0 B9R1.6 B(C1=CN=CC=C1)(O)O 5559 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.6 B(C1=CN=CN=C1)(O)O 5196 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.6 C1=CC=C(C=C1)C(=O)O 9205 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.6 C1=CC=C(C=C1)C(=S)N 5715 [0,0,0,0,0,0|1,1,0]=2 4 B9R1.6 C1=CC=C(C=C1)P(=O)O 5787 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.6 C1=CC=C(C=C1)S(=O)O 5284 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 C1=CC=NC(=C1)C(=S)N 6571 [0,0,0,0,0,0|2,1,0]=3 7 B9R1.6 C1=CN=C(C=N1)C(=O)O 6728 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 C1=CN=CC=C1C(=S)N 6572 [0,0,0,0,0,0|2,1,0]=3 9 B9R1.6 C1=CN=CN=C1C(=O)O 10206 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.6 C1=CN=CN=C1C(=O)O 6729 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.6 CC(=O)C1=NC=CN=C1 6119 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.6 c1ccnc(c1)C(=O)O P2885 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.6 c1cncnc1C(=O)O P8990 [0,0,0,0,0,0|4,0,0]=4 14 B8R1.2 C1=CC(=CN=C1)CCl 5990 [1,0,0,0,0,0|1,0,1]=3 15 B8R1.2 C1=CC(=CN=C1)CN 10146 [1,0,0,0,0,0|0,0,1]=2 16 B8R1.2 C1=CC(=CN=C1)CO 8600 [1,0,0,0,0,0|0,0,2]=3 17 B8R1.2 C1=CC=C(C=C1)NN 6820 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.2 C1=CC=NC(=C1)CN 5496 [1,0,0,0,0,0|2,0,1]=4 19 B8R1.2 C1=CN=C(C=N1)C#N 6122 [1,0,0,0,0,0|1,0,2]=4 20 B8R1.2 c1ccnc(c1)C=O P0092 [1,0,0,0,0,0|2,0,0]=3 21 B8R1.2 c1cnccc1C=O P0128 [1,0,0,0,0,0|2,0,0]=3 22 B8R1.2 c1cnccc1C=O P0128 [1,0,0,0,0,0|2,0,0]=3 23 B10R1.13 B(C1=CN=C(C=C1)F)(O)O 5214 [0,1,0,0,0,0|2,0,1]=4 24 B10R1.13 C1=C(C=NC(=N1)N)[N+](=O)[O-] 9984 [0,1,0,0,0,0|3,0,0]=4 25 B10R1.13 C1=C(N=CC(=N1)Cl)C(=O)O 8658 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.13 C1=CC(=CC=C1C(=N)N)Cl 8212 [0,1,0,0,0,0|2,0,0]=3 27 B10R1.13 C1=CC(=CC=C1C(=O)Cl)F 9898 [0,1,0,0,0,0|2,0,0]=3 28 B10R1.13 C1=CC(=CC=C1C(=O)O)Cl 6827 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.13 C1=CC(=CC=C1C(=O)O)F 5362 [0,1,0,0,0,0|2,0,0]=3 30 B10R1.13 C1=CC(=CC=C1C(=O)O)F 8250 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.13 C1=CC(=CC=C1C(=S)N)Cl 10635 [0,1,0,0,0,0|1,1,0]=3 32 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])Br 10151 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])F 6117 [0,1,0,0,0,0|3,0,0]=4 34 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])[O-] 10257 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.13 C1=CC(=NC=C1C(=O)O)Br 6594 [0,1,0,0,0,0|1,0,0]=2 36 B10R1.13 C1=CC(=NC=C1C(=O)O)F 8791 [0,1,0,0,0,0|1,0,0]=2 37 B10R1.13 C1=CC(=NC=C1C(=O)O)N 5220 [0,1,0,0,0,0|1,0,0]=2 38 B10R1.13 C1=CC(=NC=C1Cl)C(=O)O 9363 [0,1,0,0,0,0|3,0,0]=4 39 B10R1.13 C1=CC(=NC=C1N)C(=O)O 5702 [0,1,0,0,0,0|3,0,0]=4 40 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Br 5468 [0,1,0,0,0,0|2,0,0]=3 41 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Cl 5205 [0,1,0,0,0,0|2,0,0]=3 42 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])F 8260 [0,1,0,0,0,0|2,0,0]=3 43 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])N 8018 [0,1,0,0,0,0|2,0,0]=3 44 B10R1.13 C1=CC(=NN=C1C(=O)O)Cl 6730 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.13 C1=CC(=O)NC=C1C(=O)O 9694 [0,1,0,0,0,0|1,0,1]=3 46 B10R1.13 C1=C[N+](=CC=C1C(=O)O)[O-] 8865 [0,1,0,0,0,0|3,0,0]=4 47 B10R1.13 CC(=O)C1=CC=C(C=C1)I 9277 [0,1,0,0,0,0|2,0,0]=3 48 B10R1.13 CC(=O)C1=CC=C(C=C1)O 8298 [0,1,0,0,0,0|2,0,0]=3 49 B10R1.13 CC(=O)C1=CN=C(C=C1)Cl 9976 [0,1,0,0,0,0|1,0,0]=2 50 B10R1.13 CC1=CC=C(C=C1)C(=O)O 9874 [0,1,0,0,0,0|2,0,0]=3 51 B10R1.13 CC1=NC=C(N=C1)C(=O)O 9695 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] N0068 [0,1,0,0,0,0|3,0,0]=4 53 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] N0068 [0,1,0,0,0,0|3,0,0]=4 54 B10R1.13 c1cc(ccc1[N+](=O)[O-])O N0023 [0,1,0,0,0,0|3,0,0]=4 55 B10R1.15 C1=CC(=CN=C1)C(=NO)N 9520 [0,1,0,0,0,0|0,0,1]=2 56 B10R1.15 C1=CC(=CN=C1)C(=O)NN 6873 [0,1,0,0,0,0|0,0,0]=1 57 B10R1.15 C1=CC=C(C=C1)C(=O)CN 5484 [0,1,0,0,0,0|1,0,0]=2 58 B10R1.15 C1=CN=CC=C1C(=O)NN 8671 [0,1,0,0,0,0|2,0,0]=3 59 B10R1.15 CC(CN)C1=CC=CC=C1 9559 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.15 COC(=O)C1=CC=NC=C1 9961 [0,1,0,0,0,0|3,0,0]=4 61 B10R1.15 COC(=O)C1=CN=CC=C1 6793 [0,1,0,0,0,0|1,0,0]=2 62 B10R1.28 C1=CC(=CN=C1)C(F)(F)F 8366 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.28 C1=CC(=CN=C1)S(=O)(=O)Cl 5085 [0,1,0,0,0,0|2,0,0]=3 64 B10R1.28 C1=CC(=CN=C1)S(=O)(=O)Cl 8852 [0,1,0,0,0,0|2,0,0]=3 65 B10R1.28 C1=CC=C(C=C1)S(=N)(=O)O 5501 [0,1,0,0,0,0|2,0,1]=4 66 B10R1.28 c1cc(cnc1)S(=O)(=O)Cl P4868 [0,1,0,0,0,0|2,0,0]=3 67 B10R1.28 c1cc(cnc1)S(=O)(=O)Cl P4869 [0,1,0,0,0,0|2,0,0]=3 68 B10R1.28 c1cc(cnc1)S(=O)(=O)O P0398 [0,1,0,0,0,0|2,0,0]=3 69 B10R1.61 C1=CC(=C(N=C1)Br)C(=O)O 5226 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.61 C1=CC(=C(N=C1)C(=O)O)N 10236 [0,1,0,0,0,0|3,0,0]=4 71 B10R1.61 C1=CC(=C(N=C1)Cl)C(=O)O 5074 [0,1,0,0,0,0|1,0,0]=2 72 B10R1.61 C1=CC(=C(N=C1)Cl)C(=O)O 9565 [0,1,0,0,0,0|1,0,0]=2 73 B10R1.61 C1=CC(=C(N=C1)Cl)[N+](=O)[O-] 5452 [0,1,0,0,0,0|2,0,0]=3 74 B10R1.61 C1=CC(=C(N=C1)F)C(=O)O 6239 [0,1,0,0,0,0|1,0,0]=2 75 B10R1.61 C1=CC(=C(N=C1)N)C(=O)O 8982 [0,1,0,0,0,0|1,0,0]=2 76 B10R1.61 C1=CC(=C(N=C1)N)[N+](=O)[O-] 6721 [0,1,0,0,0,0|2,0,0]=3 77 B10R1.61 C1=CC=C(C(=C1)C(=O)N)F 6116 [0,1,0,0,0,0|1,0,0]=2 78 B10R1.61 C1=CC=C(C(=C1)C(=O)O)F 10438 [0,1,0,0,0,0|2,0,0]=3 79 B10R1.61 C1=CC=C(C(=C1)C(=O)O)F 5361 [0,1,0,0,0,0|2,0,0]=3 80 B10R1.61 C1=CC=C(C(=C1)C(=O)O)I 10195 [0,1,0,0,0,0|2,0,0]=3 81 B10R1.61 C1=CC=C(C(=C1)C(=S)N)I 9519 [0,1,0,0,0,0|1,1,0]=3 82 B10R1.61 C1=CN=CC(=C1Br)C(=O)O 10508 [0,1,0,0,0,0|1,0,0]=2 83 B10R1.61 C1=CN=CC(=C1C(=O)O)Br 8123 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.61 C1=CN=CC(=C1C(=O)O)Cl 5213 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.61 C1=CN=CC(=C1C(=O)O)F 5201 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.61 C1=CN=CC(=C1C(=O)O)O 10190 [0,1,0,0,0,0|3,0,0]=4 87 B10R1.61 C1=CN=CC(=C1Cl)C(=O)O 9319 [0,1,0,0,0,0|1,0,0]=2 88 B10R1.61 C1=CN=CC(=C1Cl)[N+](=O)[O-] 8264 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.61 C1=CN=CC(=C1N)C(=O)O 9973 [0,1,0,0,0,0|1,0,0]=2 90 B10R1.61 C1=CNC(=O)C(=C1)[N+](=O)[O-] 9986 [0,1,0,0,0,0|2,0,1]=4 91 B10R1.61 CC(=O)C1=C(N=CC=C1)Cl 10697 [0,1,0,0,0,0|1,0,0]=2 92 B10R1.61 CC(=O)C1=CC=CC=C1Cl 6154 [0,1,0,0,0,0|2,0,0]=3 93 B10R1.61 CC(=O)C1=CC=CC=C1F 5580 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.61 CC(=O)C1=CC=CC=C1F 6042 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.61 CC1=C(C=CC=N1)C(=O)O 8461 [0,1,0,0,0,0|1,0,0]=2 96 B10R1.61 CC1=NC=CN=C1C(=O)C 6120 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.113 C1=C(C=C(C=C1)I)[N+](=O)[O-] 10012 [0,1,0,0,0,0|3,0,0]=4 98 B10R1.113 C1=C(C=NC=C1Br)C(=O)N 5683 [0,1,0,0,0,0|0,0,0]=1 99 B10R1.113 C1=C(C=NC=C1Cl)C(=O)O 10525 [0,1,0,0,0,0|1,0,0]=2 100 B10R1.113 C1=C(C=NC=C1N)C(=O)O 9365 [0,1,0,0,0,0|1,0,0]=2 101 B10R1.113 C1=C(C=NC=C1O)C(=O)O 5442 [0,1,0,0,0,0|1,0,0]=2 102 B10R1.113 C1=CC(=CC(=C1)F)C(=O)Cl 8192 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.113 C1=CC(=CC(=C1)F)C(=O)O 6085 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.113 C1=CC(=CC(=C1)F)[N+](=O)[O-] 5276 [0,1,0,0,0,0|3,0,0]=4 105 B10R1.113 C1=CC(=CC(=C1)I)C(=O)O 8319 [0,1,0,0,0,0|2,0,0]=3 106 B10R1.113 C1=CC(=NC(=C1)Cl)C(=O)O 5646 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.113 C1=CC(=NC(=C1)Cl)C(=O)O 5677 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.113 C1=CC(=NC(=C1)N)C(=O)O 5464 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.113 C1=CC(=O)NC(=C1)C(=O)O 6697 [0,1,0,0,0,0|3,0,0]=4 110 B10R1.113 C1=CN=C(C=C1Br)C(=O)O 5698 [0,1,0,0,0,0|3,0,0]=4 111 B10R1.113 C1=CN=C(C=C1C(=O)N)Cl 5659 [0,1,0,0,0,0|2,0,0]=3 112 B10R1.113 C1=CN=C(C=C1C(=O)O)Cl 6443 [0,1,0,0,0,0|3,0,0]=4 113 B10R1.113 C1=CN=C(C=C1Cl)C(=O)O 9386 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.113 C1=CNC(=O)C=C1C(=O)O 5040 [0,1,0,0,0,0|3,0,0]=4 115 B10R1.113 C1=CNC(=O)C=C1C(=O)O 8855 [0,1,0,0,0,0|3,0,0]=4 116 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl 10105 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.113 CC(=O)C1=CC(=CC=C1)F 8337 [0,1,0,0,0,0|2,0,0]=3 118 B10R1.113 CC(=O)C1=CC(=CC=C1)I 6861 [0,1,0,0,0,0|2,0,0]=3 119 B10R1.113 CC(=O)C1=CC(=CC=C1)O 5263 [0,1,0,0,0,0|2,0,0]=3 120 B10R1.113 CC(=O)C1=NC(=CC=C1)Br 10007 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.113 CC1=CN=CC(=C1)C(=O)O 9194 [0,1,0,0,0,0|1,0,0]=2 122 B8R1.7 C1=C(C=NN1)C(=O)O 9820 [0,0,0,0,1,0|2,0,0]=3 123 B8R1.7 C1=C(C=NN1)[N+](=O)[O-] 9369 [0,0,0,0,1,0|3,0,0]=4 124 B8R1.7 C1=C(NC=N1)C(=O)O 6466 [0,0,0,0,1,0|2,0,0]=3 125 B8R1.7 C1=C(NN=C1)C(=O)O 5200 [0,0,0,0,1,0|2,0,0]=3 126 B8R1.7 C1=C(NN=C1)[N+](=O)[O-] 10423 [0,0,0,0,1,0|3,0,0]=4 127 B8R1.7 C1=C(NN=C1)[N+](=O)[O-] 10509 [0,0,0,0,1,0|3,0,0]=4 128 B8R1.7 C1=C(ON=C1)C(=O)O 6510 [0,0,0,0,1,0|2,0,0]=3 129 B8R1.7 C1=CN=C(N1)[N+](=O)[O-] 6645 [0,0,0,0,1,0|3,0,0]=4 130 B8R1.7 C1=CNC(=C1)C(=O)O 8130 [0,0,0,0,1,0|1,0,1]=3 131 B8R1.7 C1=CON=C1C(=O)O I8529 [0,0,0,0,1,0|2,0,0]=3 132 B8R1.7 C1=CSC(=C1)C(=O)O 5487 [0,0,0,0,1,0|2,0,0]=3 133 B8R1.7 C1=CSC(=C1)C(=O)[O-] 8282 [0,0,0,0,1,0|2,0,0]=3 134 B8R1.7 C1=CSC(=N1)C(=O)O 9615 [0,0,0,0,1,0|2,0,0]=3 135 B8R1.7 C1=NNC(=N1)C(=O)O 10072 [0,0,0,0,1,0|3,0,0]=4 136 B8R1.7 CC(=O)C1=CC=CS1 8482 [0,0,0,0,1,0|2,0,0]=3 137 B8R1.7 CC(=O)C1=CC=CS1 8660 [0,0,0,0,1,0|2,0,0]=3 138 B8R1.7 CC(=O)C1=NC=CS1 10337 [0,0,0,0,1,0|2,0,0]=3 139 B8R1.7 c1cnc([nH]1)[N+](=O)[O-] N0026 [0,0,0,0,1,0|3,0,0]=4 140 B10R1.18 C1=CC(=CN=C1)CC(=O)O 9059 [0,0,0,0,0,1|1,0,0]=2 141 B10R1.18 C1=CC=C(C=C1)NC(=O)N 10186 [0,0,0,0,0,1|1,0,0]=2 142 B10R1.18 C1=CC=C(C=C1)NC(=O)N 6814 [0,0,0,0,0,1|1,0,0]=2 143 B7R1.3 C1=C(C=NC=N1)Br 5441 [2,0,0,0,0,0|2,0,0]=4 144 B7R1.3 C1=C(C=NC=N1)N 10659 [2,0,0,0,0,0|1,0,0]=3 145 B7R1.3 C1=CC(=CN=C1)N 9511 [2,0,0,0,0,0|0,0,0]=2 146 B7R1.3 C1=CC(=CN=C1)O 6695 [2,0,0,0,0,0|0,0,1]=3 147 B7R1.3 C1=CC(=CN=C1)O 6696 [2,0,0,0,0,0|0,0,1]=3 148 B7R1.3 C1=CC=C(C=C1)F 5387 [2,0,0,0,0,0|2,0,0]=4 149 B7R1.3 C1=CC=C(C=C1)O 5847 [2,0,0,0,0,0|1,0,1]=4 150 B7R1.3 C1=CN=C(C=N1)Cl 5278 [2,0,0,0,0,0|2,0,0]=4 151 B7R1.3 C1=CN=C(C=N1)N 6677 [2,0,0,0,0,0|1,0,0]=3 152 B7R1.3 CC1=CN=CC=C1 8633 [2,0,0,0,0,0|0,0,1]=3 153 B7R1.3 c1c(cncn1)Br B0314 [2,0,0,0,0,0|2,0,0]=4 154 B7R1.3 c1ccc(cc1)F B0042 [2,0,0,0,0,0|2,0,0]=4 155 B9R1.1 C1=CC(=CC=C1C=O)F 6034 [1,1,0,0,0,0|1,0,0]=3 156 B9R1.1 C1=CC(=CC=C1C=O)I 5018 [1,1,0,0,0,0|1,0,0]=3 157 B9R1.1 C1=CC(=CC=C1C=O)O 5740 [1,1,0,0,0,0|1,0,0]=3 158 B9R1.1 C1=CC(=CC=C1CN)Br 8072 [1,1,0,0,0,0|1,0,1]=4 159 B9R1.1 C1=CC(=CC=C1CN)F 5139 [1,1,0,0,0,0|1,0,1]=4 160 B9R1.1 C1=CC(=CC=C1CN)O 8602 [1,1,0,0,0,0|1,0,1]=4 161 B9R1.1 C1=CC(=CC=C1NN)Br 5240 [1,1,0,0,0,0|2,0,0]=4 162 B9R1.1 C1=CC(=CC=C1NN)Cl 10440 [1,1,0,0,0,0|2,0,0]=4 163 B9R1.1 C1=CC(=CC=C1NN)F 5594 [1,1,0,0,0,0|2,0,0]=4 164 B9R1.1 C1=CC(=NC=C1Br)C=O 5008 [1,1,0,0,0,0|2,0,0]=4 165 B9R1.1 C1=CC(=NC=C1C#N)Cl 9222 [1,1,0,0,0,0|0,0,2]=4 166 B9R1.1 C1=CC(=NC=C1C#N)F 8692 [1,1,0,0,0,0|0,0,2]=4 167 B9R1.1 C1=CC(=NC=C1C#N)N 9207 [1,1,0,0,0,0|0,0,2]=4 168 B9R1.1 C1=CC(=NC=C1C=O)Cl 5230 [1,1,0,0,0,0|0,0,0]=2 169 B9R1.1 C1=CC(=NC=C1CCl)Cl 5674 [1,1,0,0,0,0|1,0,1]=4 170 B9R1.1 C=CC1=CC=C(C=C1)N 6013 [1,1,0,0,0,0|2,0,0]=4 171 B9R1.1 CC1=CC=C(C=C1)CN 9612 [1,1,0,0,0,0|1,0,1]=4 172 B9R1.2 C1=C(C=NC=C1Br)C#N 5232 [1,1,0,0,0,0|0,0,2]=4 173 B9R1.2 C1=C(C=NC=C1Br)C=O 6653 [1,1,0,0,0,0|0,0,0]=2 174 B9R1.2 C1=CC(=CC(=C1)Br)C=O 8210 [1,1,0,0,0,0|1,0,0]=3 175 B9R1.2 C1=CC(=CC(=C1)Br)CN 9996 [1,1,0,0,0,0|1,0,1]=4 176 B9R1.2 C1=CC(=CC(=C1)Br)NN 10008 [1,1,0,0,0,0|2,0,0]=4 177 B9R1.2 C1=CC(=CC(=C1)Cl)NN 9850 [1,1,0,0,0,0|2,0,0]=4 178 B9R1.2 C1=CC(=CC(=C1)F)C=O 9272 [1,1,0,0,0,0|1,0,0]=3 179 B9R1.2 C1=CC(=CC(=C1)F)NN 5986 [1,1,0,0,0,0|2,0,0]=4 180 B9R1.2 C1=CC(=CC(=C1)I)C=O 9442 [1,1,0,0,0,0|1,0,0]=3 181 B9R1.2 C1=CC(=NC(=C1)Br)C=O 8472 [1,1,0,0,0,0|2,0,0]=4 182 B9R1.2 CC1=CC=CC(=C1)C=O 8187 [1,1,0,0,0,0|1,0,0]=3 183 B9R1.2 CC1=CC=CC(=N1)C=O 10415 [1,1,0,0,0,0|2,0,0]=4 184 B9R1.2 COC1=CC(=CN=C1)Br 10627 [1,1,0,0,0,0|2,0,0]=4 185 B9R1.2 COC1=CC(=CN=C1)Br 5648 [1,1,0,0,0,0|2,0,0]=4 186 B9R1.8 C1=CC=C(C=C1)CON 10183 [1,1,0,0,0,0|1,0,1]=4 187 B9R1.15 C1=CC(=C(N=C1)Cl)C#N 5375 [1,1,0,0,0,0|0,0,2]=4 188 B9R1.15 C1=CC(=C(N=C1)Cl)CO 6736 [1,1,0,0,0,0|0,0,2]=4 189 B9R1.15 C1=CC(=C(N=C1)F)C#N 5238 [1,1,0,0,0,0|0,0,2]=4 190 B9R1.15 C1=CC(=C(N=C1)N)C=O 9322 [1,1,0,0,0,0|0,0,0]=2 191 B9R1.15 C1=CC=C(C(=C1)C=O)O 5096 [1,1,0,0,0,0|1,0,0]=3 192 B9R1.15 C1=CC=C(C(=C1)CN)Br 8860 [1,1,0,0,0,0|1,0,1]=4 193 B9R1.15 C1=CC=C(C(=C1)CN)Cl 9625 [1,1,0,0,0,0|1,0,1]=4 194 B9R1.15 C1=CC=C(C(=C1)CN)F 8921 [1,1,0,0,0,0|1,0,1]=4 195 B9R1.15 C1=CC=C(C(=C1)NN)F 5985 [1,1,0,0,0,0|2,0,0]=4 196 B9R1.15 COC1=C(N=CC=C1)Cl 9004 [1,1,0,0,0,0|2,0,0]=4 197 B9R1.11 CCC(=O)C1=CC=CS1 10053 [0,1,0,0,1,0|2,0,0]=4 198 B9R1.11 COC(=O)C1=CC=NN1 6618 [0,1,0,0,1,0|2,0,0]=4 199 B9R1.11 COC(=O)C1=CN=CN1 10237 [0,1,0,0,1,0|2,0,0]=4 200 B9R1.35 C1=C(OC(=C1)Br)C(=O)O 6446 [0,1,0,0,1,0|2,0,0]=4 201 B9R1.35 C1=C(SC(=C1)Br)C(=O)O 6855 [0,1,0,0,1,0|2,0,0]=4 202 B9R1.35 C1=C(SC(=C1)Cl)C(=O)Cl 10677 [0,1,0,0,1,0|2,0,0]=4 203 B9R1.35 C1=C(SC(=N1)Br)C(=O)O 5706 [0,1,0,0,1,0|2,0,0]=4 204 B9R1.35 C1=C(SC=C1Br)C(=O)O 5005 [0,1,0,0,1,0|2,0,0]=4 205 B9R1.35 CC(=O)C1=CC=C(S1)Br 9665 [0,1,0,0,1,0|2,0,0]=4 206 B9R1.35 CC1=CC=C(S1)C(=O)C 10140 [0,1,0,0,1,0|2,0,0]=4 207 B9R1.35 CC1=CC=C(S1)C(=O)O 6693 [0,1,0,0,1,0|2,0,0]=4 208 B9R1.35 CN1C=C(C=N1)C(=O)O 5080 [0,1,0,0,1,0|2,0,0]=4 209 B9R1.35 CN1C=C(N=C1)C(=O)O 8619 [0,1,0,0,1,0|2,0,0]=4 210 B9R1.41 C1=CSC(=C1Br)C(=O)O 5474 [0,1,0,0,1,0|2,0,0]=4 211 B9R1.41 C1=CSC(=C1N)C(=O)N 6479 [0,1,0,0,1,0|1,0,0]=3 212 B9R1.41 C1=NNC(=C1C(=O)N)N 6705 [0,1,0,0,1,0|1,0,0]=3 213 B9R1.41 C1=NNC(=C1C(=O)O)N 8614 [0,1,0,0,1,0|2,0,0]=4 214 B9R1.41 CC1=C(SC=N1)C(=O)O 8869 [0,1,0,0,1,0|2,0,0]=4 215 B9R1.41 CN1C(=CC=N1)C(=O)O 8611 [0,1,0,0,1,0|2,0,0]=4 216 B9R1.41 Cc1ccoc1C(=O)O M0024 [0,1,0,0,1,0|2,0,0]=4 217 B11R1.20 C1=CC(=CC=C1CC(=O)O)Br 5312 [0,1,0,0,0,1|2,0,0]=4 218 B11R1.20 C1=CC(=CC=C1CC(=O)O)F 9282 [0,1,0,0,0,1|2,0,0]=4 219 B11R1.20 C1=CC(=CC=C1CC(=O)O)I 6666 [0,1,0,0,0,1|2,0,0]=4 220 B11R1.20 C1=CC(=CC=C1CC(=O)O)N 6676 [0,1,0,0,0,1|2,0,0]=4 221 B11R1.20 C1=CC(=CC=C1NC(=S)N)F 8121 [0,1,0,0,0,1|1,1,0]=4 222 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl 5593 [0,1,0,0,0,1|2,0,0]=4 223 B11R1.20 CC(=O)Nc1ccc(cc1)O A0029 [0,1,0,0,0,1|2,0,0]=4 224 B11R1.36 C1=CC=C(C=C1)C(C(=O)O)O 9216 [0,1,0,0,0,1|2,0,0]=4 225 B11R1.36 CC(C1=CC=CC=C1)C(=O)O 9014 [0,1,0,0,0,1|2,0,0]=4 226 B11R1.86 C1=CC=C(C(=C1)CC(=O)O)Br 5311 [0,1,0,0,0,1|2,0,0]=4 227 B11R1.86 C1=CC=C(C(=C1)CC(=O)O)I 8438 [0,1,0,0,0,1|2,0,0]=4 228 B11R1.86 CC1=CC=CC=C1CC(=O)O 6025 [0,1,0,0,0,1|2,0,0]=4 229 B11R1.86 CC1=CC=CC=C1NC(=S)N 8725 [0,1,0,0,0,1|1,1,0]=4 230 B11R1.157 C1=CC(=CC(=C1)Br)CC(=O)O 6004 [0,1,0,0,0,1|2,0,0]=4 231 B11R1.157 C1=CC(=CC(=C1)Cl)CC(=O)O 10404 [0,1,0,0,0,1|2,0,0]=4 232 B11R1.157 C1=CC(=CC(=C1)F)CC(=O)[O-] 10031 [0,1,0,0,0,1|2,0,0]=4 233 B11R1.157 C1=CC(=CC(=C1)N)CC(=O)O 8680 [0,1,0,0,0,1|2,0,0]=4 234 B11R1.157 C1=CC(=CC(=C1)O)CC(=O)O 10176 [0,1,0,0,0,1|2,0,0]=4 235 B11R1.157 CC(=O)NC1=CC(=CC=C1)F 8345 [0,1,0,0,0,1|2,0,0]=4 236 B11R1.3 C1=CC(=CC=C1C=O)C(=O)O 6784 [0,2,0,0,0,0|2,0,0]=4 237 B11R1.3 C1=CC(=CC=C1CN)C(=O)O 6756 [0,2,0,0,0,0|2,0,0]=4 238 B11R1.3 CC(=O)C1=CC=C(C=C1)C#N 6778 [0,2,0,0,0,0|2,0,0]=4 239 B11R1.3 COC1=CC=C(C=C1)C(=O)O 10197 [0,2,0,0,0,0|2,0,0]=4 240 B11R1.3 COC1=NC=C(C=C1)C(=O)O 6684 [0,2,0,0,0,0|1,0,0]=3 241 B11R1.19 C1=CC(=CC=C1F)S(=O)(=O)N 5136 [0,2,0,0,0,0|2,0,0]=4 242 B11R1.19 C1=CC(=CC=C1F)S(=O)(=O)N 6297 [0,2,0,0,0,0|2,0,0]=4 243 B11R1.21 C1=C(C=NC(=C1Br)Cl)[N+](=O)[O-] 8618 [0,2,0,0,0,0|2,0,0]=4 244 B11R1.21 C1=C(C=NC(=C1Cl)Cl)[N+](=O)[O-] 8502 [0,2,0,0,0,0|2,0,0]=4 245 B11R1.21 C1=CC(=C(C=C1C(=O)Cl)Cl)F 6379 [0,2,0,0,0,0|2,0,0]=4 246 B11R1.21 C1=CC(=C(C=C1C(=O)N)Cl)F 6189 [0,2,0,0,0,0|1,0,0]=3 247 B11R1.21 C1=CC(=C(C=C1C(=O)N)F)F 6205 [0,2,0,0,0,0|1,0,0]=3 248 B11R1.21 C1=CC(=C(C=C1C(=O)O)Br)Cl 6852 [0,2,0,0,0,0|2,0,0]=4 249 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)Br 10653 [0,2,0,0,0,0|2,0,0]=4 250 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)F 5565 [0,2,0,0,0,0|2,0,0]=4 251 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)N 10388 [0,2,0,0,0,0|2,0,0]=4 252 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)Cl 6223 [0,2,0,0,0,0|2,0,0]=4 253 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)F 10520 [0,2,0,0,0,0|2,0,0]=4 254 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)N 8422 [0,2,0,0,0,0|2,0,0]=4 255 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)O 9542 [0,2,0,0,0,0|2,0,0]=4 256 B11R1.21 C1=CC(=C(C=C1C(=O)O)I)Cl 10576 [0,2,0,0,0,0|2,0,0]=4 257 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)Cl 8056 [0,2,0,0,0,0|2,0,0]=4 258 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)F 8984 [0,2,0,0,0,0|2,0,0]=4 259 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)O 10466 [0,2,0,0,0,0|2,0,0]=4 260 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)O 8891 [0,2,0,0,0,0|2,0,0]=4 261 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Br 6438 [0,2,0,0,0,0|2,0,0]=4 262 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)F 5378 [0,2,0,0,0,0|2,0,0]=4 263 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)F 6468 [0,2,0,0,0,0|2,0,0]=4 264 B11R1.21 CC1=C(C=C(C=C1)C(=O)C)F 8214 [0,2,0,0,0,0|2,0,0]=4 265 B11R1.21 CC1=C(C=C(C=C1)C(=O)Cl)F 5569 [0,2,0,0,0,0|2,0,0]=4 266 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)C 10163 [0,2,0,0,0,0|1,0,0]=3 267 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)F 8586 [0,2,0,0,0,0|1,0,0]=3 268 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Cl 6856 [0,2,0,0,0,0|2,0,0]=4 269 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)F 5127 [0,2,0,0,0,0|2,0,0]=4 270 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)F 8978 [0,2,0,0,0,0|2,0,0]=4 271 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I 6495 [0,2,0,0,0,0|2,0,0]=4 272 B11R1.21 CC1=C(C=CC(=C1)C(=O)Cl)F 6280 [0,2,0,0,0,0|2,0,0]=4 273 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Br 6529 [0,2,0,0,0,0|2,0,0]=4 274 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Cl 10036 [0,2,0,0,0,0|2,0,0]=4 275 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)I 8691 [0,2,0,0,0,0|2,0,0]=4 276 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)N 5197 [0,2,0,0,0,0|2,0,0]=4 277 B11R1.21 CC1=CC(=CN=C1Cl)[N+](=O)[O-] 6648 [0,2,0,0,0,0|2,0,0]=4 278 B11R1.22 C1=CC(=CC=C1C(=O)C=O)F 6237 [0,2,0,0,0,0|2,0,0]=4 279 B11R1.22 C1=CC(=CC=C1C(=O)CBr)Br 5388 [0,2,0,0,0,0|2,0,0]=4 280 B11R1.22 C1=CC(=CC=C1C(=O)CBr)Cl 8413 [0,2,0,0,0,0|2,0,0]=4 281 B11R1.22 C1=CC(=CC=C1C(=O)CBr)F 5562 [0,2,0,0,0,0|2,0,0]=4 282 B11R1.22 C1=CC(=CC=C1C(=O)CBr)F 6515 [0,2,0,0,0,0|2,0,0]=4 283 B11R1.22 C1=CC(=CC=C1C(=O)CBr)O 10265 [0,2,0,0,0,0|2,0,0]=4 284 B11R1.22 C1=CC(=CC=C1C(=O)NN)Br 5721 [0,2,0,0,0,0|1,0,0]=3 285 B11R1.22 C1=CC(=CC=C1C(=O)NN)F 8576 [0,2,0,0,0,0|1,0,0]=3 286 B11R1.22 C1=CC(=CC=C1C(=O)NN)I 6553 [0,2,0,0,0,0|1,0,0]=3 287 B11R1.22 COC(=O)C1=CC=C(C=C1)N 6641 [0,2,0,0,0,0|2,0,0]=4 288 B11R1.22 COC(=O)C1=CN=C(C=C1)N 5257 [0,2,0,0,0,0|1,0,0]=3 289 B11R1.22 COC(=O)C1=CN=C(C=C1)N 9348 [0,2,0,0,0,0|1,0,0]=3 290 B11R1.166 C1=C(C(=CN=C1Cl)C(=O)O)Cl 8416 [0,2,0,0,0,0|1,0,0]=3 291 B11R1.166 C1=CC(=C(C=C1Br)Br)C(=O)O 9828 [0,2,0,0,0,0|2,0,0]=4 292 B11R1.166 C1=CC(=C(C=C1Br)Cl)C(=O)O 5684 [0,2,0,0,0,0|2,0,0]=4 293 B11R1.166 C1=CC(=C(C=C1Br)F)C(=O)O 9928 [0,2,0,0,0,0|2,0,0]=4 294 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)O 6787 [0,2,0,0,0,0|2,0,0]=4 295 B11R1.166 C1=CC(=C(C=C1Cl)F)C(=O)O 6191 [0,2,0,0,0,0|2,0,0]=4 296 B11R1.166 C1=CC(=C(C=C1Cl)I)C(=O)O 5553 [0,2,0,0,0,0|2,0,0]=4 297 B11R1.166 C1=CC(=C(C=C1Cl)O)C(=O)O 5117 [0,2,0,0,0,0|2,0,0]=4 298 B11R1.166 C1=CC(=C(C=C1F)Br)C(=O)O 6240 [0,2,0,0,0,0|2,0,0]=4 299 B11R1.166 C1=CC(=C(C=C1F)Br)C(=O)O 9681 [0,2,0,0,0,0|2,0,0]=4 300 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)Cl 6193 [0,2,0,0,0,0|2,0,0]=4 301 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)O 5349 [0,2,0,0,0,0|2,0,0]=4 302 B11R1.166 C1=CC(=C(C=C1F)F)C(=O)Cl 6207 [0,2,0,0,0,0|2,0,0]=4 303 B11R1.166 C1=CC(=C(C=C1F)F)C(=O)N 9781 [0,2,0,0,0,0|1,0,0]=3 304 B11R1.166 C1=CC(=C(C=C1F)N)C(=O)O 10307 [0,2,0,0,0,0|2,0,0]=4 305 B11R1.166 C1=CC(=C(C=C1N)F)C(=O)[O-] 6630 [0,2,0,0,0,0|2,0,0]=4 306 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O 6786 [0,2,0,0,0,0|2,0,0]=4 307 B11R1.166 C1=CC(=C(C=C1O)Cl)C(=O)O 8738 [0,2,0,0,0,0|2,0,0]=4 308 B11R1.166 C1=CC(=C(C=C1O)F)C(=O)O 5209 [0,2,0,0,0,0|2,0,0]=4 309 B11R1.166 C1=CC(=NC(=C1C(=O)O)Cl)Cl 5307 [0,2,0,0,0,0|1,0,0]=3 310 B11R1.166 C1=CC(=NC(=C1[N+](=O)[O-])Cl)Cl 5075 [0,2,0,0,0,0|2,0,0]=4 311 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)F 10081 [0,2,0,0,0,0|2,0,0]=4 312 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)O 9883 [0,2,0,0,0,0|2,0,0]=4 313 B11R1.166 CC1=C(C=CC(=C1)Br)C(=O)O 10616 [0,2,0,0,0,0|2,0,0]=4 314 B11R1.166 CC1=C(C=CC(=C1)Cl)C(=O)O 5555 [0,2,0,0,0,0|2,0,0]=4 315 B11R1.166 CC1=C(C=CC(=C1)O)C(=O)O 9034 [0,2,0,0,0,0|2,0,0]=4 316 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O 6607 [0,2,0,0,0,0|2,0,0]=4 317 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O 6608 [0,2,0,0,0,0|2,0,0]=4 318 B11R1.166 CC1=CC(=NC=C1[N+](=O)[O-])Cl 6670 [0,2,0,0,0,0|2,0,0]=4 319 B11R1.166 CC1=CC(=NC=C1[N+](=O)[O-])Cl 8473 [0,2,0,0,0,0|2,0,0]=4 320 B11R1.166 CC1=CC(=NC=C1[N+](=O)[O-])N 5688 [0,2,0,0,0,0|2,0,0]=4 321 B11R1.166 CC1=CC(=NC=C1[N+](=O)[O-])N 9417 [0,2,0,0,0,0|2,0,0]=4 322 B11R1.166 CC1=CC(=O)C(=CN1)C(=O)O 5043 [0,2,0,0,0,0|1,0,1]=4 323 B11R1.166 CC1=NC(=C(C=C1)[N+](=O)[O-])F 10110 [0,2,0,0,0,0|2,0,0]=4 324 B11R1.16 C1=CC=C(C=C1)C(=O)N=C=S 8487 [0,2,0,0,0,0|1,0,1]=4 325 B11R1.16 C1=CC=C(C=C1)C(=O)NCO 5641 [0,2,0,0,0,0|1,0,0]=3 326 B11R1.23 C1=CC(=CC(=C1)F)C(=O)NN 9266 [0,2,0,0,0,0|1,0,0]=3 327 B11R1.23 C1=CC(=CC(=C1)I)C(=O)NN 9274 [0,2,0,0,0,0|1,0,0]=3 328 B11R1.23 CCC(=O)C1=CC(=CC=C1)F 5174 [0,2,0,0,0,0|2,0,0]=4 329 B11R1.23 COC(=O)C1=CC(=CC=C1)Cl 8550 [0,2,0,0,0,0|2,0,0]=4 330 B11R1.23 COC(=O)C1=CC(=CC=C1)I 9834 [0,2,0,0,0,0|2,0,0]=4 331 B11R1.23 COC(=O)C1=CC(=CC=C1)O 10660 [0,2,0,0,0,0|2,0,0]=4 332 B11R1.23 COC(=O)C1=CC(=CN=C1)Br 5020 [0,2,0,0,0,0|1,0,0]=3 333 B11R1.222 C1=CC=C(C(=C1)C(=O)CBr)F 8148 [0,2,0,0,0,0|2,0,0]=4 334 B11R1.222 C1=CC=C(C(=C1)C(=O)NN)F 8384 [0,2,0,0,0,0|1,0,0]=3 335 B11R1.222 C1=CC=C(C(=C1)C(=O)NO)O 9621 [0,2,0,0,0,0|1,0,0]=3 336 B11R1.222 CNC(=O)C1=CC=CC=C1N 8920 [0,2,0,0,0,0|1,0,0]=3 337 B11R1.222 COC(=O)C1=C(C=CN=C1)N 10408 [0,2,0,0,0,0|1,0,0]=3 338 B11R1.222 COC(=O)C1=C(N=CC=C1)Cl 6783 [0,2,0,0,0,0|1,0,0]=3 339 B11R1.222 COC(=O)C1=CC=CC=C1F 6341 [0,2,0,0,0,0|2,0,0]=4 340 B11R1.222 COC(=O)C1=NC=CN=C1N 10013 [0,2,0,0,0,0|2,0,0]=4 341 B11R1.87 C1=CC=C(C(=C1)S(=O)(=O)N)Cl 8406 [0,2,0,0,0,0|2,0,0]=4 342 B11R1.155 C1=CC(=CC(=C1)Br)S(=O)(=O)N 8666 [0,2,0,0,0,0|2,0,0]=4 343 B11R1.155 C1=CC(=CC(=C1)Cl)S(=O)(=O)N 6621 [0,2,0,0,0,0|2,0,0]=4 344 B11R1.155 C1=CC(=CC(=C1)S(=O)(=O)N)N 8879 [0,2,0,0,0,0|2,0,0]=4 345 B11R1.53 CSC1=CC=CC=C1C(=O)O 9495 [0,2,0,0,0,0|2,0,0]=4 346 B11R1.156 C1=CC(=C(C(=C1)Br)C(=O)O)Cl 6567 [0,2,0,0,0,0|2,0,0]=4 347 B11R1.156 C1=CC(=C(C(=C1)Br)C(=O)O)F 6241 [0,2,0,0,0,0|2,0,0]=4 348 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)O)Cl 5394 [0,2,0,0,0,0|2,0,0]=4 349 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)O)F 5099 [0,2,0,0,0,0|2,0,0]=4 350 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)O)F 5353 [0,2,0,0,0,0|2,0,0]=4 351 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)Cl)F 6208 [0,2,0,0,0,0|2,0,0]=4 352 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)N)F 5615 [0,2,0,0,0,0|1,0,0]=3 353 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)N)N 5439 [0,2,0,0,0,0|1,0,0]=3 354 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)O)N 5048 [0,2,0,0,0,0|2,0,0]=4 355 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)O)O 6300 [0,2,0,0,0,0|2,0,0]=4 356 B11R1.156 C1=CN=C(C(=C1Cl)C(=O)O)Cl 10555 [0,2,0,0,0,0|1,0,0]=3 357 B11R1.156 CC(=O)C1=C(C=CC=C1Cl)F 5981 [0,2,0,0,0,0|2,0,0]=4 358 B11R1.156 CC(=O)C1=C(C=CC=C1F)F 5605 [0,2,0,0,0,0|2,0,0]=4 359 B11R1.156 CC(=O)C1=C(C=CC=C1O)O 6860 [0,2,0,0,0,0|2,0,0]=4 360 B11R1.156 CC1=C(C(=CC=C1)Cl)C(=O)N 6850 [0,2,0,0,0,0|1,0,0]=3 361 B11R1.156 CC1=C(C(=CC=C1)Cl)C(=O)O 9895 [0,2,0,0,0,0|2,0,0]=4 362 B11R1.156 CC1=C(C(=CC=C1)N)C(=O)O 10650 [0,2,0,0,0,0|2,0,0]=4 363 B11R1.156 CC1=C(C(=NC=C1)N)[N+](=O)[O-] 10662 [0,2,0,0,0,0|2,0,0]=4 364 B11R1.159 C1=CC(=C(C(=C1)Br)Cl)C(=O)O 8609 [0,2,0,0,0,0|2,0,0]=4 365 B11R1.159 C1=CC(=C(C(=C1)Br)F)C(=O)O 6242 [0,2,0,0,0,0|2,0,0]=4 366 B11R1.159 C1=CC(=C(C(=C1)Cl)Cl)C(=O)O 8360 [0,2,0,0,0,0|2,0,0]=4 367 B11R1.159 C1=CC(=C(C(=C1)Cl)F)C(=O)O 8329 [0,2,0,0,0,0|2,0,0]=4 368 B11R1.159 C1=CC(=C(C(=C1)F)Cl)C(=O)O 5124 [0,2,0,0,0,0|2,0,0]=4 369 B11R1.159 C1=CC(=C(C(=C1)F)N)C(=O)O 10136 [0,2,0,0,0,0|2,0,0]=4 370 B11R1.159 C1=CC(=C(C(=C1)N)N)C(=O)O 10409 [0,2,0,0,0,0|2,0,0]=4 371 B11R1.159 CC(=O)C1=C(C(=CC=C1)F)F 9780 [0,2,0,0,0,0|2,0,0]=4 372 B11R1.159 CC(=O)C1=C(C(=CC=C1)N)O 6667 [0,2,0,0,0,0|2,0,0]=4 373 B11R1.159 CC1=C(C=CC=C1Br)C(=O)O 8705 [0,2,0,0,0,0|2,0,0]=4 374 B11R1.159 CC1=C(C=CC=C1Cl)C(=O)O 5119 [0,2,0,0,0,0|2,0,0]=4 375 B11R1.159 CC1=C(C=CC=C1F)C(=O)[O-] 5368 [0,2,0,0,0,0|2,0,0]=4 376 B11R1.159 CC1=C(C=CC=C1O)C(=O)O 10009 [0,2,0,0,0,0|2,0,0]=4 377 B11R1.159 CC1=CC=CC(=C1Br)C(=O)O 5552 [0,2,0,0,0,0|2,0,0]=4 378 B11R1.159 CC1=CC=CC(=C1Cl)C(=O)O 9214 [0,2,0,0,0,0|2,0,0]=4 379 B11R1.159 CC1=CC=CC(=C1I)C(=O)O 6863 [0,2,0,0,0,0|2,0,0]=4 380 B11R1.159 CC1=CC=CC(=C1N)C(=O)O 6598 [0,2,0,0,0,0|2,0,0]=4 381 B11R1.167 C1=C(C(=NC=C1Br)Br)[N+](=O)[O-] 9342 [0,2,0,0,0,0|2,0,0]=4 382 B11R1.167 C1=C(C(=NC=C1Br)Cl)C(=O)[O-] 5249 [0,2,0,0,0,0|1,0,0]=3 383 B11R1.167 C1=C(C(=NC=C1Br)Cl)[N+](=O)[O-] 5679 [0,2,0,0,0,0|2,0,0]=4 384 B11R1.167 C1=C(C(=NC=C1Br)N)[N+](=O)[O-] 5642 [0,2,0,0,0,0|2,0,0]=4 385 B11R1.167 C1=C(C(=NC=C1Cl)Br)[N+](=O)[O-] 6602 [0,2,0,0,0,0|2,0,0]=4 386 B11R1.167 C1=C(C(=NC=C1F)Cl)C(=O)O 9339 [0,2,0,0,0,0|1,0,0]=3 387 B11R1.167 C1=C(C(=NN=C1Cl)Cl)C(=O)O 10074 [0,2,0,0,0,0|2,0,0]=4 388 B11R1.167 C1=C(C(=O)NC=C1Br)C(=O)O 8259 [0,2,0,0,0,0|1,0,1]=4 389 B11R1.167 C1=C(N=C(C(=N1)N)C(=O)O)Br 6768 [0,2,0,0,0,0|2,0,0]=4 390 B11R1.167 C1=CC(=C(C=C1Br)C(=O)O)Cl 5334 [0,2,0,0,0,0|2,0,0]=4 391 B11R1.167 C1=CC(=C(C=C1Br)C(=O)O)I 8491 [0,2,0,0,0,0|2,0,0]=4 392 B11R1.167 C1=CC(=C(C=C1Br)C(=O)O)N 5476 [0,2,0,0,0,0|2,0,0]=4 393 B11R1.167 C1=CC(=C(C=C1Br)C(=O)O)N 6519 [0,2,0,0,0,0|2,0,0]=4 394 B11R1.167 C1=CC(=C(C=C1Br)C(=O)O)O 8508 [0,2,0,0,0,0|2,0,0]=4 395 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)Cl)F 6251 [0,2,0,0,0,0|2,0,0]=4 396 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)N)F 9892 [0,2,0,0,0,0|1,0,0]=3 397 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)Br 10376 [0,2,0,0,0,0|2,0,0]=4 398 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)Br 5046 [0,2,0,0,0,0|2,0,0]=4 399 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)F 5072 [0,2,0,0,0,0|2,0,0]=4 400 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)F 5344 [0,2,0,0,0,0|2,0,0]=4 401 B11R1.167 C1=CC(=C(C=C1F)C(=O)N)F 5161 [0,2,0,0,0,0|1,0,0]=3 402 B11R1.167 C1=CC(=C(C=C1F)C(=O)O)Br 8351 [0,2,0,0,0,0|2,0,0]=4 403 B11R1.167 C1=CC(=C(C=C1F)C(=O)O)F 6069 [0,2,0,0,0,0|2,0,0]=4 404 B11R1.167 C1=CC(=C(C=C1F)C(=O)O)N 6138 [0,2,0,0,0,0|2,0,0]=4 405 B11R1.167 C1=CC(=C(C=C1I)C(=O)O)Br 5274 [0,2,0,0,0,0|2,0,0]=4 406 B11R1.167 C1=CC(=C(C=C1I)C(=O)O)I 9722 [0,2,0,0,0,0|2,0,0]=4 407 B11R1.167 C1=CC(=C(C=C1N)C(=O)O)F 9459 [0,2,0,0,0,0|2,0,0]=4 408 B11R1.167 C1=CC(=C(C=C1O)C(=O)O)N 8634 [0,2,0,0,0,0|2,0,0]=4 409 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)F 10631 [0,2,0,0,0,0|2,0,0]=4 410 B11R1.167 CC(=O)C1=C(C=CC(=C1)Cl)Cl 8109 [0,2,0,0,0,0|2,0,0]=4 411 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)Cl 9377 [0,2,0,0,0,0|2,0,0]=4 412 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)F 5604 [0,2,0,0,0,0|2,0,0]=4 413 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)O 10507 [0,2,0,0,0,0|2,0,0]=4 414 B11R1.167 CC1=C(C=C(C=C1)Br)C(=O)O 9714 [0,2,0,0,0,0|2,0,0]=4 415 B11R1.167 CC1=C(C=C(C=C1)Cl)C(=O)O 9462 [0,2,0,0,0,0|2,0,0]=4 416 B11R1.167 CC1=C(C=C(C=C1)F)C(=O)Cl 6306 [0,2,0,0,0,0|2,0,0]=4 417 B11R1.167 CC1=C(C=C(C=C1)F)C(=O)O 6092 [0,2,0,0,0,0|2,0,0]=4 418 B11R1.167 CC1=C(C=C(C=C1)F)C(=O)O 6093 [0,2,0,0,0,0|2,0,0]=4 419 B11R1.167 CC1=C(C=C(C=C1)O)C(=O)O 9407 [0,2,0,0,0,0|2,0,0]=4 420 B11R1.167 CC1=CC(=C(C=C1)Cl)C(=O)O 8528 [0,2,0,0,0,0|2,0,0]=4 421 B11R1.167 CC1=CC(=C(C=C1)F)C(=O)O 5026 [0,2,0,0,0,0|2,0,0]=4 422 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O 5607 [0,2,0,0,0,0|2,0,0]=4 423 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O 6864 [0,2,0,0,0,0|2,0,0]=4 424 B11R1.167 CC1=CC(=C(C=C1)N)C(=O)O 5694 [0,2,0,0,0,0|2,0,0]=4 425 B11R1.167 CC1=CC(=C(N=C1)Br)[N+](=O)[O-] 8985 [0,2,0,0,0,0|2,0,0]=4 426 B11R1.74 C1=C(C=C(C=C1Br)Br)C(=O)O 8107 [0,2,0,0,0,0|2,0,0]=4 427 B11R1.74 C1=C(C=C(C=C1Cl)Cl)C(=O)O 5395 [0,2,0,0,0,0|2,0,0]=4 428 B11R1.74 C1=C(C=C(C=C1F)Br)C(=O)O 5109 [0,2,0,0,0,0|2,0,0]=4 429 B11R1.74 C1=C(C=C(C=C1F)Cl)C(=O)O 10049 [0,2,0,0,0,0|2,0,0]=4 430 B11R1.74 C1=C(C=C(C=C1F)F)C(=O)N 5033 [0,2,0,0,0,0|1,0,0]=3 431 B11R1.74 CC(=O)C1=CC(=CC(=C1)F)F 5151 [0,2,0,0,0,0|2,0,0]=4 432 B11R1.74 CC1=CC(=CC(=C1)C(=O)O)C 6658 [0,2,0,0,0,0|2,0,0]=4 433 B11R1.74 CC1=CC(=CC(=C1)C(=O)O)F 10642 [0,2,0,0,0,0|2,0,0]=4 434 B11R1.74 Cc1cc(cc(c1)F)C(=O)Cl F4210 [0,2,0,0,0,0|2,0,0]=4 435 B11R1.74 Cc1cc(cc(c1)F)C(=O)N F0059 [0,2,0,0,0,0|1,0,0]=3 436 B11R1.74 c1c(cc(cc1F)Br)C(=O)N B0294 [0,2,0,0,0,0|1,0,0]=3 437 B11R1.74 c1c(cc(cc1F)Cl)C(=O)Cl C0091 [0,2,0,0,0,0|2,0,0]=4 438 B11R1.266 C1=CC(=CC(=C1)CCl)C(=O)O 8272 [0,2,0,0,0,0|2,0,0]=4 439 B11R1.266 CC(=O)C1=CC=CC(=C1)C#N 6016 [0,2,0,0,0,0|2,0,0]=4 440 B11R2.10 C1=CC2=C(NC(=O)O2)N=C1 9603 [0,0,0,1,0,1|0,0,0]=2 441 B11R2.10 C1=CC=C2C(=C1)NC(=O)O2 9606 [0,0,0,1,0,1|1,0,0]=3 442 B11R2.10 C1=CC=C2C(=C1)NC(=O)S2 8011 [0,0,0,1,0,1|1,0,0]=3 443 B11R2.10 C1C(=O)CC2=CC=CC=C21 8484 [0,0,0,1,0,1|2,0,0]=4 444 B11R2.10 C1C2=CC=CC=C2NC1=O 8296 [0,0,0,1,0,1|1,0,0]=3 445 B11R2.10 C1C2=CC=CC=C2NC1=O 8629 [0,0,0,1,0,1|1,0,0]=3 446 B11R2.10 CC1=CC2=CC=CC=C2N1 6155 [0,0,0,1,0,1|2,0,0]=4 447 B11R2.1 C1=CC2=C(NN=C2C=C1)Br 9942 [0,1,0,1,0,0|2,0,0]=4 448 B7R1.1 C1=CN=C(N1)C=O 6465 [1,0,0,0,1,0|1,0,0]=3 449 B7R1.1 C1=CSC(=C1)CN 6832 [1,0,0,0,1,0|1,0,1]=4 450 B7R1.1 C1=CSC(=N1)C=O 9389 [1,0,0,0,1,0|1,0,0]=3 451 B7R1.1 c1cc(oc1)C=O F0018 [1,0,0,0,1,0|1,0,0]=3 452 B7R1.1 c1cc(oc1)CN F0590 [1,0,0,0,1,0|1,0,1]=4 453 B7R1.1 c1cc(sc1)C=O T0002 [1,0,0,0,1,0|1,0,0]=3 454 B7R1.1 o1c(ccc1)CN F0591 [1,0,0,0,1,0|1,0,1]=4 455 B11R1.91 C1=CC=C(C=C1)OCC(=O)N 5996 [0,0,0,0,0,2|1,0,0]=3