154 B12R2.606 CC1=CC=C2OC(=O)NC2=C1 BB12-1458 [0,0,0,1,0,1|1,0,0]=3 155 B12R2.606 NC1=CC=C2NC(O)=NC2=C1 BB26-0788 [0,0,0,1,0,1|2,0,0]=4 156 B12R2.606 NC1=NC2=CC=C(O)C=C2S1 BB12-2129 [0,0,0,1,0,1|2,0,0]=4 157 B12R2.606 O=C1NC2=CC=C(F)C=C2O1 BB12-1459 [0,0,0,1,0,1|2,0,0]=4 158 B12R2.606 OC1=NC2=CC=C(F)C=C2N1 BB17-0211 [0,0,0,1,0,1|2,0,0]=4 159 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 B12R1.226 CC1=CC(NCC(=O)O)=CC=C1 BB12-2587 [0,0,0,0,0,2|1,0,0]=3 163 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 BB12-2907 [0,0,0,0,0,2|1,0,0]=3 164 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 BB17-0708 [0,0,0,0,0,2|1,0,0]=3 165 B12R1.226 O=C(O)\C=C\C1=CC(I)=CC=C1 BB56-2320 [0,0,0,0,0,2|1,0,0]=3