0 B9R1.15 BrCC1=C(Br)C=CC=C1 16915 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.15 BrCC1=C(I)C=CC=C1 14812 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.15 BrCC1=CC=CN=C1Br 22284 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.15 C#CC1=C(Cl)C=CC=C1 2550 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.15 C#CC1=CC=CN=C1N 34373 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.15 C=CC1=C(Br)C=CC=C1 23975 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.15 CC1=C(C#N)C=CC=C1 25285 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.15 CC1=C(C#N)C=CN=C1 20005 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.15 CC1=C(C#N)C=NC=C1 31633 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.15 CC1=C(C#N)C=NC=C1 6623 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.15 CC1=C(C=O)C=CC=N1 24064 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.15 CC1=C(CCl)C=CC=C1 7487 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.15 CC1=C(CN)C=CC=C1 10197 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.15 CC1=C(CO)C=NC=C1 34710 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.15 CC1=C(NN)C=CC=C1 22584 [0,0,0,0,0,0|2,0,0]=2 15 B9R1.15 CC1=C(NN)C=CC=C1 6396 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.15 CC1=CC=CC=C1C=O 15511 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.15 CC1=CC=CN=C1C#N 9627 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.15 CC1=CC=CN=C1C=O 17165 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.15 CC1=CC=NC=C1C#N 18426 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.15 CC1=CC=NC=C1C=O 18427 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.15 CC1=NC=CC=C1C#N 17460 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.15 CC1=NC=CC=C1CCl 26692 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.15 CC1=NC=CC=C1CO 26693 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.15 CCC1=C(Br)C=CC=C1 3770 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.15 CCC1=C(I)C=CC=C1 3876 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.15 CCC1=C(N)C=CC=C1 20945 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.15 CCC1=C(N)C=CC=C1 21080 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.15 CCC1=C(O)C=CC=C1 3871 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.15 CCC1=C(S)C=CC=C1 6844 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.15 CCC1=CC=CN=C1N 35166 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.15 CCC1=CN=CN=C1Cl 21456 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.15 CCC1=NC=CC=C1Br 27958 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.15 CCC1=NC=CN=C1C 8611 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.15 CCC1=NC=CN=C1Cl 32165 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.15 CCC1=NC=NC=C1F 17408 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.15 CC[N+]1=C(Br)C=CC=C1 35190 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.15 CNC1=C(F)C=CC=C1 15527 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.15 CNC1=C(N)C=NC=C1 29063 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.15 CNC1=CC=CC=C1N 14987 [0,0,0,0,0,0|2,0,0]=2 40 B9R1.15 COC1=C(Br)C=CC=C1 3725 [0,0,0,0,0,0|1,0,0]=1 41 B9R1.15 COC1=C(Br)C=CN=C1 20095 [0,0,0,0,0,0|2,0,0]=2 42 B9R1.15 COC1=C(Br)C=CN=C1 34713 [0,0,0,0,0,0|2,0,0]=2 43 B9R1.15 COC1=C(Br)C=NC=C1 6686 [0,0,0,0,0,0|2,0,0]=2 44 B9R1.15 COC1=C(C)C=CN=C1 34674 [0,0,0,0,0,0|1,0,0]=1 45 B9R1.15 COC1=C(Cl)C=CC=C1 3614 [0,0,0,0,0,0|1,0,0]=1 46 B9R1.15 COC1=C(Cl)C=CN=C1 33677 [0,0,0,0,0,0|2,0,0]=2 47 B9R1.15 COC1=C(Cl)C=NC=C1 6687 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.15 COC1=C(F)C=CC=C1 3473 [0,0,0,0,0,0|1,0,0]=1 49 B9R1.15 COC1=C(I)C=CC=C1 3898 [0,0,0,0,0,0|1,0,0]=1 50 B9R1.15 COC1=C(I)C=NC=C1 34558 [0,0,0,0,0,0|2,0,0]=2 51 B9R1.15 COC1=C(N)C=CN=C1 27755 [0,0,0,0,0,0|2,0,0]=2 52 B9R1.15 COC1=C(O)C=CN=C1 34289 [0,0,0,0,0,0|2,0,0]=2 53 B9R1.15 COC1=C(S)C=CC=C1 6816 [0,0,0,0,0,0|1,0,0]=1 54 B9R1.15 COC1=CC=CC=C1O 26545 [0,0,0,0,0,0|1,0,0]=1 55 B9R1.15 COC1=CC=CN=C1Br 5916 [0,0,0,0,0,0|2,0,0]=2 56 B9R1.15 COC1=CC=CN=C1C 6637 [0,0,0,0,0,0|1,0,0]=1 57 B9R1.15 COC1=CC=CN=C1Cl 6146 [0,0,0,0,0,0|2,0,0]=2 58 B9R1.15 COC1=CC=CN=C1N 28123 [0,0,0,0,0,0|2,0,0]=2 59 B9R1.15 COC1=CC=CN=C1O 6543 [0,0,0,0,0,0|2,0,0]=2 60 B9R1.15 COC1=CN=CN=C1Cl 32304 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.15 COC1=NC=CC=C1Br 1180 [0,0,0,0,0,0|2,0,0]=2 62 B9R1.15 COC1=NC=CC=C1C 6594 [0,0,0,0,0,0|1,0,0]=1 63 B9R1.15 COC1=NC=CC=C1Cl 1189 [0,0,0,0,0,0|2,0,0]=2 64 B9R1.15 COC1=NC=CC=C1F 10624 [0,0,0,0,0,0|2,0,0]=2 65 B9R1.15 COC1=NC=CC=C1I 6586 [0,0,0,0,0,0|2,0,0]=2 66 B9R1.15 COC1=NC=CC=C1N 1269 [0,0,0,0,0,0|2,0,0]=2 67 B9R1.15 COC1=NC=CN=C1Br 32150 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.15 COC1=NC=CN=C1C 9109 [0,0,0,0,0,0|2,0,0]=2 69 B9R1.15 COC1=NC=CN=C1Cl 8545 [0,0,0,0,0,0|3,0,0]=3 70 B9R1.15 COC1=NC=CN=C1N 27380 [0,0,0,0,0,0|3,0,0]=3 71 B9R1.15 CSC1=C(Br)C=CC=C1 10648 [0,0,0,0,0,0|1,1,0]=2 72 B9R1.15 CSC1=C(C)C=CC=C1 10730 [0,0,0,0,0,0|0,1,0]=1 73 B9R1.15 CSC1=C(Cl)C=CC=C1 10643 [0,0,0,0,0,0|1,1,0]=2 74 B9R1.15 CSC1=C(F)C=CC=C1 10638 [0,0,0,0,0,0|1,1,0]=2 75 B9R1.15 CSC1=C(I)C=CC=C1 10668 [0,0,0,0,0,0|1,1,0]=2 76 B9R1.15 CSC1=C(N)C=CC=C1 10633 [0,0,0,0,0,0|1,1,0]=2 77 B9R1.15 CSC1=C(O)C=CC=C1 10666 [0,0,0,0,0,0|1,1,0]=2 78 B9R1.15 CSC1=NC=CN=C1Cl 32091 [0,0,0,0,0,0|3,1,0]=4 79 B9R1.15 ClC1=C(CBr)C=CC=C1 12482 [0,0,0,0,0,0|3,0,0]=3 80 B9R1.15 ClCC1=C(Cl)C=CC=C1 10203 [0,0,0,0,0,0|3,0,0]=3 81 B9R1.15 ClCC1=NC=CC=C1Cl 27217 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.15 FC1=C(CBr)C=CC=C1 10383 [0,0,0,0,0,0|3,0,0]=3 83 B9R1.15 FC1=C(CCl)C=CC=C1 2094 [0,0,0,0,0,0|3,0,0]=3 84 B9R1.15 N#CC1=C(Br)C=CC=C1 3744 [0,0,0,0,0,0|3,0,0]=3 85 B9R1.15 N#CC1=C(Br)C=CN=C1 17650 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.15 N#CC1=C(Br)C=NC=C1 17105 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.15 N#CC1=C(Br)N=CC=C1 35805 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.15 N#CC1=C(Cl)C=NC=C1 15941 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.15 N#CC1=C(F)C=CC=C1 1578 [0,0,0,0,0,0|3,0,0]=3 90 B9R1.15 N#CC1=C(I)C=CC=C1 3932 [0,0,0,0,0,0|3,0,0]=3 91 B9R1.15 N#CC1=C(I)N=CC=C1 34249 [0,0,0,0,0,0|4,0,0]=4 92 B9R1.15 N#CC1=C(N)C=NC=C1 9759 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.15 N#CC1=C(O)C=CC=C1 4803 [0,0,0,0,0,0|3,0,0]=3 94 B9R1.15 N#CC1=CC=CC=C1N 13630 [0,0,0,0,0,0|3,0,0]=3 95 B9R1.15 N#CC1=CC=CN=C1Cl 2573 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.15 N#CC1=CC=CN=C1F 1108 [0,0,0,0,0,0|4,0,0]=4 97 B9R1.15 N#CC1=CC=CN=C1N 5584 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.15 N#CC1=CC=CN=C1O 20421 [0,0,0,0,0,0|4,0,0]=4 99 B9R1.15 N#CC1=CC=CN=C1O 6539 [0,0,0,0,0,0|4,0,0]=4 100 B9R1.15 N#CC1=CN=CC=C1O 13974 [0,0,0,0,0,0|4,0,0]=4 101 B9R1.15 N#CC1=NC=CC=C1Br 2263 [0,0,0,0,0,0|4,0,0]=4 102 B9R1.15 N#CC1=NC=CC=C1Cl 14368 [0,0,0,0,0,0|4,0,0]=4 103 B9R1.15 N#CC1=NC=CC=C1F 16434 [0,0,0,0,0,0|4,0,0]=4 104 B9R1.15 N#CC1=NC=CC=C1I 15743 [0,0,0,0,0,0|4,0,0]=4 105 B9R1.15 N#CC1=NC=CC=C1N 7667 [0,0,0,0,0,0|4,0,0]=4 106 B9R1.15 N#CC1=NC=CC=C1O 9231 [0,0,0,0,0,0|4,0,0]=4 107 B9R1.15 NC1=C(C=O)C=CC=C1 15692 [0,0,0,0,0,0|3,0,0]=3 108 B9R1.15 NC1=C(C=O)C=CN=C1 26765 [0,0,0,0,0,0|4,0,0]=4 109 B9R1.15 NC1=C(C=O)C=NC=C1 7681 [0,0,0,0,0,0|4,0,0]=4 110 B9R1.15 NC1=C(CO)C=CC=C1 7478 [0,0,0,0,0,0|3,0,0]=3 111 B9R1.15 NC1=C(CO)C=CN=C1 7692 [0,0,0,0,0,0|4,0,0]=4 112 B9R1.15 NC1=C(CO)C=NC=C1 26901 [0,0,0,0,0,0|4,0,0]=4 113 B9R1.15 NC1=CC=CN=C1C=O 7680 [0,0,0,0,0,0|4,0,0]=4 114 B9R1.15 NC1=CC=CN=C1CO 35900 [0,0,0,0,0,0|4,0,0]=4 115 B9R1.15 NC1=NC=CC=C1C=O 1262 [0,0,0,0,0,0|4,0,0]=4 116 B9R1.15 NC1=NC=CC=C1CO 7688 [0,0,0,0,0,0|4,0,0]=4 117 B9R1.15 NCC1=C(Br)C=CC=C1 20398 [0,0,0,0,0,0|3,0,0]=3 118 B9R1.15 NCC1=C(Br)C=CC=C1 3749 [0,0,0,0,0,0|3,0,0]=3 119 B9R1.15 NCC1=C(Cl)C=CC=C1 5800 [0,0,0,0,0,0|3,0,0]=3 120 B9R1.15 NCC1=C(Cl)C=CC=C1 6155 [0,0,0,0,0,0|3,0,0]=3 121 B9R1.15 NCC1=C(F)C=CC=C1 4415 [0,0,0,0,0,0|3,0,0]=3 122 B9R1.15 NCC1=C(N)C=CC=C1 23363 [0,0,0,0,0,0|3,0,0]=3 123 B9R1.15 NCC1=C(O)C=CC=C1 7383 [0,0,0,0,0,0|3,0,0]=3 124 B9R1.15 NCC1=CC=CN=C1Cl 17749 [0,0,0,0,0,0|4,0,0]=4 125 B9R1.15 NCC1=NC=CC=C1O 34602 [0,0,0,0,0,0|4,0,0]=4 126 B9R1.15 NNC1=C(Br)C=CC=C1 4463 [0,0,0,0,0,0|3,0,0]=3 127 B9R1.15 NNC1=C(Cl)C=CC=C1 4482 [0,0,0,0,0,0|3,0,0]=3 128 B9R1.15 NNC1=C(F)C=CC=C1 3347 [0,0,0,0,0,0|3,0,0]=3 129 B9R1.15 NNC1=C(F)C=CC=C1 3350 [0,0,0,0,0,0|3,0,0]=3 130 B9R1.15 NNC1=NC=CC=C1Cl 6444 [0,0,0,0,0,0|4,0,0]=4 131 B9R1.15 NNC1=NC=CC=C1F 19894 [0,0,0,0,0,0|4,0,0]=4 132 B9R1.15 O=CC1=C(Br)C=CC=C1 3727 [0,0,0,0,0,0|3,0,0]=3 133 B9R1.15 O=CC1=C(Br)C=CN=C1 5061 [0,0,0,0,0,0|4,0,0]=4 134 B9R1.15 O=CC1=C(Br)C=NC=C1 5063 [0,0,0,0,0,0|4,0,0]=4 135 B9R1.15 O=CC1=C(Cl)C=CN=C1 7359 [0,0,0,0,0,0|4,0,0]=4 136 B9R1.15 O=CC1=C(Cl)C=NC=C1 25431 [0,0,0,0,0,0|4,0,0]=4 137 B9R1.15 O=CC1=C(F)C=CC=C1 3476 [0,0,0,0,0,0|3,0,0]=3 138 B9R1.15 O=CC1=C(F)C=NC=C1 5137 [0,0,0,0,0,0|4,0,0]=4 139 B9R1.15 O=CC1=C(I)C=CC=C1 3914 [0,0,0,0,0,0|3,0,0]=3 140 B9R1.15 O=CC1=C(O)C=NC=C1 33398 [0,0,0,0,0,0|4,0,0]=4 141 B9R1.15 O=CC1=C(O)N=CC=C1 17177 [0,0,0,0,0,0|4,0,0]=4 142 B9R1.15 O=CC1=CC=CN=C1Br 5057 [0,0,0,0,0,0|4,0,0]=4 143 B9R1.15 O=CC1=CC=CN=C1Cl 31630 [0,0,0,0,0,0|4,0,0]=4 144 B9R1.15 O=CC1=CC=CN=C1Cl 5097 [0,0,0,0,0,0|4,0,0]=4 145 B9R1.15 O=CC1=CC=CN=C1F 5131 [0,0,0,0,0,0|4,0,0]=4 146 B9R1.15 O=CC1=NC=CC=C1Br 15122 [0,0,0,0,0,0|4,0,0]=4 147 B9R1.15 O=CC1=NC=CC=C1Cl 17163 [0,0,0,0,0,0|4,0,0]=4 148 B9R1.15 O=CC1=NC=CC=C1F 5142 [0,0,0,0,0,0|4,0,0]=4 149 B9R1.15 O=CC1=NC=CC=C1O 12415 [0,0,0,0,0,0|4,0,0]=4 150 B9R1.15 OCC1=C(Br)C=CC=C1 3746 [0,0,0,0,0,0|3,0,0]=3 151 B9R1.15 OCC1=C(Cl)C=CC=C1 3625 [0,0,0,0,0,0|3,0,0]=3 152 B9R1.15 OCC1=C(Cl)C=CN=C1 12981 [0,0,0,0,0,0|4,0,0]=4 153 B9R1.15 OCC1=C(F)C=CC=C1 3485 [0,0,0,0,0,0|3,0,0]=3 154 B9R1.15 OCC1=C(F)C=NC=C1 23891 [0,0,0,0,0,0|4,0,0]=4 155 B9R1.15 OCC1=C(O)C=CC=C1 21869 [0,0,0,0,0,0|3,0,0]=3 156 B9R1.15 OCC1=CC=CN=C1Cl 12984 [0,0,0,0,0,0|4,0,0]=4 157 B9R1.15 OCC1=CC=CN=C1F 7351 [0,0,0,0,0,0|4,0,0]=4 158 B9R1.15 OCC1=NC=CC=C1F 15108 [0,0,0,0,0,0|4,0,0]=4 159 B9R1.15 OCC1=NC=CC=C1O 4075 [0,0,0,0,0,0|4,0,0]=4 160 B9R1.15 SCC1=C(Cl)C=CC=C1 6836 [0,0,0,0,0,0|3,0,0]=3 161 B9R1.15 SCc1ccccc1Br 6847 [0,0,0,0,0,0|3,0,0]=3 162 B8R1.2 BrCC1=CC=CC=C1 13143 [1,0,0,0,0,0|2,0,0]=3 163 B8R1.2 BrCC1=CC=CN=C1 17664 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.2 C#CC1=CC=CC=C1 15340 [1,0,0,0,0,0|1,0,1]=3 165 B8R1.2 C#CC1=CC=CN=C1 16106 [1,0,0,0,0,0|2,0,1]=4 166 B8R1.2 C#CC1=CC=NC=C1 19527 [1,0,0,0,0,0|2,0,1]=4 167 B8R1.2 C=CC1=NC=CC=C1 23910 [1,0,0,0,0,0|2,0,1]=4 168 B8R1.2 CCC1=NC=NC=C1 23618 [1,0,0,0,0,0|3,0,0]=4 169 B8R1.2 CNC1=CC=CN=C1 14983 [1,0,0,0,0,0|2,0,0]=3 170 B8R1.2 CNC1=CC=NC=C1 12915 [1,0,0,0,0,0|2,0,0]=3 171 B8R1.2 CNC1=CN=CN=C1 25066 [1,0,0,0,0,0|3,0,0]=4 172 B8R1.2 COC1=CC=CC=C1 12830 [1,0,0,0,0,0|0,0,0]=1 173 B8R1.2 COC1=CC=CC=C1 17272 [1,0,0,0,0,0|0,0,0]=1 174 B8R1.2 COC1=CC=CN=C1 15370 [1,0,0,0,0,0|1,0,0]=2 175 B8R1.2 COC1=CC=NC=C1 2585 [1,0,0,0,0,0|1,0,0]=2 176 B8R1.2 COC1=CN=CN=C1 25073 [1,0,0,0,0,0|2,0,0]=3 177 B8R1.2 COC1=NC=CC=C1 13201 [1,0,0,0,0,0|1,0,0]=2 178 B8R1.2 COC1=NC=CN=C1 8605 [1,0,0,0,0,0|2,0,0]=3 179 B8R1.2 COC1=NC=NC=C1 21029 [1,0,0,0,0,0|2,0,0]=3 180 B8R1.2 CSC1=CC=CC=C1 10578 [1,0,0,0,0,0|0,1,0]=2 181 B8R1.2 CSC1=NC=CC=C1 35938 [1,0,0,0,0,0|1,1,0]=3 182 B8R1.2 CSC1=NC=CN=C1 8604 [1,0,0,0,0,0|2,1,0]=4 183 B8R1.2 ClCC1=CC=CN=C1 9217 [1,0,0,0,0,0|3,0,0]=4 184 B8R1.2 ClCC1=CC=NC=C1 15905 [1,0,0,0,0,0|3,0,0]=4 185 B8R1.2 ClCC1=NC=CC=C1 16732 [1,0,0,0,0,0|3,0,0]=4 186 B8R1.2 ClCC1=NC=CC=C1 36036 [1,0,0,0,0,0|3,0,0]=4 187 B8R1.2 N#CC1=CC=CN=C1 11233 [1,0,0,0,0,0|3,0,0]=4 188 B8R1.2 N#CC1=CC=NC=C1 11155 [1,0,0,0,0,0|3,0,0]=4 189 B8R1.2 N#CC1=NC=CC=C1 6007 [1,0,0,0,0,0|3,0,0]=4 190 B8R1.2 N#Cc1ccccc1 25507 [1,0,0,0,0,0|2,0,0]=3 191 B8R1.2 NCC1=CC=CC=C1 25530 [1,0,0,0,0,0|2,0,0]=3 192 B8R1.2 NCC1=CC=CN=C1 11140 [1,0,0,0,0,0|3,0,0]=4 193 B8R1.2 NCC1=CC=NC=C1 12407 [1,0,0,0,0,0|3,0,0]=4 194 B8R1.2 NCC1=NC=CC=C1 11142 [1,0,0,0,0,0|3,0,0]=4 195 B8R1.2 NNC1=CC=CC=C1 22925 [1,0,0,0,0,0|2,0,0]=3 196 B8R1.2 NNC1=CC=NC=C1 16313 [1,0,0,0,0,0|3,0,0]=4 197 B8R1.2 NNC1=NC=CC=C1 22630 [1,0,0,0,0,0|3,0,0]=4 198 B8R1.2 O=CC1=CC=CN=C1 1124 [1,0,0,0,0,0|3,0,0]=4 199 B8R1.2 O=CC1=CC=NC=C1 11745 [1,0,0,0,0,0|3,0,0]=4 200 B8R1.2 O=CC1=NC=CC=C1 11741 [1,0,0,0,0,0|3,0,0]=4 201 B8R1.2 OCC1=CC=CN=C1 11736 [1,0,0,0,0,0|3,0,0]=4 202 B8R1.2 OCC1=CC=NC=C1 11738 [1,0,0,0,0,0|3,0,0]=4 203 B8R1.2 OCC1=NC=CC=C1 9301 [1,0,0,0,0,0|3,0,0]=4 204 B8R1.2 SCC1=CC=CC=C1 6835 [1,0,0,0,0,0|2,0,0]=3 205 B8R1.2 SCC1=CC=CN=C1 25049 [1,0,0,0,0,0|3,0,0]=4 206 B8R1.2 SCC1=CC=NC=C1 25053 [1,0,0,0,0,0|3,0,0]=4 207 B8R1.2 SCC1=NC=CC=C1 25013 [1,0,0,0,0,0|3,0,0]=4 208 B8R1.5 BrC1=C(Br)C=CC=C1 3852 [1,0,0,0,0,0|2,0,0]=3 209 B8R1.5 BrC1=C(Br)C=NC=C1 6611 [1,0,0,0,0,0|3,0,0]=4 210 B8R1.5 BrC1=C(I)C=CC=C1 19983 [1,0,0,0,0,0|2,0,0]=3 211 B8R1.5 BrC1=C(I)C=CC=C1 2278 [1,0,0,0,0,0|2,0,0]=3 212 B8R1.5 BrC1=C(I)C=CN=C1 35720 [1,0,0,0,0,0|3,0,0]=4 213 B8R1.5 BrC1=CC=CN=C1Br 5402 [1,0,0,0,0,0|3,0,0]=4 214 B8R1.5 BrC1=CC=CN=C1I 11018 [1,0,0,0,0,0|3,0,0]=4 215 B8R1.5 BrC1=NC=CC=C1I 13529 [1,0,0,0,0,0|3,0,0]=4 216 B8R1.5 CC1=C(Br)C=CC=C1 3834 [1,0,0,0,0,0|1,0,0]=2 217 B8R1.5 CC1=C(Br)C=CN=C1 10604 [1,0,0,0,0,0|2,0,0]=3 218 B8R1.5 CC1=C(Br)C=CN=C1 6889 [1,0,0,0,0,0|2,0,0]=3 219 B8R1.5 CC1=C(Br)C=NC=C1 3994 [1,0,0,0,0,0|2,0,0]=3 220 B8R1.5 CC1=C(Cl)C=CC=C1 19748 [1,0,0,0,0,0|1,0,0]=2 221 B8R1.5 CC1=C(Cl)C=CN=C1 17464 [1,0,0,0,0,0|2,0,0]=3 222 B8R1.5 CC1=C(Cl)C=CN=C1 9218 [1,0,0,0,0,0|2,0,0]=3 223 B8R1.5 CC1=C(Cl)C=NC=C1 14323 [1,0,0,0,0,0|2,0,0]=3 224 B8R1.5 CC1=C(Cl)N=NC=C1 11015 [1,0,0,0,0,0|3,0,0]=4 225 B8R1.5 CC1=C(F)C=CN=C1 15249 [1,0,0,0,0,0|2,0,0]=3 226 B8R1.5 CC1=C(F)C=NC=C1 9251 [1,0,0,0,0,0|2,0,0]=3 227 B8R1.5 CC1=C(I)C=CC=C1 9516 [1,0,0,0,0,0|1,0,0]=2 228 B8R1.5 CC1=C(N)C=CN=C1 1119 [1,0,0,0,0,0|2,0,0]=3 229 B8R1.5 CC1=C(N)C=NC=C1 1278 [1,0,0,0,0,0|2,0,0]=3 230 B8R1.5 CC1=C(O)C=NC=C1 15184 [1,0,0,0,0,0|1,0,0]=2 231 B8R1.5 CC1=C(O)N=NC=C1 19780 [1,0,0,0,0,0|2,0,0]=3 232 B8R1.5 CC1=C(S)C=CC=C1 6806 [1,0,0,0,0,0|0,1,0]=2 233 B8R1.5 CC1=CC=CC=C1N 20202 [1,0,0,0,0,0|1,0,0]=2 234 B8R1.5 CC1=CC=CC=C1O 15714 [1,0,0,0,0,0|0,0,0]=1 235 B8R1.5 CC1=CC=CN=C1Br 9208 [1,0,0,0,0,0|2,0,0]=3 236 B8R1.5 CC1=CC=CN=C1C 20520 [1,0,0,0,0,0|1,0,0]=2 237 B8R1.5 CC1=CC=CN=C1Cl 2074 [1,0,0,0,0,0|2,0,0]=3 238 B8R1.5 CC1=CC=CN=C1F 3992 [1,0,0,0,0,0|2,0,0]=3 239 B8R1.5 CC1=CC=CN=C1I 14399 [1,0,0,0,0,0|2,0,0]=3 240 B8R1.5 CC1=CC=CN=C1N 1217 [1,0,0,0,0,0|2,0,0]=3 241 B8R1.5 CC1=CC=CN=C1O 14401 [1,0,0,0,0,0|1,0,0]=2 242 B8R1.5 CC1=CC=CN=C1O 8871 [1,0,0,0,0,0|1,0,0]=2 243 B8R1.5 CC1=CN=CN=C1Cl 21457 [1,0,0,0,0,0|3,0,0]=4 244 B8R1.5 CC1=NC=CC=C1Br 1220 [1,0,0,0,0,0|2,0,0]=3 245 B8R1.5 CC1=NC=CC=C1Cl 14380 [1,0,0,0,0,0|2,0,0]=3 246 B8R1.5 CC1=NC=CC=C1F 14381 [1,0,0,0,0,0|2,0,0]=3 247 B8R1.5 CC1=NC=CC=C1I 14400 [1,0,0,0,0,0|2,0,0]=3 248 B8R1.5 CC1=NC=CC=C1N 2076 [1,0,0,0,0,0|2,0,0]=3 249 B8R1.5 CC1=NC=CC=C1O 6626 [1,0,0,0,0,0|1,0,0]=2 250 B8R1.5 CC1=NC=CN=C1Br 18035 [1,0,0,0,0,0|3,0,0]=4 251 B8R1.5 CC1=NC=CN=C1C 8607 [1,0,0,0,0,0|2,0,0]=3 252 B8R1.5 CC1=NC=CN=C1Cl 2149 [1,0,0,0,0,0|3,0,0]=4 253 B8R1.5 CC1=NC=CN=C1N 19617 [1,0,0,0,0,0|3,0,0]=4 254 B8R1.5 CC1=NC=CN=C1O 34244 [1,0,0,0,0,0|2,0,0]=3 255 B8R1.5 CC1=NC=NC=C1Br 17240 [1,0,0,0,0,0|3,0,0]=4 256 B8R1.5 CC1=NC=NC=C1Cl 16949 [1,0,0,0,0,0|3,0,0]=4 257 B8R1.5 CC1=NC=NC=C1N 19924 [1,0,0,0,0,0|3,0,0]=4 258 B8R1.5 CC1=[N+]([O-])C=CC=C1 14342 [1,0,0,0,0,0|1,0,1]=3 259 B8R1.5 CN1C=CC=CC1=O 25381 [1,0,0,0,0,0|1,0,1]=3 260 B8R1.5 C[N+]1=C(Cl)C=CC=C1 16659 [1,0,0,0,0,0|2,0,0]=3 261 B8R1.5 ClC1=C(Br)C=CC=C1 3582 [1,0,0,0,0,0|2,0,0]=3 262 B8R1.5 ClC1=C(Br)C=CN=C1 1288 [1,0,0,0,0,0|3,0,0]=4 263 B8R1.5 ClC1=C(Br)C=NC=C1 1287 [1,0,0,0,0,0|3,0,0]=4 264 B8R1.5 ClC1=C(Br)C=NC=C1 27014 [1,0,0,0,0,0|3,0,0]=4 265 B8R1.5 ClC1=C(Cl)C=CC=C1 16667 [1,0,0,0,0,0|2,0,0]=3 266 B8R1.5 ClC1=C(Cl)C=NC=C1 6613 [1,0,0,0,0,0|3,0,0]=4 267 B8R1.5 ClC1=C(Cl)C=NC=C1 9823 [1,0,0,0,0,0|3,0,0]=4 268 B8R1.5 ClC1=C(I)C=CC=C1 3646 [1,0,0,0,0,0|2,0,0]=3 269 B8R1.5 ClC1=C(I)C=CN=C1 9822 [1,0,0,0,0,0|3,0,0]=4 270 B8R1.5 ClC1=C(I)C=NC=C1 8083 [1,0,0,0,0,0|3,0,0]=4 271 B8R1.5 ClC1=CC=CN=C1Br 5776 [1,0,0,0,0,0|3,0,0]=4 272 B8R1.5 ClC1=CC=CN=C1Cl 1198 [1,0,0,0,0,0|3,0,0]=4 273 B8R1.5 ClC1=NC=CC=C1Br 1098 [1,0,0,0,0,0|3,0,0]=4 274 B8R1.5 ClC1=NC=CC=C1I 1188 [1,0,0,0,0,0|3,0,0]=4 275 B8R1.5 FC1=C(Br)C=CC=C1 3215 [1,0,0,0,0,0|2,0,0]=3 276 B8R1.5 FC1=C(Br)C=CN=C1 18130 [1,0,0,0,0,0|3,0,0]=4 277 B8R1.5 FC1=C(Br)C=CN=C1 6660 [1,0,0,0,0,0|3,0,0]=4 278 B8R1.5 FC1=C(Br)C=NC=C1 3009 [1,0,0,0,0,0|3,0,0]=4 279 B8R1.5 FC1=C(Cl)C=CC=C1 3418 [1,0,0,0,0,0|2,0,0]=3 280 B8R1.5 FC1=C(Cl)C=CN=C1 6667 [1,0,0,0,0,0|3,0,0]=4 281 B8R1.5 FC1=C(Cl)C=CN=C1 6668 [1,0,0,0,0,0|3,0,0]=4 282 B8R1.5 FC1=C(Cl)C=NC=C1 6675 [1,0,0,0,0,0|3,0,0]=4 283 B8R1.5 FC1=C(F)C=CC=C1 2307 [1,0,0,0,0,0|2,0,0]=3 284 B8R1.5 FC1=C(F)C=NC=C1 16287 [1,0,0,0,0,0|3,0,0]=4 285 B8R1.5 FC1=C(I)C=CC=C1 3496 [1,0,0,0,0,0|2,0,0]=3 286 B8R1.5 FC1=C(I)C=CN=C1 9249 [1,0,0,0,0,0|3,0,0]=4 287 B8R1.5 FC1=C(S)C=CC=C1 5428 [1,0,0,0,0,0|1,1,0]=3 288 B8R1.5 FC1=CC=CN=C1Br 3002 [1,0,0,0,0,0|3,0,0]=4 289 B8R1.5 FC1=CC=CN=C1Cl 2532 [1,0,0,0,0,0|3,0,0]=4 290 B8R1.5 FC1=CC=CN=C1F 5414 [1,0,0,0,0,0|3,0,0]=4 291 B8R1.5 FC1=CC=CN=C1I 6569 [1,0,0,0,0,0|3,0,0]=4 292 B8R1.5 FC1=NC=CC=C1Br 3008 [1,0,0,0,0,0|3,0,0]=4 293 B8R1.5 FC1=NC=CC=C1Cl 6263 [1,0,0,0,0,0|3,0,0]=4 294 B8R1.5 FC1=NC=CC=C1I 1231 [1,0,0,0,0,0|3,0,0]=4 295 B8R1.5 IC1=C(I)C=CC=C1 3831 [1,0,0,0,0,0|2,0,0]=3 296 B8R1.5 IC1=CC=CN=C1I 9245 [1,0,0,0,0,0|3,0,0]=4 297 B8R1.5 NC1=C(Br)C=CC=C1 3722 [1,0,0,0,0,0|2,0,0]=3 298 B8R1.5 NC1=C(Br)C=CN=C1 6658 [1,0,0,0,0,0|3,0,0]=4 299 B8R1.5 NC1=C(Br)C=NC=C1 1242 [1,0,0,0,0,0|3,0,0]=4 300 B8R1.5 NC1=C(Cl)C=CC=C1 19107 [1,0,0,0,0,0|2,0,0]=3 301 B8R1.5 NC1=C(Cl)C=CN=C1 6665 [1,0,0,0,0,0|3,0,0]=4 302 B8R1.5 NC1=C(Cl)C=NC=C1 6653 [1,0,0,0,0,0|3,0,0]=4 303 B8R1.5 NC1=C(F)C=CC=C1 15382 [1,0,0,0,0,0|2,0,0]=3 304 B8R1.5 NC1=C(F)C=CC=C1 5245 [1,0,0,0,0,0|2,0,0]=3 305 B8R1.5 NC1=C(F)C=NC=C1 1261 [1,0,0,0,0,0|3,0,0]=4 306 B8R1.5 NC1=C(F)C=NC=C1 26667 [1,0,0,0,0,0|3,0,0]=4 307 B8R1.5 NC1=C(I)C=CC=C1 10573 [1,0,0,0,0,0|2,0,0]=3 308 B8R1.5 NC1=C(I)C=CN=C1 6681 [1,0,0,0,0,0|3,0,0]=4 309 B8R1.5 NC1=C(I)C=NC=C1 6632 [1,0,0,0,0,0|3,0,0]=4 310 B8R1.5 NC1=C(N)C=CC=C1 32376 [1,0,0,0,0,0|2,0,0]=3 311 B8R1.5 NC1=C(N)C=NC=C1 1295 [1,0,0,0,0,0|3,0,0]=4 312 B8R1.5 NC1=C(O)C=CN=C1 6679 [1,0,0,0,0,0|2,0,0]=3 313 B8R1.5 NC1=C(O)C=NC=C1 6654 [1,0,0,0,0,0|2,0,0]=3 314 B8R1.5 NC1=C(S)C=CC=C1 5424 [1,0,0,0,0,0|1,1,0]=3 315 B8R1.5 NC1=CC=CN=C1Br 5766 [1,0,0,0,0,0|3,0,0]=4 316 B8R1.5 NC1=CC=CN=C1Cl 1096 [1,0,0,0,0,0|3,0,0]=4 317 B8R1.5 NC1=CC=CN=C1F 1259 [1,0,0,0,0,0|3,0,0]=4 318 B8R1.5 NC1=CC=CN=C1I 9292 [1,0,0,0,0,0|3,0,0]=4 319 B8R1.5 NC1=CC=CN=C1N 1296 [1,0,0,0,0,0|3,0,0]=4 320 B8R1.5 NC1=CC=CN=C1N 5394 [1,0,0,0,0,0|3,0,0]=4 321 B8R1.5 NC1=CC=CN=C1O 1263 [1,0,0,0,0,0|2,0,0]=3 322 B8R1.5 NC1=NC=CC=C1Br 1241 [1,0,0,0,0,0|3,0,0]=4 323 B8R1.5 NC1=NC=CC=C1Cl 5562 [1,0,0,0,0,0|3,0,0]=4 324 B8R1.5 NC1=NC=CC=C1F 2976 [1,0,0,0,0,0|3,0,0]=4 325 B8R1.5 NC1=NC=CC=C1I 1265 [1,0,0,0,0,0|3,0,0]=4 326 B8R1.5 NC1=NC=CC=C1O 2574 [1,0,0,0,0,0|2,0,0]=3 327 B8R1.5 NC1=NC=CC=C1S 16432 [1,0,0,0,0,0|2,1,0]=4 328 B8R1.5 NC1=NC=CN=C1O 27948 [1,0,0,0,0,0|3,0,0]=4 329 B8R1.5 Nc1ccccc1N 23346 [1,0,0,0,0,0|2,0,0]=3 330 B8R1.5 O=C1C=COC=C1O 25209 [1,0,0,0,0,0|2,0,0]=3 331 B8R1.5 OC1=C(Br)C=CC=C1 3841 [1,0,0,0,0,0|1,0,0]=2 332 B8R1.5 OC1=C(Br)C=CN=C1 6661 [1,0,0,0,0,0|2,0,0]=3 333 B8R1.5 OC1=C(Br)C=NC=C1 6678 [1,0,0,0,0,0|2,0,0]=3 334 B8R1.5 OC1=C(Cl)C=CC=C1 12600 [1,0,0,0,0,0|1,0,0]=2 335 B8R1.5 OC1=C(Cl)C=CN=C1 6669 [1,0,0,0,0,0|2,0,0]=3 336 B8R1.5 OC1=C(Cl)C=NC=C1 6680 [1,0,0,0,0,0|2,0,0]=3 337 B8R1.5 OC1=C(F)C=CC=C1 2313 [1,0,0,0,0,0|1,0,0]=2 338 B8R1.5 OC1=C(I)C=CC=C1 3963 [1,0,0,0,0,0|1,0,0]=2 339 B8R1.5 OC1=C(S)C=CC=C1 6827 [1,0,0,0,0,0|1,0,0]=2 340 B8R1.5 OC1=CC=CN=C1Br 2572 [1,0,0,0,0,0|2,0,0]=3 341 B8R1.5 OC1=CC=CN=C1Cl 2577 [1,0,0,0,0,0|2,0,0]=3 342 B8R1.5 OC1=CC=CN=C1F 6290 [1,0,0,0,0,0|2,0,0]=3 343 B8R1.5 OC1=CC=CN=C1I 6571 [1,0,0,0,0,0|2,0,0]=3 344 B8R1.5 OC1=CC=CN=C1O 2580 [1,0,0,0,0,0|2,0,0]=3 345 B8R1.5 OC1=NC=CC=C1Br 1177 [1,0,0,0,0,0|2,0,0]=3 346 B8R1.5 OC1=NC=CC=C1Cl 6538 [1,0,0,0,0,0|2,0,0]=3 347 B8R1.5 OC1=NC=CC=C1F 1200 [1,0,0,0,0,0|2,0,0]=3 348 B8R1.5 OC1=NC=CC=C1I 6701 [1,0,0,0,0,0|2,0,0]=3 349 B8R1.5 OC1=NC=NC=C1Br 24352 [1,0,0,0,0,0|3,0,0]=4 350 B8R1.5 OC1=NC=NC=C1F 7191 [1,0,0,0,0,0|3,0,0]=4 351 B8R1.5 SC1=C(Br)C=CC=C1 4009 [1,0,0,0,0,0|1,1,0]=3 352 B8R1.5 SC1=C(Cl)C=CC=C1 6776 [1,0,0,0,0,0|1,1,0]=3 353 B8R1.5 [O-][N+]1=C(Br)C=CC=C1 13510 [1,0,0,0,0,0|2,0,1]=4 354 B8R1.5 [O-][N+]1=C(Cl)C=CC=C1 1196 [1,0,0,0,0,0|2,0,1]=4 355 B8R1.5 [O-][N+]1=CC=CC=C1O 26927 [1,0,0,0,0,0|2,0,0]=3 356 B10R1.2 BrCC1=C(Br)C(I)=CC=C1 31265 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.2 CC1=C(Br)C=CN=C1C=O 27808 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.2 CC1=C(C#N)C=CC=C1Br 19931 [0,1,0,0,0,0|2,0,0]=3 359 B10R1.2 CC1=C(C#N)C=CC=C1Cl 23847 [0,1,0,0,0,0|2,0,0]=3 360 B10R1.2 CC1=C(C#N)C=CC=C1F 1556 [0,1,0,0,0,0|2,0,0]=3 361 B10R1.2 CC1=C(C#N)C=CC=C1I 23173 [0,1,0,0,0,0|2,0,0]=3 362 B10R1.2 CC1=C(C#N)C=CN=C1Cl 34729 [0,1,0,0,0,0|3,0,0]=4 363 B10R1.2 CC1=C(C=O)C=CC=C1Br 30964 [0,1,0,0,0,0|2,0,0]=3 364 B10R1.2 CC1=C(C=O)C=CC=C1Cl 28399 [0,1,0,0,0,0|2,0,0]=3 365 B10R1.2 CC1=C(C=O)C=CC=C1F 1453 [0,1,0,0,0,0|2,0,0]=3 366 B10R1.2 CC1=C(C=O)C=CC=C1O 30949 [0,1,0,0,0,0|2,0,0]=3 367 B10R1.2 CC1=C(C=O)C=CN=C1Cl 33749 [0,1,0,0,0,0|3,0,0]=4 368 B10R1.2 CC1=C(CBr)C=CC=C1Br 31382 [0,1,0,0,0,0|2,0,0]=3 369 B10R1.2 CC1=C(CBr)C=CC=C1I 31386 [0,1,0,0,0,0|2,0,0]=3 370 B10R1.2 CC1=C(CO)C=CC=C1Br 31381 [0,1,0,0,0,0|2,0,0]=3 371 B10R1.2 CC1=C(CO)C=CC=C1F 4925 [0,1,0,0,0,0|2,0,0]=3 372 B10R1.2 CC1=C(CO)C=CC=C1I 31385 [0,1,0,0,0,0|2,0,0]=3 373 B10R1.2 CC1=C(CO)C=CC=C1N 19790 [0,1,0,0,0,0|2,0,0]=3 374 B10R1.2 CC1=C(Cl)C=CN=C1C#N 33555 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.2 CC1=C(Cl)C=CN=C1C=O 33533 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.2 CC1=CC=CC(C#N)=C1Br 26070 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.2 CC1=CC=CC(C#N)=C1C 8125 [0,1,0,0,0,0|2,0,0]=3 378 B10R1.2 CC1=CC=CC(C#N)=C1Cl 4731 [0,1,0,0,0,0|3,0,0]=4 379 B10R1.2 CC1=CC=CC(C#N)=C1F 4788 [0,1,0,0,0,0|3,0,0]=4 380 B10R1.2 CC1=CC=CC(C#N)=C1N 27566 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.2 CC1=CC=CC(C=O)=C1Br 30978 [0,1,0,0,0,0|3,0,0]=4 382 B10R1.2 CC1=CC=CC(C=O)=C1C 3080 [0,1,0,0,0,0|2,0,0]=3 383 B10R1.2 CC1=CC=CC(C=O)=C1Cl 28398 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.2 CC1=CC=CC(C=O)=C1F 1450 [0,1,0,0,0,0|3,0,0]=4 385 B10R1.2 CC1=CC=CC(C=O)=C1O 14264 [0,1,0,0,0,0|3,0,0]=4 386 B10R1.2 CC1=CC=CC(CBr)=C1Br 31378 [0,1,0,0,0,0|3,0,0]=4 387 B10R1.2 CC1=CC=CC(CBr)=C1C 27463 [0,1,0,0,0,0|2,0,0]=3 388 B10R1.2 CC1=CC=CC(CN)=C1Cl 31260 [0,1,0,0,0,0|3,0,0]=4 389 B10R1.2 CC1=CC=CC(CN)=C1F 31262 [0,1,0,0,0,0|3,0,0]=4 390 B10R1.2 CC1=CC=CC(CO)=C1Br 31377 [0,1,0,0,0,0|3,0,0]=4 391 B10R1.2 CC1=CC=CC(NN)=C1C 6398 [0,1,0,0,0,0|2,0,0]=3 392 B10R1.2 CCC1=C(O)C(O)=CC=C1 33193 [0,1,0,0,0,0|2,0,0]=3 393 B10R1.2 CCC1=CC=CC(Br)=C1O 33831 [0,1,0,0,0,0|2,0,0]=3 394 B10R1.2 CCC1=CC=CC(Cl)=C1N 34625 [0,1,0,0,0,0|2,0,0]=3 395 B10R1.2 CCC1=CC=CC(Cl)=C1O 27841 [0,1,0,0,0,0|2,0,0]=3 396 B10R1.2 CCC1=CC=CC(O)=C1F 27791 [0,1,0,0,0,0|2,0,0]=3 397 B10R1.2 COC1=C(Br)C(Br)=CC=C1 31145 [0,1,0,0,0,0|1,0,0]=2 398 B10R1.2 COC1=C(Br)C(C)=CC=C1 31146 [0,1,0,0,0,0|1,0,0]=2 399 B10R1.2 COC1=C(Br)C(F)=CC=C1 4125 [0,1,0,0,0,0|1,0,0]=2 400 B10R1.2 COC1=C(C)C(Br)=CC=C1 31165 [0,1,0,0,0,0|0,0,0]=1 401 B10R1.2 COC1=C(C)C(C)=CC=C1 4114 [0,1,0,0,0,0|0,0,0]=1 402 B10R1.2 COC1=C(C)C(Cl)=CC=C1 2664 [0,1,0,0,0,0|0,0,0]=1 403 B10R1.2 COC1=C(Cl)C(Br)=CC=C1 31152 [0,1,0,0,0,0|1,0,0]=2 404 B10R1.2 COC1=C(Cl)C(Cl)=CC=C1 3680 [0,1,0,0,0,0|1,0,0]=2 405 B10R1.2 COC1=C(Cl)C(F)=CC=C1 31158 [0,1,0,0,0,0|1,0,0]=2 406 B10R1.2 COC1=C(F)C(Br)=CC=C1 4127 [0,1,0,0,0,0|1,0,0]=2 407 B10R1.2 COC1=C(F)C(Cl)=CC=C1 31153 [0,1,0,0,0,0|1,0,0]=2 408 B10R1.2 COC1=C(F)C(Cl)=CC=C1 8445 [0,1,0,0,0,0|1,0,0]=2 409 B10R1.2 COC1=C(I)C(F)=CC=C1 4119 [0,1,0,0,0,0|1,0,0]=2 410 B10R1.2 COC1=C(I)C(N)=CC=C1 28346 [0,1,0,0,0,0|1,0,0]=2 411 B10R1.2 COC1=C(I)C(N)=NC=C1 26695 [0,1,0,0,0,0|2,0,0]=3 412 B10R1.2 COC1=C(N)C(Cl)=NC=N1 29067 [0,1,0,0,0,0|3,0,0]=4 413 B10R1.2 COC1=CC=CC(Br)=C1N 31031 [0,1,0,0,0,0|1,0,0]=2 414 B10R1.2 COC1=CC=CC(Br)=C1O 33838 [0,1,0,0,0,0|1,0,0]=2 415 B10R1.2 COC1=CC=CC(Cl)=C1N 31032 [0,1,0,0,0,0|1,0,0]=2 416 B10R1.2 COC1=CC=CC(Cl)=C1O 28111 [0,1,0,0,0,0|1,0,0]=2 417 B10R1.2 COC1=CC=CC(F)=C1F 1969 [0,1,0,0,0,0|1,0,0]=2 418 B10R1.2 COC1=CC=CC(F)=C1N 8485 [0,1,0,0,0,0|1,0,0]=2 419 B10R1.2 COC1=CC=CC(F)=C1O 3878 [0,1,0,0,0,0|1,0,0]=2 420 B10R1.2 COC1=CC=CC(I)=C1Br 27634 [0,1,0,0,0,0|1,0,0]=2 421 B10R1.2 COC1=CC=CC(I)=C1C 33420 [0,1,0,0,0,0|0,0,0]=1 422 B10R1.2 COC1=CC=CC(N)=C1Br 15644 [0,1,0,0,0,0|1,0,0]=2 423 B10R1.2 COC1=CC=CC(N)=C1C 15040 [0,1,0,0,0,0|0,0,0]=1 424 B10R1.2 COC1=CC=CC(N)=C1C 19248 [0,1,0,0,0,0|0,0,0]=1 425 B10R1.2 COC1=CC=CC(N)=C1Cl 19249 [0,1,0,0,0,0|1,0,0]=2 426 B10R1.2 COC1=CC=CC(N)=C1Cl 19250 [0,1,0,0,0,0|1,0,0]=2 427 B10R1.2 COC1=CC=CC(N)=C1F 15807 [0,1,0,0,0,0|1,0,0]=2 428 B10R1.2 COC1=CC=CC(N)=C1O 33268 [0,1,0,0,0,0|1,0,0]=2 429 B10R1.2 COC1=CC=CC(O)=C1Br 34186 [0,1,0,0,0,0|1,0,0]=2 430 B10R1.2 COC1=CC=CC(O)=C1Cl 33442 [0,1,0,0,0,0|1,0,0]=2 431 B10R1.2 COC1=CC=CC(O)=C1F 27943 [0,1,0,0,0,0|1,0,0]=2 432 B10R1.2 COC1=NC=CC(C)=C1Br 6583 [0,1,0,0,0,0|2,0,0]=3 433 B10R1.2 COC1=NC=CC(C)=C1N 6582 [0,1,0,0,0,0|2,0,0]=3 434 B10R1.2 COc1ccc[n+]([O-])c1Br 5949 [0,1,0,0,0,0|2,0,0]=3 435 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 10673 [0,1,0,0,0,0|0,1,0]=2 436 B10R1.2 CSC1=C(I)C(N)=NC=C1 20809 [0,1,0,0,0,0|2,1,0]=4 437 B10R1.2 ClCC1=C(Cl)C(Cl)=CC=C1 16508 [0,1,0,0,0,0|3,0,0]=4 438 B10R1.2 FC1=C(Br)C=CC=C1CCl 23347 [0,1,0,0,0,0|3,0,0]=4 439 B10R1.2 FC1=C(CBr)C=CC=C1Br 27437 [0,1,0,0,0,0|3,0,0]=4 440 B10R1.2 FC1=C(CBr)C=CC=C1Cl 4895 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.2 FC1=C(CCl)C=CC=C1Cl 31346 [0,1,0,0,0,0|3,0,0]=4 442 B10R1.2 FC1=CC=CC(CBr)=C1Br 28798 [0,1,0,0,0,0|3,0,0]=4 443 B10R1.2 FC1=CC=CC(CBr)=C1Cl 31269 [0,1,0,0,0,0|3,0,0]=4 444 B10R1.2 FC1=CC=CC(CBr)=C1F 4909 [0,1,0,0,0,0|3,0,0]=4 445 B10R1.2 FC1=CC=CC(CCl)=C1F 10225 [0,1,0,0,0,0|3,0,0]=4 446 B10R1.2 N#CC1=C(Br)C(F)=CC=C1 4702 [0,1,0,0,0,0|3,0,0]=4 447 B10R1.2 N#CC1=C(Br)C(O)=CC=C1 23204 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.2 N#CC1=C(Cl)C(Br)=CC=C1 30781 [0,1,0,0,0,0|3,0,0]=4 449 B10R1.2 N#CC1=C(Cl)C(Cl)=CC=C1 12516 [0,1,0,0,0,0|3,0,0]=4 450 B10R1.2 N#CC1=C(Cl)C(F)=CC=C1 3554 [0,1,0,0,0,0|3,0,0]=4 451 B10R1.2 N#CC1=C(F)C(Br)=CC=C1 4704 [0,1,0,0,0,0|3,0,0]=4 452 B10R1.2 N#CC1=C(F)C(Cl)=CC=C1 1559 [0,1,0,0,0,0|3,0,0]=4 453 B10R1.2 N#CC1=C(F)C(F)=CC=C1 1564 [0,1,0,0,0,0|3,0,0]=4 454 B10R1.2 N#CC1=C(F)C(I)=CC=C1 28745 [0,1,0,0,0,0|3,0,0]=4 455 B10R1.2 N#CC1=C(F)C(O)=CC=C1 4775 [0,1,0,0,0,0|3,0,0]=4 456 B10R1.2 N#CC1=C(I)C(F)=CC=C1 28746 [0,1,0,0,0,0|3,0,0]=4 457 B10R1.2 N#CC1=C(N)C(Br)=CC=C1 28704 [0,1,0,0,0,0|3,0,0]=4 458 B10R1.2 N#CC1=C(N)C(Cl)=CC=C1 4612 [0,1,0,0,0,0|3,0,0]=4 459 B10R1.2 N#CC1=C(N)C(F)=CC=C1 4638 [0,1,0,0,0,0|3,0,0]=4 460 B10R1.2 N#CC1=C(O)C(Br)=CC=C1 30801 [0,1,0,0,0,0|3,0,0]=4 461 B10R1.2 N#CC1=C(O)C(Cl)=CC=C1 27384 [0,1,0,0,0,0|3,0,0]=4 462 B10R1.2 N#CC1=C(O)C(F)=CC=C1 33421 [0,1,0,0,0,0|3,0,0]=4 463 B10R1.2 N#CC1=C(O)C(N)=CC=C1 28119 [0,1,0,0,0,0|3,0,0]=4 464 B10R1.2 N#CC1=C(O)C(O)=CC=C1 28105 [0,1,0,0,0,0|3,0,0]=4 465 B10R1.2 N#CC1=CC=CC(N)=C1F 26084 [0,1,0,0,0,0|3,0,0]=4 466 B10R1.2 N#CC1=CC=CC(N)=C1N 31030 [0,1,0,0,0,0|3,0,0]=4 467 B10R1.2 NC1=C(CO)C=CC=C1F 20365 [0,1,0,0,0,0|3,0,0]=4 468 B10R1.2 NCC1=C(Cl)C(Cl)=CC=C1 16713 [0,1,0,0,0,0|3,0,0]=4 469 B10R1.2 NCC1=C(Cl)C(F)=CC=C1 31240 [0,1,0,0,0,0|3,0,0]=4 470 B10R1.2 NCC1=C(F)C(Cl)=CC=C1 25441 [0,1,0,0,0,0|3,0,0]=4 471 B10R1.2 NCC1=C(F)C(F)=CC=C1 7356 [0,1,0,0,0,0|3,0,0]=4 472 B10R1.2 NNC1=C(Cl)C(Cl)=CC=C1 7561 [0,1,0,0,0,0|3,0,0]=4 473 B10R1.2 NNC1=C(F)C(Cl)=CC=C1 1081 [0,1,0,0,0,0|3,0,0]=4 474 B10R1.2 O=CC1=C(Br)C(Br)=CC=C1 29209 [0,1,0,0,0,0|3,0,0]=4 475 B10R1.2 O=CC1=C(Br)C(Cl)=CC=C1 27512 [0,1,0,0,0,0|3,0,0]=4 476 B10R1.2 O=CC1=C(Br)C(F)=CC=C1 1417 [0,1,0,0,0,0|3,0,0]=4 477 B10R1.2 O=CC1=C(Br)C(O)=CC=C1 20855 [0,1,0,0,0,0|3,0,0]=4 478 B10R1.2 O=CC1=C(Cl)C(Cl)=CC=C1 3079 [0,1,0,0,0,0|3,0,0]=4 479 B10R1.2 O=CC1=C(Cl)C(F)=CC=C1 1432 [0,1,0,0,0,0|3,0,0]=4 480 B10R1.2 O=CC1=C(F)C(Br)=CC=C1 22500 [0,1,0,0,0,0|3,0,0]=4 481 B10R1.2 O=CC1=C(F)C(Cl)=CC=C1 1408 [0,1,0,0,0,0|3,0,0]=4 482 B10R1.2 O=CC1=C(F)C(F)=CC=C1 1436 [0,1,0,0,0,0|3,0,0]=4 483 B10R1.2 O=CC1=C(F)C(O)=CC=C1 27364 [0,1,0,0,0,0|3,0,0]=4 484 B10R1.2 O=CC1=C(I)C(F)=CC=C1 1439 [0,1,0,0,0,0|3,0,0]=4 485 B10R1.2 O=CC1=C(O)C(Br)=CC=C1 17016 [0,1,0,0,0,0|3,0,0]=4 486 B10R1.2 O=CC1=C(O)C(Cl)=CC=C1 13405 [0,1,0,0,0,0|3,0,0]=4 487 B10R1.2 O=CC1=C(O)C(F)=CC=C1 4215 [0,1,0,0,0,0|3,0,0]=4 488 B10R1.2 O=CC1=C(O)C(I)=CC=C1 33715 [0,1,0,0,0,0|3,0,0]=4 489 B10R1.2 O=CC1=C(O)C(O)=CC=C1 6561 [0,1,0,0,0,0|3,0,0]=4 490 B10R1.2 OCC1=C(Br)C(Cl)=CC=C1 27763 [0,1,0,0,0,0|3,0,0]=4 491 B10R1.2 OCC1=C(Br)C(F)=CC=C1 25799 [0,1,0,0,0,0|3,0,0]=4 492 B10R1.2 OCC1=C(Br)C(I)=CC=C1 31266 [0,1,0,0,0,0|3,0,0]=4 493 B10R1.2 OCC1=C(Cl)C(Br)=CC=C1 31304 [0,1,0,0,0,0|3,0,0]=4 494 B10R1.2 OCC1=C(Cl)C(F)=CC=C1 31268 [0,1,0,0,0,0|3,0,0]=4 495 B10R1.2 OCC1=C(F)C(Br)=CC=C1 19843 [0,1,0,0,0,0|3,0,0]=4 496 B10R1.2 OCC1=C(F)C(F)=CC=C1 7358 [0,1,0,0,0,0|3,0,0]=4 497 B10R1.4 BrCCC1=C(Br)C=CC=C1 16179 [0,1,0,0,0,0|2,0,0]=3 498 B10R1.4 CC1=C(CC#N)C=CC=C1 32359 [0,1,0,0,0,0|1,0,1]=3 499 B10R1.4 CC1=C(N=C=S)C=CC=C1 10740 [0,1,0,0,0,0|1,0,1]=3 500 B10R1.4 CCCC1=C(N)C=CC=C1 13695 [0,1,0,0,0,0|2,0,0]=3 501 B10R1.4 CCNC1=C(N)C=CN=C1 26071 [0,1,0,0,0,0|3,0,0]=4 502 B10R1.4 CCNC1=NC=CC=C1N 6237 [0,1,0,0,0,0|3,0,0]=4 503 B10R1.4 CCOC1=C(Br)C=CC=C1 3136 [0,1,0,0,0,0|1,0,0]=2 504 B10R1.4 CCOC1=C(Br)C=CN=C1 6659 [0,1,0,0,0,0|2,0,0]=3 505 B10R1.4 CCOC1=C(Br)C=NC=C1 34353 [0,1,0,0,0,0|2,0,0]=3 506 B10R1.4 CCOC1=C(C)C=CC=C1 3179 [0,1,0,0,0,0|0,0,0]=1 507 B10R1.4 CCOC1=C(Cl)C=CC=C1 3158 [0,1,0,0,0,0|1,0,0]=2 508 B10R1.4 CCOC1=C(Cl)C=CN=C1 6666 [0,1,0,0,0,0|2,0,0]=3 509 B10R1.4 CCOC1=C(F)C=CC=C1 3173 [0,1,0,0,0,0|1,0,0]=2 510 B10R1.4 CCOC1=C(N)C=CN=C1 27756 [0,1,0,0,0,0|2,0,0]=3 511 B10R1.4 CCOC1=C(N)C=NC=C1 9610 [0,1,0,0,0,0|2,0,0]=3 512 B10R1.4 CCOC1=C(O)C=CC=C1 9505 [0,1,0,0,0,0|1,0,0]=2 513 B10R1.4 CCOC1=C(S)C=CC=C1 10527 [0,1,0,0,0,0|1,0,0]=2 514 B10R1.4 CCOC1=CC=CN=C1Br 5890 [0,1,0,0,0,0|2,0,0]=3 515 B10R1.4 CCOC1=CC=CN=C1C 34423 [0,1,0,0,0,0|1,0,0]=2 516 B10R1.4 CCOC1=CC=CN=C1N 5585 [0,1,0,0,0,0|2,0,0]=3 517 B10R1.4 CCOC1=NC=CC=C1Br 6233 [0,1,0,0,0,0|2,0,0]=3 518 B10R1.4 CCOC1=NC=CC=C1I 9248 [0,1,0,0,0,0|2,0,0]=3 519 B10R1.4 CCOC1=NC=CN=C1C 9108 [0,1,0,0,0,0|2,0,0]=3 520 B10R1.4 CCSC1=C(Br)C=CC=C1 10531 [0,1,0,0,0,0|1,1,0]=3 521 B10R1.4 COCC1=C(Br)C=CC=C1 34659 [0,1,0,0,0,0|1,0,0]=2 522 B10R1.4 ClC1=C(CCBr)C=CC=C1 31587 [0,1,0,0,0,0|2,0,0]=3 523 B10R1.4 FC1=C(N=C=S)C=CC=C1 5002 [0,1,0,0,0,0|2,0,1]=4 524 B10R1.4 N#CCC1=C(Br)C=CC=C1 12554 [0,1,0,0,0,0|2,0,1]=4 525 B10R1.4 N#CCC1=C(Cl)C=CC=C1 16503 [0,1,0,0,0,0|2,0,1]=4 526 B10R1.4 N#CCC1=C(F)C=CC=C1 2611 [0,1,0,0,0,0|2,0,1]=4 527 B10R1.4 N#CCC1=C(N)C=CC=C1 24591 [0,1,0,0,0,0|2,0,1]=4 528 B10R1.4 NC1=C(CCO)C=CC=C1 12462 [0,1,0,0,0,0|2,0,0]=3 529 B10R1.4 NCCC1=C(Br)C=CC=C1 22238 [0,1,0,0,0,0|2,0,0]=3 530 B10R1.4 NCCC1=C(F)C=CC=C1 27340 [0,1,0,0,0,0|2,0,0]=3 531 B10R1.4 NCCC1=C(O)C=CC=C1 16394 [0,1,0,0,0,0|2,0,0]=3 532 B10R1.4 NNCC1=C(F)C=CC=C1 35094 [0,1,0,0,0,0|3,0,0]=4 533 B10R1.4 NNCc1ccccc1F 34909 [0,1,0,0,0,0|3,0,0]=4 534 B10R1.4 N\N=C\C1=CC=CC=C1O 22926 [0,1,0,0,0,0|3,0,0]=4 535 B10R1.4 Nc1ccccc1CCO 22282 [0,1,0,0,0,0|2,0,0]=3 536 B10R1.4 O=C=NC1=C(F)C=CC=C1 4455 [0,1,0,0,0,0|2,0,1]=4 537 B10R1.4 OCCC1=C(Br)C=CC=C1 16178 [0,1,0,0,0,0|2,0,0]=3 538 B10R1.4 OCCC1=C(O)C=CC=C1 31971 [0,1,0,0,0,0|2,0,0]=3 539 B10R1.4 O\N=C\C1=C(Br)C=CC=C1 3731 [0,1,0,0,0,0|3,0,0]=4 540 B10R1.4 O\N=C\C1=C(F)C=CC=C1 28431 [0,1,0,0,0,0|3,0,0]=4 541 B10R1.4 S=C=NC1=C(Br)C=CC=C1 35890 [0,1,0,0,0,0|2,0,1]=4 542 B10R1.4 S=C=NC1=C(I)C=CC=C1 35920 [0,1,0,0,0,0|2,0,1]=4 543 B10R1.20 BrCC1=C(CBr)C=CC=C1 10201 [0,1,0,0,0,0|2,0,0]=3 544 B10R1.20 CCC1=C(C#N)C=CC=C1 12591 [0,1,0,0,0,0|1,0,1]=3 545 B10R1.20 CCC1=C(C=O)C=CC=C1 3074 [0,1,0,0,0,0|1,0,1]=3 546 B10R1.20 CCC1=C(NN)C=CC=C1 6412 [0,1,0,0,0,0|2,0,0]=3 547 B10R1.20 CCC1=NC=CN=C1CC 8606 [0,1,0,0,0,0|3,0,0]=4 548 B10R1.20 CNC1=NC=CC=C1CO 29183 [0,1,0,0,0,0|2,0,0]=3 549 B10R1.20 COC1=C(C#N)C=CC=C1 4812 [0,1,0,0,0,0|0,0,1]=2 550 B10R1.20 COC1=C(C=O)C=CC=C1 7413 [0,1,0,0,0,0|0,0,1]=2 551 B10R1.20 COC1=C(C=O)C=CN=C1 33676 [0,1,0,0,0,0|1,0,1]=3 552 B10R1.20 COC1=C(C=O)C=NC=C1 15264 [0,1,0,0,0,0|1,0,1]=3 553 B10R1.20 COC1=C(CBr)C=CC=C1 14738 [0,1,0,0,0,0|0,0,0]=1 554 B10R1.20 COC1=C(CCl)C=CC=C1 4651 [0,1,0,0,0,0|0,0,0]=1 555 B10R1.20 COC1=C(CN)C=CC=C1 7402 [0,1,0,0,0,0|0,0,0]=1 556 B10R1.20 COC1=C(CO)C=CC=C1 7736 [0,1,0,0,0,0|0,0,0]=1 557 B10R1.20 COC1=C(NN)C=CC=C1 16110 [0,1,0,0,0,0|1,0,0]=2 558 B10R1.20 COC1=C(NN)C=CC=C1 4496 [0,1,0,0,0,0|1,0,0]=2 559 B10R1.20 COC1=C(OC)C=CC=C1 15018 [0,1,0,0,0,0|0,0,0]=1 560 B10R1.20 COC1=C(SC)C=CC=C1 10651 [0,1,0,0,0,0|0,0,0]=1 561 B10R1.20 COC1=CC=CN=C1C#N 29062 [0,1,0,0,0,0|1,0,1]=3 562 B10R1.20 COC1=CC=CN=C1CO 24107 [0,1,0,0,0,0|1,0,0]=2 563 B10R1.20 COC1=CC=CN=C1OC 2412 [0,1,0,0,0,0|1,0,0]=2 564 B10R1.20 COC1=CC=NC=C1C#N 13984 [0,1,0,0,0,0|1,0,1]=3 565 B10R1.20 COC1=NC=CC=C1C=O 15124 [0,1,0,0,0,0|1,0,1]=3 566 B10R1.20 CSC1=C(C=O)C=CC=C1 10676 [0,1,0,0,0,0|0,1,1]=3 567 B10R1.20 ClCC1=C(CCl)C=CC=C1 10209 [0,1,0,0,0,0|2,0,0]=3 568 B10R1.20 ClCC1=C(CCl)C=NC=C1 20231 [0,1,0,0,0,0|3,0,0]=4 569 B10R1.20 N#CC1=C(C=O)C=CC=C1 7409 [0,1,0,0,0,0|2,0,1]=4 570 B10R1.20 N#CC1=C(CBr)C=CC=C1 7371 [0,1,0,0,0,0|2,0,0]=3 571 B10R1.20 N#CC1=C(CCl)C=CC=C1 7522 [0,1,0,0,0,0|2,0,0]=3 572 B10R1.20 N#CC1=C(CN)C=CC=C1 31759 [0,1,0,0,0,0|2,0,0]=3 573 B10R1.20 N#CC1=CC=CC=C1C#N 18562 [0,1,0,0,0,0|2,0,1]=4 574 B10R1.20 N#CC1=CC=CN=C1CO 20085 [0,1,0,0,0,0|3,0,0]=4 575 B10R1.20 NCC1=C(CO)C=CC=C1 16185 [0,1,0,0,0,0|2,0,0]=3 576 B10R1.20 OCC1=CC=CC=C1CO 22613 [0,1,0,0,0,0|2,0,0]=3 577 B10R1.20 OCC1=CC=CN=C1CO 23565 [0,1,0,0,0,0|3,0,0]=4 578 B10R1.25 CC1=C(C#N)C=CC(Br)=C1 4721 [0,1,0,0,0,0|2,0,0]=3 579 B10R1.25 CC1=C(C#N)C=CC(Br)=N1 5962 [0,1,0,0,0,0|3,0,0]=4 580 B10R1.25 CC1=C(C#N)C=CC(Cl)=C1 12503 [0,1,0,0,0,0|2,0,0]=3 581 B10R1.25 CC1=C(C#N)C=CC(F)=C1 1554 [0,1,0,0,0,0|2,0,0]=3 582 B10R1.25 CC1=C(C#N)C=CC(F)=N1 1106 [0,1,0,0,0,0|3,0,0]=4 583 B10R1.25 CC1=C(C#N)C=CC(N)=C1 25751 [0,1,0,0,0,0|2,0,0]=3 584 B10R1.25 CC1=C(C#N)C=CC(N)=N1 14519 [0,1,0,0,0,0|3,0,0]=4 585 B10R1.25 CC1=C(C#N)C=CC(O)=C1 27578 [0,1,0,0,0,0|2,0,0]=3 586 B10R1.25 CC1=C(C=O)C=CC(Br)=C1 25414 [0,1,0,0,0,0|2,0,0]=3 587 B10R1.25 CC1=C(C=O)C=CC(Br)=N1 34417 [0,1,0,0,0,0|3,0,0]=4 588 B10R1.25 CC1=C(C=O)C=CC(Cl)=C1 23457 [0,1,0,0,0,0|2,0,0]=3 589 B10R1.25 CC1=C(C=O)C=CC(F)=C1 1456 [0,1,0,0,0,0|2,0,0]=3 590 B10R1.25 CC1=C(C=O)C=CC(F)=N1 17087 [0,1,0,0,0,0|3,0,0]=4 591 B10R1.25 CC1=C(C=O)C=CC(O)=C1 3910 [0,1,0,0,0,0|2,0,0]=3 592 B10R1.25 CC1=C(CN)C=CC(Br)=C1 19930 [0,1,0,0,0,0|2,0,0]=3 593 B10R1.25 CC1=C(CN)C=CC(O)=C1 27617 [0,1,0,0,0,0|2,0,0]=3 594 B10R1.25 CC1=C(CO)C=CC(Br)=C1 27441 [0,1,0,0,0,0|2,0,0]=3 595 B10R1.25 CC1=CC(Br)=CN=C1C#N 19482 [0,1,0,0,0,0|3,0,0]=4 596 B10R1.25 CC1=CC(Br)=NC=C1C#N 5961 [0,1,0,0,0,0|3,0,0]=4 597 B10R1.25 CC1=CC(C)=C(C=O)C=C1 3070 [0,1,0,0,0,0|2,0,0]=3 598 B10R1.25 CC1=CC(C)=C(CO)C=C1 35348 [0,1,0,0,0,0|2,0,0]=3 599 B10R1.25 CC1=CC(C)=C(NN)C=C1 6399 [0,1,0,0,0,0|2,0,0]=3 600 B10R1.25 CC1=CC(Cl)=C(C#N)C=C1 4732 [0,1,0,0,0,0|3,0,0]=4 601 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 17007 [0,1,0,0,0,0|3,0,0]=4 602 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 28906 [0,1,0,0,0,0|3,0,0]=4 603 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 35435 [0,1,0,0,0,0|3,0,0]=4 604 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 4481 [0,1,0,0,0,0|3,0,0]=4 605 B10R1.25 CC1=CC(F)=C(C#N)C=C1 1555 [0,1,0,0,0,0|3,0,0]=4 606 B10R1.25 CC1=CC(F)=C(C=O)C=C1 1451 [0,1,0,0,0,0|3,0,0]=4 607 B10R1.25 CC1=CC(N)=C(C#N)C=C1 4661 [0,1,0,0,0,0|3,0,0]=4 608 B10R1.25 CC1=CC(N)=NC=C1C#N 5750 [0,1,0,0,0,0|3,0,0]=4 609 B10R1.25 CC1=CC(O)=C(C#N)C=C1 30774 [0,1,0,0,0,0|3,0,0]=4 610 B10R1.25 CC1=CC(O)=CN=C1C#N 17625 [0,1,0,0,0,0|3,0,0]=4 611 B10R1.25 CC1=CC=C(C=O)C(C)=N1 13948 [0,1,0,0,0,0|3,0,0]=4 612 B10R1.25 CC1=CC=C(C=O)C(O)=C1 8154 [0,1,0,0,0,0|3,0,0]=4 613 B10R1.25 CC1=NC(Cl)=CC=C1C=O 35550 [0,1,0,0,0,0|3,0,0]=4 614 B10R1.25 CC1=NC(F)=CC=C1CO 17215 [0,1,0,0,0,0|3,0,0]=4 615 B10R1.25 CCC1=C(Br)C=C(N)C=C1 27787 [0,1,0,0,0,0|2,0,0]=3 616 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 27794 [0,1,0,0,0,0|2,0,0]=3 617 B10R1.25 CNC1=C(F)C=C(F)C=C1 10041 [0,1,0,0,0,0|2,0,0]=3 618 B10R1.25 CNC1=CC=C(Br)C=C1N 34299 [0,1,0,0,0,0|2,0,0]=3 619 B10R1.25 CNC1=NC=C(Br)C=C1C 34261 [0,1,0,0,0,0|2,0,0]=3 620 B10R1.25 COC1=C(Br)C=C(Br)C=C1 3847 [0,1,0,0,0,0|1,0,0]=2 621 B10R1.25 COC1=C(Br)C=C(C)C=C1 3797 [0,1,0,0,0,0|1,0,0]=2 622 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 2629 [0,1,0,0,0,0|1,0,0]=2 623 B10R1.25 COC1=C(Br)C=C(F)C=C1 1972 [0,1,0,0,0,0|1,0,0]=2 624 B10R1.25 COC1=C(Br)C=C(N)C=C1 16856 [0,1,0,0,0,0|1,0,0]=2 625 B10R1.25 COC1=C(Br)C=C(O)C=C1 31091 [0,1,0,0,0,0|1,0,0]=2 626 B10R1.25 COC1=C(Br)C=C(O)C=N1 34282 [0,1,0,0,0,0|2,0,0]=3 627 B10R1.25 COC1=C(C)C=C(Br)C=C1 3798 [0,1,0,0,0,0|0,0,0]=1 628 B10R1.25 COC1=C(C)C=C(C)C=C1 5359 [0,1,0,0,0,0|0,0,0]=1 629 B10R1.25 COC1=C(C)C=C(Cl)C=C1 2665 [0,1,0,0,0,0|0,0,0]=1 630 B10R1.25 COC1=C(C)C=C(F)C=C1 2622 [0,1,0,0,0,0|0,0,0]=1 631 B10R1.25 COC1=C(C)C=C(N)C=C1 15790 [0,1,0,0,0,0|0,0,0]=1 632 B10R1.25 COC1=C(C)C=C(O)C=C1 33186 [0,1,0,0,0,0|0,0,0]=1 633 B10R1.25 COC1=C(Cl)C=C(Br)C=C1 2630 [0,1,0,0,0,0|1,0,0]=2 634 B10R1.25 COC1=C(Cl)C=C(C)C=C1 27687 [0,1,0,0,0,0|1,0,0]=2 635 B10R1.25 COC1=C(Cl)C=C(F)C=C1 2658 [0,1,0,0,0,0|1,0,0]=2 636 B10R1.25 COC1=C(Cl)C=C(N)C=C1 17270 [0,1,0,0,0,0|1,0,0]=2 637 B10R1.25 COC1=C(Cl)C=C(O)C=C1 33443 [0,1,0,0,0,0|1,0,0]=2 638 B10R1.25 COC1=C(Cl)N=C(N)C=C1 22126 [0,1,0,0,0,0|2,0,0]=3 639 B10R1.25 COC1=C(F)C=C(Br)C=C1 1971 [0,1,0,0,0,0|1,0,0]=2 640 B10R1.25 COC1=C(F)C=C(C)C=C1 24850 [0,1,0,0,0,0|1,0,0]=2 641 B10R1.25 COC1=C(F)C=C(Cl)C=C1 2662 [0,1,0,0,0,0|1,0,0]=2 642 B10R1.25 COC1=C(F)C=C(F)C=C1 3455 [0,1,0,0,0,0|1,0,0]=2 643 B10R1.25 COC1=C(F)C=C(N)C=C1 2125 [0,1,0,0,0,0|1,0,0]=2 644 B10R1.25 COC1=C(F)C=C(O)C=C1 2369 [0,1,0,0,0,0|1,0,0]=2 645 B10R1.25 COC1=C(F)C=C(S)C=C1 6875 [0,1,0,0,0,0|1,0,0]=2 646 B10R1.25 COC1=C(I)C=C(Cl)C=C1 14310 [0,1,0,0,0,0|1,0,0]=2 647 B10R1.25 COC1=C(I)C=C(N)C=C1 3307 [0,1,0,0,0,0|1,0,0]=2 648 B10R1.25 COC1=C(I)C=C(N)C=C1 3310 [0,1,0,0,0,0|1,0,0]=2 649 B10R1.25 COC1=C(N)C=C(F)C=C1 2256 [0,1,0,0,0,0|1,0,0]=2 650 B10R1.25 COC1=C(N)C=C(I)C=C1 28345 [0,1,0,0,0,0|1,0,0]=2 651 B10R1.25 COC1=C(N)C=C(N)C=C1 1905 [0,1,0,0,0,0|1,0,0]=2 652 B10R1.25 COC1=C(N)C=C(N)C=C1 24784 [0,1,0,0,0,0|1,0,0]=2 653 B10R1.25 COC1=C(N)C=C(N)C=C1 4107 [0,1,0,0,0,0|1,0,0]=2 654 B10R1.25 COC1=C(O)C=C(Br)C=C1 26431 [0,1,0,0,0,0|1,0,0]=2 655 B10R1.25 COC1=C(O)C=C(C)C=C1 31088 [0,1,0,0,0,0|1,0,0]=2 656 B10R1.25 COC1=C(O)C=C(F)C=C1 3882 [0,1,0,0,0,0|1,0,0]=2 657 B10R1.25 COC1=C(O)C=C(N)C=C1 3112 [0,1,0,0,0,0|1,0,0]=2 658 B10R1.25 COC1=CC=C(N)N=C1C 6638 [0,1,0,0,0,0|1,0,0]=2 659 B10R1.25 COC1=CN=C(Cl)N=C1Cl 7076 [0,1,0,0,0,0|3,0,0]=4 660 B10R1.25 COC1=CN=C(O)N=C1O 7099 [0,1,0,0,0,0|3,0,0]=4 661 B10R1.25 COC1=NC=C(Br)C=C1Br 6581 [0,1,0,0,0,0|2,0,0]=3 662 B10R1.25 COC1=NC=C(Br)C=C1C 22058 [0,1,0,0,0,0|1,0,0]=2 663 B10R1.25 COC1=NC=C(Br)C=C1Cl 1164 [0,1,0,0,0,0|2,0,0]=3 664 B10R1.25 COC1=NC=C(Br)C=C1F 10468 [0,1,0,0,0,0|2,0,0]=3 665 B10R1.25 COC1=NC=C(Br)C=C1I 8079 [0,1,0,0,0,0|2,0,0]=3 666 B10R1.25 COC1=NC=C(Br)C=C1N 17164 [0,1,0,0,0,0|2,0,0]=3 667 B10R1.25 COC1=NC=C(C)C=C1I 26966 [0,1,0,0,0,0|2,0,0]=3 668 B10R1.25 COC1=NC=C(Cl)C=C1Br 6584 [0,1,0,0,0,0|2,0,0]=3 669 B10R1.25 COC1=NC=C(Cl)C=C1O 26938 [0,1,0,0,0,0|2,0,0]=3 670 B10R1.25 COC1=NC=C(F)C=C1Br 1175 [0,1,0,0,0,0|2,0,0]=3 671 B10R1.25 COC1=NC=C(F)C=C1C 6603 [0,1,0,0,0,0|1,0,0]=2 672 B10R1.25 COC1=NC=C(F)C=C1O 15267 [0,1,0,0,0,0|2,0,0]=3 673 B10R1.25 COC1=NC=C(N)C=C1Br 1147 [0,1,0,0,0,0|2,0,0]=3 674 B10R1.25 COC1=NC=C(N)C=C1C 1268 [0,1,0,0,0,0|1,0,0]=2 675 B10R1.25 COc1ccc(Cl)cc1O 31127 [0,1,0,0,0,0|1,0,0]=2 676 B10R1.25 CSC1=C(C)C=C(O)C=C1 10656 [0,1,0,0,0,0|0,1,0]=2 677 B10R1.25 CSC1=C(F)C=C(F)C=C1 10719 [0,1,0,0,0,0|1,1,0]=3 678 B10R1.25 ClC1=C(CBr)C=CC(Br)=C1 31300 [0,1,0,0,0,0|3,0,0]=4 679 B10R1.25 ClC1=CC(Cl)=C(CBr)C=C1 27460 [0,1,0,0,0,0|3,0,0]=4 680 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 16507 [0,1,0,0,0,0|3,0,0]=4 681 B10R1.25 FC1=C(CBr)C=CC(Br)=C1 4887 [0,1,0,0,0,0|3,0,0]=4 682 B10R1.25 FC1=C(CBr)C=CC(Cl)=C1 4897 [0,1,0,0,0,0|3,0,0]=4 683 B10R1.25 FC1=CC(Br)=C(CBr)C=C1 4883 [0,1,0,0,0,0|3,0,0]=4 684 B10R1.25 FC1=CC(Cl)=C(CBr)C=C1 4893 [0,1,0,0,0,0|3,0,0]=4 685 B10R1.25 FC1=CC(Cl)=C(CCl)C=C1 36215 [0,1,0,0,0,0|3,0,0]=4 686 B10R1.25 FC1=CC(F)=C(CBr)C=C1 4911 [0,1,0,0,0,0|3,0,0]=4 687 B10R1.25 FC1=CC(F)=C(CCl)C=C1 4912 [0,1,0,0,0,0|3,0,0]=4 688 B10R1.25 N#CC1=C(Br)C=C(Cl)C=C1 27222 [0,1,0,0,0,0|3,0,0]=4 689 B10R1.25 N#CC1=C(Br)C=C(F)C=C1 3217 [0,1,0,0,0,0|3,0,0]=4 690 B10R1.25 N#CC1=C(Br)C=C(I)C=C1 25241 [0,1,0,0,0,0|3,0,0]=4 691 B10R1.25 N#CC1=C(Br)C=C(N)C=C1 30789 [0,1,0,0,0,0|3,0,0]=4 692 B10R1.25 N#CC1=C(Cl)C=C(Br)C=C1 12801 [0,1,0,0,0,0|3,0,0]=4 693 B10R1.25 N#CC1=C(Cl)C=C(F)C=C1 3422 [0,1,0,0,0,0|3,0,0]=4 694 B10R1.25 N#CC1=C(Cl)C=C(N)C=C1 4620 [0,1,0,0,0,0|3,0,0]=4 695 B10R1.25 N#CC1=C(Cl)C=C(O)C=C1 4727 [0,1,0,0,0,0|3,0,0]=4 696 B10R1.25 N#CC1=C(F)C=C(Br)C=C1 3221 [0,1,0,0,0,0|3,0,0]=4 697 B10R1.25 N#CC1=C(F)C=C(Cl)C=C1 3424 [0,1,0,0,0,0|3,0,0]=4 698 B10R1.25 N#CC1=C(F)C=C(F)C=C1 1563 [0,1,0,0,0,0|3,0,0]=4 699 B10R1.25 N#CC1=C(F)C=C(I)C=C1 4778 [0,1,0,0,0,0|3,0,0]=4 700 B10R1.25 N#CC1=C(F)C=C(N)C=C1 4646 [0,1,0,0,0,0|3,0,0]=4 701 B10R1.25 N#CC1=C(F)C=C(O)C=C1 2866 [0,1,0,0,0,0|3,0,0]=4 702 B10R1.25 N#CC1=C(F)C=C(O)C=C1 3495 [0,1,0,0,0,0|3,0,0]=4 703 B10R1.25 N#CC1=C(I)C=C(Cl)C=C1 30845 [0,1,0,0,0,0|3,0,0]=4 704 B10R1.25 N#CC1=C(I)C=C(F)C=C1 25394 [0,1,0,0,0,0|3,0,0]=4 705 B10R1.25 N#CC1=C(I)C=C(N)C=C1 18486 [0,1,0,0,0,0|3,0,0]=4 706 B10R1.25 N#CC1=C(N)C=C(Br)C=C1 12350 [0,1,0,0,0,0|3,0,0]=4 707 B10R1.25 N#CC1=C(N)C=C(Cl)C=C1 20756 [0,1,0,0,0,0|3,0,0]=4 708 B10R1.25 N#CC1=C(N)C=C(F)C=C1 18459 [0,1,0,0,0,0|3,0,0]=4 709 B10R1.25 N#CC1=C(O)C=C(Br)C=C1 3781 [0,1,0,0,0,0|3,0,0]=4 710 B10R1.25 N#CC1=C(O)C=C(Cl)C=C1 28727 [0,1,0,0,0,0|3,0,0]=4 711 B10R1.25 N#CC1=C(O)C=C(F)C=C1 26276 [0,1,0,0,0,0|3,0,0]=4 712 B10R1.25 N#CC1=C(O)C=C(N)C=C1 27615 [0,1,0,0,0,0|3,0,0]=4 713 B10R1.25 N#CC1=C(O)C=C(O)C=C1 13114 [0,1,0,0,0,0|3,0,0]=4 714 B10R1.25 NC1=C(C=O)C=CC(F)=C1 27192 [0,1,0,0,0,0|3,0,0]=4 715 B10R1.25 NC1=C(CO)C=CC(Br)=C1 31328 [0,1,0,0,0,0|3,0,0]=4 716 B10R1.25 NC1=CC(I)=C(C=O)C=C1 16530 [0,1,0,0,0,0|3,0,0]=4 717 B10R1.25 NCC1=C(Cl)C=C(F)C=C1 25411 [0,1,0,0,0,0|3,0,0]=4 718 B10R1.25 NCC1=C(F)C=C(Br)C=C1 12660 [0,1,0,0,0,0|3,0,0]=4 719 B10R1.25 NCC1=C(F)C=C(Br)C=C1 4709 [0,1,0,0,0,0|3,0,0]=4 720 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 27456 [0,1,0,0,0,0|3,0,0]=4 721 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 3428 [0,1,0,0,0,0|3,0,0]=4 722 B10R1.25 NCC1=C(F)C=C(F)C=C1 4399 [0,1,0,0,0,0|3,0,0]=4 723 B10R1.25 NNC1=C(Cl)C=C(Cl)C=C1 4486 [0,1,0,0,0,0|3,0,0]=4 724 B10R1.25 NNC1=C(Cl)C=C(Cl)C=C1 7524 [0,1,0,0,0,0|3,0,0]=4 725 B10R1.25 NNC1=C(Cl)C=C(F)C=C1 4469 [0,1,0,0,0,0|3,0,0]=4 726 B10R1.25 NNC1=C(F)C=C(Br)C=C1 4467 [0,1,0,0,0,0|3,0,0]=4 727 B10R1.25 NNC1=C(F)C=C(F)C=C1 3498 [0,1,0,0,0,0|3,0,0]=4 728 B10R1.25 NNC1=C(F)C=C(I)C=C1 3359 [0,1,0,0,0,0|3,0,0]=4 729 B10R1.25 O=CC1=C(Br)C=C(Br)C=C1 28404 [0,1,0,0,0,0|3,0,0]=4 730 B10R1.25 O=CC1=C(Br)C=C(Cl)C=C1 16872 [0,1,0,0,0,0|3,0,0]=4 731 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 2877 [0,1,0,0,0,0|3,0,0]=4 732 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 30961 [0,1,0,0,0,0|3,0,0]=4 733 B10R1.25 O=CC1=C(Br)C=C(O)C=C1 28099 [0,1,0,0,0,0|3,0,0]=4 734 B10R1.25 O=CC1=C(Cl)C=C(Br)C=C1 24612 [0,1,0,0,0,0|3,0,0]=4 735 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 1433 [0,1,0,0,0,0|3,0,0]=4 736 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 7366 [0,1,0,0,0,0|3,0,0]=4 737 B10R1.25 O=CC1=C(F)C=C(Br)C=C1 1421 [0,1,0,0,0,0|3,0,0]=4 738 B10R1.25 O=CC1=C(F)C=C(Cl)C=C1 1435 [0,1,0,0,0,0|3,0,0]=4 739 B10R1.25 O=CC1=C(F)C=C(F)C=C1 2903 [0,1,0,0,0,0|3,0,0]=4 740 B10R1.25 O=CC1=C(F)C=C(I)C=C1 4219 [0,1,0,0,0,0|3,0,0]=4 741 B10R1.25 O=CC1=C(F)C=C(O)C=C1 1442 [0,1,0,0,0,0|3,0,0]=4 742 B10R1.25 O=CC1=C(I)C=C(Cl)C=C1 22996 [0,1,0,0,0,0|3,0,0]=4 743 B10R1.25 O=CC1=C(I)C=C(F)C=C1 22995 [0,1,0,0,0,0|3,0,0]=4 744 B10R1.25 O=CC1=C(I)C=C(O)C=C1 28098 [0,1,0,0,0,0|3,0,0]=4 745 B10R1.25 O=CC1=C(O)C=C(Br)C=C1 16944 [0,1,0,0,0,0|3,0,0]=4 746 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 22142 [0,1,0,0,0,0|3,0,0]=4 747 B10R1.25 O=CC1=C(O)C=C(F)C=C1 8483 [0,1,0,0,0,0|3,0,0]=4 748 B10R1.25 O=CC1=C(O)C=C(O)C=C1 8218 [0,1,0,0,0,0|3,0,0]=4 749 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 9781 [0,1,0,0,0,0|3,0,0]=4 750 B10R1.25 OCC1=C(Br)C=C(F)C=C1 3222 [0,1,0,0,0,0|3,0,0]=4 751 B10R1.25 OCC1=C(Br)C=C(I)C=C1 31340 [0,1,0,0,0,0|3,0,0]=4 752 B10R1.25 OCC1=C(Cl)C=C(Cl)C=C1 9993 [0,1,0,0,0,0|3,0,0]=4 753 B10R1.25 OCC1=C(Cl)C=C(F)C=C1 3426 [0,1,0,0,0,0|3,0,0]=4 754 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 31313 [0,1,0,0,0,0|3,0,0]=4 755 B10R1.25 OCC1=C(F)C=C(Br)C=C1 3223 [0,1,0,0,0,0|3,0,0]=4 756 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 26669 [0,1,0,0,0,0|3,0,0]=4 757 B10R1.25 OCC1=C(F)C=C(F)C=C1 4910 [0,1,0,0,0,0|3,0,0]=4 758 B10R1.25 OCC1=C(I)C=C(F)C=C1 31350 [0,1,0,0,0,0|3,0,0]=4 759 B10R1.25 OCC1=C(O)C=C(Br)C=C1 15237 [0,1,0,0,0,0|3,0,0]=4 760 B10R1.30 BrCC1=C(Br)C=CC(I)=C1 31312 [0,1,0,0,0,0|3,0,0]=4 761 B10R1.30 BrCC1=C(I)C=CC(Br)=C1 31317 [0,1,0,0,0,0|3,0,0]=4 762 B10R1.30 C=CC1=C(Br)C=CC(F)=C1 16646 [0,1,0,0,0,0|2,0,1]=4 763 B10R1.30 CC1=C(C#N)C=C(Br)C=C1 30796 [0,1,0,0,0,0|2,0,0]=3 764 B10R1.30 CC1=C(C#N)C=C(Cl)C=C1 12504 [0,1,0,0,0,0|2,0,0]=3 765 B10R1.30 CC1=C(C#N)C=C(F)C=C1 1551 [0,1,0,0,0,0|2,0,0]=3 766 B10R1.30 CC1=C(C#N)C=C(N)C=C1 28708 [0,1,0,0,0,0|2,0,0]=3 767 B10R1.30 CC1=C(C#N)C=C(O)C=C1 33444 [0,1,0,0,0,0|2,0,0]=3 768 B10R1.30 CC1=C(C=O)C=C(Br)C=C1 10353 [0,1,0,0,0,0|2,0,0]=3 769 B10R1.30 CC1=C(C=O)C=C(Cl)C=C1 33750 [0,1,0,0,0,0|2,0,0]=3 770 B10R1.30 CC1=C(C=O)C=C(F)C=C1 1458 [0,1,0,0,0,0|2,0,0]=3 771 B10R1.30 CC1=C(C=O)C=C(I)C=C1 26001 [0,1,0,0,0,0|2,0,0]=3 772 B10R1.30 CC1=C(C=O)C=C(O)C=C1 30957 [0,1,0,0,0,0|2,0,0]=3 773 B10R1.30 CC1=C(CBr)C=C(F)C=C1 4927 [0,1,0,0,0,0|2,0,0]=3 774 B10R1.30 CC1=C(CBr)C=C(I)C=C1 13831 [0,1,0,0,0,0|2,0,0]=3 775 B10R1.30 CC1=C(CCl)C=C(F)C=C1 4926 [0,1,0,0,0,0|2,0,0]=3 776 B10R1.30 CC1=C(CO)C=C(Br)C=C1 44861 [0,1,0,0,0,0|2,0,0]=3 777 B10R1.30 CC1=C(NN)C=C(F)C=C1 1087 [0,1,0,0,0,0|2,0,0]=3 778 B10R1.30 CC1=CC(C#N)=C(Br)C=C1 14563 [0,1,0,0,0,0|3,0,0]=4 779 B10R1.30 CC1=CC(C#N)=C(Cl)C=C1 14562 [0,1,0,0,0,0|3,0,0]=4 780 B10R1.30 CC1=CC(C#N)=C(F)C=C1 1552 [0,1,0,0,0,0|3,0,0]=4 781 B10R1.30 CC1=CC(C#N)=C(N)C=C1 17447 [0,1,0,0,0,0|3,0,0]=4 782 B10R1.30 CC1=CC(C#N)=C(O)C=C1 27632 [0,1,0,0,0,0|3,0,0]=4 783 B10R1.30 CC1=CC(C=O)=C(Br)C=C1 16748 [0,1,0,0,0,0|3,0,0]=4 784 B10R1.30 CC1=CC(C=O)=C(F)C=C1 1452 [0,1,0,0,0,0|3,0,0]=4 785 B10R1.30 CC1=CC(CBr)=C(C)C=C1 31376 [0,1,0,0,0,0|2,0,0]=3 786 B10R1.30 CC1=CC(CN)=C(C)C=C1 7405 [0,1,0,0,0,0|2,0,0]=3 787 B10R1.30 CC1=CC(NN)=C(C)C=C1 6400 [0,1,0,0,0,0|2,0,0]=3 788 B10R1.30 CC1=CC=C(Cl)N=C1C=O 26730 [0,1,0,0,0,0|3,0,0]=4 789 B10R1.30 CC1=CC=C(O)C(C=O)=C1 15680 [0,1,0,0,0,0|3,0,0]=4 790 B10R1.30 CCC1=C(Cl)C=CC(O)=C1 2213 [0,1,0,0,0,0|2,0,0]=3 791 B10R1.30 CCC1=C(F)C=CC(O)=C1 27790 [0,1,0,0,0,0|2,0,0]=3 792 B10R1.30 CCC1=C(I)C=CC(Br)=C1 3773 [0,1,0,0,0,0|2,0,0]=3 793 B10R1.30 CCC1=C(N)C=CC(Br)=C1 23174 [0,1,0,0,0,0|2,0,0]=3 794 B10R1.30 CCC1=C(N)C=CC(Br)=C1 3769 [0,1,0,0,0,0|2,0,0]=3 795 B10R1.30 CCC1=NC(C)=CC=C1O 35102 [0,1,0,0,0,0|3,0,0]=4 796 B10R1.30 CNC1=C(O)C=CC(N)=C1 20872 [0,1,0,0,0,0|2,0,0]=3 797 B10R1.30 CNC1=CC(Br)=CC=C1N 18337 [0,1,0,0,0,0|2,0,0]=3 798 B10R1.30 COC1=C(Br)C=CC(Br)=C1 5357 [0,1,0,0,0,0|1,0,0]=2 799 B10R1.30 COC1=C(Br)C=CC(C)=C1 4136 [0,1,0,0,0,0|1,0,0]=2 800 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 5265 [0,1,0,0,0,0|1,0,0]=2 801 B10R1.30 COC1=C(Br)C=CC(F)=C1 4091 [0,1,0,0,0,0|1,0,0]=2 802 B10R1.30 COC1=C(Br)C=CC(I)=C1 5333 [0,1,0,0,0,0|1,0,0]=2 803 B10R1.30 COC1=C(Br)C=CC(N)=C1 3794 [0,1,0,0,0,0|1,0,0]=2 804 B10R1.30 COC1=C(Br)C=CC(O)=C1 13260 [0,1,0,0,0,0|1,0,0]=2 805 B10R1.30 COC1=C(C)C=CC(Br)=C1 25292 [0,1,0,0,0,0|0,0,0]=1 806 B10R1.30 COC1=C(C)C=CC(C)=C1 5360 [0,1,0,0,0,0|0,0,0]=1 807 B10R1.30 COC1=C(C)C=CC(Cl)=C1 2667 [0,1,0,0,0,0|0,0,0]=1 808 B10R1.30 COC1=C(C)C=CC(F)=C1 2624 [0,1,0,0,0,0|0,0,0]=1 809 B10R1.30 COC1=C(C)C=CC(N)=C1 3329 [0,1,0,0,0,0|0,0,0]=1 810 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 2632 [0,1,0,0,0,0|1,0,0]=2 811 B10R1.30 COC1=C(Cl)C=CC(C)=C1 5299 [0,1,0,0,0,0|1,0,0]=2 812 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 3681 [0,1,0,0,0,0|1,0,0]=2 813 B10R1.30 COC1=C(Cl)C=CC(F)=C1 2659 [0,1,0,0,0,0|1,0,0]=2 814 B10R1.30 COC1=C(Cl)C=CC(I)=C1 5289 [0,1,0,0,0,0|1,0,0]=2 815 B10R1.30 COC1=C(Cl)C=CC(N)=C1 3659 [0,1,0,0,0,0|1,0,0]=2 816 B10R1.30 COC1=C(Cl)C=CC(O)=C1 28110 [0,1,0,0,0,0|1,0,0]=2 817 B10R1.30 COC1=C(Cl)N=CC(N)=C1 22114 [0,1,0,0,0,0|2,0,0]=3 818 B10R1.30 COC1=C(F)C=CC(Br)=C1 18513 [0,1,0,0,0,0|1,0,0]=2 819 B10R1.30 COC1=C(F)C=CC(C)=C1 8487 [0,1,0,0,0,0|1,0,0]=2 820 B10R1.30 COC1=C(F)C=CC(F)=C1 3456 [0,1,0,0,0,0|1,0,0]=2 821 B10R1.30 COC1=C(F)C=CC(N)=C1 14566 [0,1,0,0,0,0|1,0,0]=2 822 B10R1.30 COC1=C(F)C=CC(N)=C1 3022 [0,1,0,0,0,0|1,0,0]=2 823 B10R1.30 COC1=C(F)C=CC(O)=C1 14358 [0,1,0,0,0,0|1,0,0]=2 824 B10R1.30 COC1=C(I)C=CC(Br)=C1 28357 [0,1,0,0,0,0|1,0,0]=2 825 B10R1.30 COC1=C(I)C=CC(Cl)=C1 5293 [0,1,0,0,0,0|1,0,0]=2 826 B10R1.30 COC1=C(I)C=CC(I)=C1 28130 [0,1,0,0,0,0|1,0,0]=2 827 B10R1.30 COC1=C(I)C=CC(N)=C1 5352 [0,1,0,0,0,0|1,0,0]=2 828 B10R1.30 COC1=C(N)C=CC(Br)=C1 2258 [0,1,0,0,0,0|1,0,0]=2 829 B10R1.30 COC1=C(N)C=CC(F)=C1 28343 [0,1,0,0,0,0|1,0,0]=2 830 B10R1.30 COC1=C(N)C=CC(I)=C1 25591 [0,1,0,0,0,0|1,0,0]=2 831 B10R1.30 COC1=C(N)C=CC(O)=C1 18733 [0,1,0,0,0,0|1,0,0]=2 832 B10R1.30 COC1=C(N)C=CC(O)=C1 26950 [0,1,0,0,0,0|1,0,0]=2 833 B10R1.30 COC1=C(O)C=CC(Br)=C1 17271 [0,1,0,0,0,0|1,0,0]=2 834 B10R1.30 COC1=C(O)C=CC(Cl)=C1 3665 [0,1,0,0,0,0|1,0,0]=2 835 B10R1.30 COC1=C(O)C=CC(F)=C1 3880 [0,1,0,0,0,0|1,0,0]=2 836 B10R1.30 COC1=C(O)C=CC(I)=C1 17587 [0,1,0,0,0,0|1,0,0]=2 837 B10R1.30 COC1=C(O)C=CC(N)=C1 14144 [0,1,0,0,0,0|1,0,0]=2 838 B10R1.30 COC1=C(O)C=CC(N)=C1 33372 [0,1,0,0,0,0|1,0,0]=2 839 B10R1.30 COC1=CC(Br)=CN=C1Cl 35568 [0,1,0,0,0,0|2,0,0]=3 840 B10R1.30 COC1=CC(Br)=CN=C1I 26836 [0,1,0,0,0,0|2,0,0]=3 841 B10R1.30 COC1=CC(Cl)=CN=C1Br 5915 [0,1,0,0,0,0|2,0,0]=3 842 B10R1.30 COC1=CC(I)=CN=C1Br 28124 [0,1,0,0,0,0|2,0,0]=3 843 B10R1.30 COC1=CC(I)=CN=C1I 28122 [0,1,0,0,0,0|2,0,0]=3 844 B10R1.30 COC1=NC(Br)=CC=C1N 21956 [0,1,0,0,0,0|2,0,0]=3 845 B10R1.30 COC1=NC(Br)=CN=C1Br 27766 [0,1,0,0,0,0|3,0,0]=4 846 B10R1.30 COC1=NC(Br)=CN=C1N 23582 [0,1,0,0,0,0|3,0,0]=4 847 B10R1.30 COC1=NC(C)=CC=C1Br 8122 [0,1,0,0,0,0|2,0,0]=3 848 B10R1.30 COC1=NC(C)=CC=C1F 6585 [0,1,0,0,0,0|2,0,0]=3 849 B10R1.30 COC1=NC(C)=CC=C1N 1266 [0,1,0,0,0,0|2,0,0]=3 850 B10R1.30 COC1=NC(C)=NC=C1N 22765 [0,1,0,0,0,0|3,0,0]=4 851 B10R1.30 ClC1=C(CBr)C=C(I)C=C1 25801 [0,1,0,0,0,0|3,0,0]=4 852 B10R1.30 ClC1=CC(CBr)=C(Cl)C=C1 10208 [0,1,0,0,0,0|3,0,0]=4 853 B10R1.30 ClCC1=C(Cl)C=CC(Br)=C1 22498 [0,1,0,0,0,0|3,0,0]=4 854 B10R1.30 ClCC1=C(Cl)C=CC(I)=C1 27444 [0,1,0,0,0,0|3,0,0]=4 855 B10R1.30 FC1=C(CBr)C=C(Br)C=C1 25800 [0,1,0,0,0,0|3,0,0]=4 856 B10R1.30 FC1=C(CBr)C=C(Cl)C=C1 4899 [0,1,0,0,0,0|3,0,0]=4 857 B10R1.30 FC1=CC(CBr)=C(Br)C=C1 1953 [0,1,0,0,0,0|3,0,0]=4 858 B10R1.30 FC1=CC(CBr)=C(Cl)C=C1 7498 [0,1,0,0,0,0|3,0,0]=4 859 B10R1.30 FC1=CC(CBr)=C(F)C=C1 10213 [0,1,0,0,0,0|3,0,0]=4 860 B10R1.30 FC1=CC(CCl)=C(Br)C=C1 1952 [0,1,0,0,0,0|3,0,0]=4 861 B10R1.30 N#CC1=C(Br)C=CC(Cl)=C1 24744 [0,1,0,0,0,0|3,0,0]=4 862 B10R1.30 N#CC1=C(Br)C=CC(F)=C1 3218 [0,1,0,0,0,0|3,0,0]=4 863 B10R1.30 N#CC1=C(Br)C=CC(I)=C1 28721 [0,1,0,0,0,0|3,0,0]=4 864 B10R1.30 N#CC1=C(Br)C=CC(N)=C1 26438 [0,1,0,0,0,0|3,0,0]=4 865 B10R1.30 N#CC1=C(Br)C=CC(O)=C1 9770 [0,1,0,0,0,0|3,0,0]=4 866 B10R1.30 N#CC1=C(Cl)C=CC(Br)=C1 4695 [0,1,0,0,0,0|3,0,0]=4 867 B10R1.30 N#CC1=C(Cl)C=CC(Cl)=C1 3687 [0,1,0,0,0,0|3,0,0]=4 868 B10R1.30 N#CC1=C(Cl)C=CC(F)=C1 1558 [0,1,0,0,0,0|3,0,0]=4 869 B10R1.30 N#CC1=C(Cl)C=CC(I)=C1 1590 [0,1,0,0,0,0|3,0,0]=4 870 B10R1.30 N#CC1=C(Cl)C=CC(N)=C1 20454 [0,1,0,0,0,0|3,0,0]=4 871 B10R1.30 N#CC1=C(Cl)C=CC(O)=C1 28120 [0,1,0,0,0,0|3,0,0]=4 872 B10R1.30 N#CC1=C(F)C=CC(Br)=C1 1582 [0,1,0,0,0,0|3,0,0]=4 873 B10R1.30 N#CC1=C(F)C=CC(Cl)=C1 1581 [0,1,0,0,0,0|3,0,0]=4 874 B10R1.30 N#CC1=C(F)C=CC(F)=C1 4754 [0,1,0,0,0,0|3,0,0]=4 875 B10R1.30 N#CC1=C(F)C=CC(I)=C1 4779 [0,1,0,0,0,0|3,0,0]=4 876 B10R1.30 N#CC1=C(F)C=CC(N)=C1 2554 [0,1,0,0,0,0|3,0,0]=4 877 B10R1.30 N#CC1=C(F)C=CC(O)=C1 28108 [0,1,0,0,0,0|3,0,0]=4 878 B10R1.30 N#CC1=C(I)C=CC(Br)=C1 3790 [0,1,0,0,0,0|3,0,0]=4 879 B10R1.30 N#CC1=C(I)C=CC(F)=C1 24331 [0,1,0,0,0,0|3,0,0]=4 880 B10R1.30 N#CC1=C(N)C=CC(Br)=C1 4602 [0,1,0,0,0,0|3,0,0]=4 881 B10R1.30 N#CC1=C(N)C=CC(Cl)=C1 15691 [0,1,0,0,0,0|3,0,0]=4 882 B10R1.30 N#CC1=C(N)C=CC(F)=C1 4641 [0,1,0,0,0,0|3,0,0]=4 883 B10R1.30 N#CC1=C(N)C=CC(I)=C1 15845 [0,1,0,0,0,0|3,0,0]=4 884 B10R1.30 N#CC1=C(O)C=CC(Br)=C1 3782 [0,1,0,0,0,0|3,0,0]=4 885 B10R1.30 N#CC1=C(O)C=CC(Cl)=C1 33422 [0,1,0,0,0,0|3,0,0]=4 886 B10R1.30 N#CC1=C(O)C=CC(I)=C1 20368 [0,1,0,0,0,0|3,0,0]=4 887 B10R1.30 NC1=C(C=O)C=C(Br)C=C1 19693 [0,1,0,0,0,0|3,0,0]=4 888 B10R1.30 NC1=C(C=O)C=C(Cl)C=C1 16498 [0,1,0,0,0,0|3,0,0]=4 889 B10R1.30 NC1=C(C=O)C=C(Cl)C=C1 16499 [0,1,0,0,0,0|3,0,0]=4 890 B10R1.30 NC1=C(C=O)C=C(Cl)C=C1 7364 [0,1,0,0,0,0|3,0,0]=4 891 B10R1.30 NC1=C(CO)C=C(Cl)C=C1 24123 [0,1,0,0,0,0|3,0,0]=4 892 B10R1.30 NC1=CC(CO)=C(Cl)C=C1 28794 [0,1,0,0,0,0|3,0,0]=4 893 B10R1.30 NCC1=C(Br)C=CC(F)=C1 3225 [0,1,0,0,0,0|3,0,0]=4 894 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 23431 [0,1,0,0,0,0|3,0,0]=4 895 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 31261 [0,1,0,0,0,0|3,0,0]=4 896 B10R1.30 NCC1=C(Cl)C=CC(F)=C1 4371 [0,1,0,0,0,0|3,0,0]=4 897 B10R1.30 NCC1=C(F)C=CC(Br)=C1 3227 [0,1,0,0,0,0|3,0,0]=4 898 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 4378 [0,1,0,0,0,0|3,0,0]=4 899 B10R1.30 NCC1=C(F)C=CC(F)=C1 4401 [0,1,0,0,0,0|3,0,0]=4 900 B10R1.30 NCc1cc(Br)ccc1Br 31252 [0,1,0,0,0,0|3,0,0]=4 901 B10R1.30 NNC1=C(Cl)C=CC(Cl)=C1 7525 [0,1,0,0,0,0|3,0,0]=4 902 B10R1.30 NNC1=C(Cl)C=CC(F)=C1 28905 [0,1,0,0,0,0|3,0,0]=4 903 B10R1.30 NNC1=C(F)C=CC(Cl)=C1 4471 [0,1,0,0,0,0|3,0,0]=4 904 B10R1.30 NNC1=C(F)C=CC(F)=C1 1082 [0,1,0,0,0,0|3,0,0]=4 905 B10R1.30 NNC1=C(F)C=CC(F)=C1 2467 [0,1,0,0,0,0|3,0,0]=4 906 B10R1.30 O=CC1=C(Br)C=CC(Br)=C1 30882 [0,1,0,0,0,0|3,0,0]=4 907 B10R1.30 O=CC1=C(Br)C=CC(Cl)=C1 19849 [0,1,0,0,0,0|3,0,0]=4 908 B10R1.30 O=CC1=C(Br)C=CC(F)=C1 1418 [0,1,0,0,0,0|3,0,0]=4 909 B10R1.30 O=CC1=C(Br)C=CC(I)=C1 30930 [0,1,0,0,0,0|3,0,0]=4 910 B10R1.30 O=CC1=C(Br)C=CC(O)=C1 14430 [0,1,0,0,0,0|3,0,0]=4 911 B10R1.30 O=CC1=C(Cl)C=CC(Br)=C1 10373 [0,1,0,0,0,0|3,0,0]=4 912 B10R1.30 O=CC1=C(Cl)C=CC(Cl)=C1 3081 [0,1,0,0,0,0|3,0,0]=4 913 B10R1.30 O=CC1=C(Cl)C=CC(F)=C1 1410 [0,1,0,0,0,0|3,0,0]=4 914 B10R1.30 O=CC1=C(Cl)C=CC(O)=C1 30918 [0,1,0,0,0,0|3,0,0]=4 915 B10R1.30 O=CC1=C(F)C=CC(Br)=C1 2879 [0,1,0,0,0,0|3,0,0]=4 916 B10R1.30 O=CC1=C(F)C=CC(Cl)=C1 1411 [0,1,0,0,0,0|3,0,0]=4 917 B10R1.30 O=CC1=C(F)C=CC(F)=C1 1437 [0,1,0,0,0,0|3,0,0]=4 918 B10R1.30 O=CC1=C(F)C=CC(I)=C1 4222 [0,1,0,0,0,0|3,0,0]=4 919 B10R1.30 O=CC1=C(F)C=CC(O)=C1 16486 [0,1,0,0,0,0|3,0,0]=4 920 B10R1.30 O=CC1=C(I)C=CC(Br)=C1 17023 [0,1,0,0,0,0|3,0,0]=4 921 B10R1.30 O=CC1=C(I)C=CC(Cl)=C1 22997 [0,1,0,0,0,0|3,0,0]=4 922 B10R1.30 O=CC1=C(I)C=CC(F)=C1 1441 [0,1,0,0,0,0|3,0,0]=4 923 B10R1.30 O=CC1=C(O)C=CC(Br)=C1 3779 [0,1,0,0,0,0|3,0,0]=4 924 B10R1.30 O=CC1=C(O)C=CC(F)=C1 1444 [0,1,0,0,0,0|3,0,0]=4 925 B10R1.30 O=CC1=C(O)C=CC(I)=C1 22695 [0,1,0,0,0,0|3,0,0]=4 926 B10R1.30 O=CC1=C(O)C=CC(O)=C1 2285 [0,1,0,0,0,0|3,0,0]=4 927 B10R1.30 O=CC1=CC(Cl)=CC=C1O 8203 [0,1,0,0,0,0|3,0,0]=4 928 B10R1.30 OCC1=C(Br)C=CC(F)=C1 1963 [0,1,0,0,0,0|3,0,0]=4 929 B10R1.30 OCC1=C(Br)C=CC(I)=C1 27439 [0,1,0,0,0,0|3,0,0]=4 930 B10R1.30 OCC1=C(Cl)C=CC(Br)=C1 4881 [0,1,0,0,0,0|3,0,0]=4 931 B10R1.30 OCC1=C(F)C=CC(Br)=C1 3224 [0,1,0,0,0,0|3,0,0]=4 932 B10R1.30 OCC1=C(F)C=CC(F)=C1 4913 [0,1,0,0,0,0|3,0,0]=4 933 B10R1.30 OCC1=C(I)C=CC(Br)=C1 31316 [0,1,0,0,0,0|3,0,0]=4 934 B10R1.30 OCC1=C(S)C=CC(F)=C1 19636 [0,1,0,0,0,0|3,0,0]=4 935 B10R1.30 OCC1=CC(Br)=CC=C1O 22564 [0,1,0,0,0,0|3,0,0]=4 936 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 3086 [0,1,0,0,0,0|2,0,0]=3 937 B10R1.61 CC(=O)C1=C(C)C=CC=C1 3090 [0,1,0,0,0,0|1,0,0]=2 938 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 3084 [0,1,0,0,0,0|2,0,0]=3 939 B10R1.61 CC(=O)C1=C(F)C=CC=C1 22574 [0,1,0,0,0,0|2,0,0]=3 940 B10R1.61 CC(=O)C1=C(F)C=NC=C1 33787 [0,1,0,0,0,0|3,0,0]=4 941 B10R1.61 CC(=O)C1=C(I)C=CC=C1 3893 [0,1,0,0,0,0|2,0,0]=3 942 B10R1.61 CC(=O)C1=C(O)C=CC=C1 23010 [0,1,0,0,0,0|2,0,0]=3 943 B10R1.61 CC(=O)C1=CC=CN=C1Cl 14410 [0,1,0,0,0,0|3,0,0]=4 944 B10R1.61 CC(=O)C1=CC=CN=C1F 5049 [0,1,0,0,0,0|3,0,0]=4 945 B10R1.61 CC(=O)C1=CC=CN=C1N 18534 [0,1,0,0,0,0|3,0,0]=4 946 B10R1.61 CC(=O)C1=CC=CNC1=O 23936 [0,1,0,0,0,0|3,0,0]=4 947 B10R1.61 CC(=O)C1=NC=CC=C1Cl 34385 [0,1,0,0,0,0|3,0,0]=4 948 B10R1.61 CC(=O)C1=NC=CC=C1F 1300 [0,1,0,0,0,0|3,0,0]=4 949 B10R1.61 CC(=O)C1=NC=CC=C1N 17729 [0,1,0,0,0,0|3,0,0]=4 950 B10R1.61 CC(=O)C1=NC=CN=C1C 8616 [0,1,0,0,0,0|3,0,0]=4 951 B10R1.61 CC(C)C1=C(Br)C=CC=C1 16461 [0,1,0,0,0,0|2,0,0]=3 952 B10R1.61 CC(C)C1=C(Cl)C=NC=C1 6618 [0,1,0,0,0,0|3,0,0]=4 953 B10R1.61 CC(C)C1=C(I)C=CC=C1 12584 [0,1,0,0,0,0|2,0,0]=3 954 B10R1.61 CC(C)C1=C(O)C=CN=C1 35264 [0,1,0,0,0,0|3,0,0]=4 955 B10R1.61 CC(C)C1=C(S)C=CC=C1 6880 [0,1,0,0,0,0|2,0,0]=3 956 B10R1.61 CC(C)C1=CC=CN=C1Cl 6145 [0,1,0,0,0,0|3,0,0]=4 957 B10R1.61 CC(C)C1=NC=CC=C1Br 32481 [0,1,0,0,0,0|3,0,0]=4 958 B10R1.61 CC1=C(B(O)O)C=CC=C1 1871 [0,1,0,0,0,0|2,0,0]=3 959 B10R1.61 CC1=C(B(O)O)C=CN=C1 9664 [0,1,0,0,0,0|3,0,0]=4 960 B10R1.61 CC1=C(B(O)O)C=NC=C1 17083 [0,1,0,0,0,0|3,0,0]=4 961 B10R1.61 CC1=C(C(=O)O)C=CC=N1 2458 [0,1,0,0,0,0|3,0,0]=4 962 B10R1.61 CC1=C(C(=O)O)C=CN=C1 19851 [0,1,0,0,0,0|3,0,0]=4 963 B10R1.61 CC1=C(C(=O)O)C=NC=C1 16270 [0,1,0,0,0,0|3,0,0]=4 964 B10R1.61 CC1=C(C(Cl)Cl)C=CC=C1 10210 [0,1,0,0,0,0|2,0,0]=3 965 B10R1.61 CC1=C(C(O)=S)C=CC=C1 10795 [0,1,0,0,0,0|2,0,0]=3 966 B10R1.61 CC1=C([N+](=O)[O-])C=CN=C1 6642 [0,1,0,0,0,0|3,0,0]=4 967 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 6644 [0,1,0,0,0,0|3,0,0]=4 968 B10R1.61 CC1=CC=CC=C1C(=O)Cl 15451 [0,1,0,0,0,0|2,0,0]=3 969 B10R1.61 CC1=CC=CC=C1C(=O)O 15431 [0,1,0,0,0,0|2,0,0]=3 970 B10R1.61 CC1=CC=CN=C1B(O)O 17385 [0,1,0,0,0,0|3,0,0]=4 971 B10R1.61 CC1=CC=CN=C1C(=O)O 14396 [0,1,0,0,0,0|3,0,0]=4 972 B10R1.61 CC1=CC=CN=C1C(=O)O 17659 [0,1,0,0,0,0|3,0,0]=4 973 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] 6641 [0,1,0,0,0,0|3,0,0]=4 974 B10R1.61 CC1=NC=CC=C1B(O)O 17080 [0,1,0,0,0,0|3,0,0]=4 975 B10R1.61 CC1=NC=CC=C1C(N)=O 22966 [0,1,0,0,0,0|3,0,0]=4 976 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] 6643 [0,1,0,0,0,0|3,0,0]=4 977 B10R1.61 CC1=NC=CN=C1C(C)C 24268 [0,1,0,0,0,0|3,0,0]=4 978 B10R1.61 CN(C)C1=C(Br)C=CC=C1 3759 [0,1,0,0,0,0|2,0,0]=3 979 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 5269 [0,1,0,0,0,0|2,0,0]=3 980 B10R1.61 CN(C)C1=C(F)C=CC=C1 5243 [0,1,0,0,0,0|2,0,0]=3 981 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 24734 [0,1,0,0,0,0|2,0,0]=3 982 B10R1.61 C[C@@H](N)C1=C(O)C=CC=C1 23367 [0,1,0,0,0,0|2,0,0]=3 983 B10R1.61 C[C@@H](O)C1=C(Br)C=CC=C1 5686 [0,1,0,0,0,0|2,0,0]=3 984 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 3980 [0,1,0,0,0,0|2,0,0]=3 985 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 24769 [0,1,0,0,0,0|2,0,0]=3 986 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 24731 [0,1,0,0,0,0|2,0,0]=3 987 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 15728 [0,1,0,0,0,0|2,0,0]=3 988 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 5682 [0,1,0,0,0,0|2,0,0]=3 989 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 5670 [0,1,0,0,0,0|2,0,0]=3 990 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 24768 [0,1,0,0,0,0|2,0,0]=3 991 B10R1.61 IC1=C(N(I)I)C=CC=C1 19658 [0,1,0,0,0,0|3,0,0]=4 992 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 3733 [0,1,0,0,0,0|3,0,0]=4 993 B10R1.61 NC(=O)C1=C(Cl)C=CC=C1 3617 [0,1,0,0,0,0|3,0,0]=4 994 B10R1.61 NC(=O)C1=C(F)C=CC=C1 3405 [0,1,0,0,0,0|3,0,0]=4 995 B10R1.61 NC(=O)C1=C(I)C=CC=C1 3299 [0,1,0,0,0,0|3,0,0]=4 996 B10R1.61 NC(=O)C1=CC=CC=C1N 13631 [0,1,0,0,0,0|3,0,0]=4 997 B10R1.61 NC(=O)C1=CC=CC=C1O 10992 [0,1,0,0,0,0|3,0,0]=4 998 B10R1.61 NC1=C(B(O)O)C=CC=C1 1746 [0,1,0,0,0,0|3,0,0]=4 999 B10R1.61 NC1=C(B(O)O)C=CC=C1 9885 [0,1,0,0,0,0|3,0,0]=4 1000 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 12510 [0,1,0,0,0,0|3,0,0]=4 1001 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 15054 [0,1,0,0,0,0|3,0,0]=4 1002 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 3739 [0,1,0,0,0,0|3,0,0]=4 1003 B10R1.61 O=C(O)C1=C(F)C=CC=C1 9650 [0,1,0,0,0,0|3,0,0]=4 1004 B10R1.61 O=C(O)C1=C(I)C=CC=C1 3924 [0,1,0,0,0,0|3,0,0]=4 1005 B10R1.61 O=C(O)C1=CC=CC=C1S 6841 [0,1,0,0,0,0|3,0,0]=4 1006 B10R1.61 O=C([O-])C1=C(F)C=CC=C1 2270 [0,1,0,0,0,0|3,0,0]=4 1007 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 3819 [0,1,0,0,0,0|3,0,0]=4 1008 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 2063 [0,1,0,0,0,0|3,0,0]=4 1009 B10R1.61 O=[N+]([O-])C1=C(I)C=CC=C1 3952 [0,1,0,0,0,0|3,0,0]=4 1010 B10R1.61 O=[N+]([O-])c1ccccc1Cl 18481 [0,1,0,0,0,0|3,0,0]=4 1011 B10R1.61 O=[N+]([O-])c1ccccc1F 28476 [0,1,0,0,0,0|3,0,0]=4 1012 B10R1.61 OB(O)C1=C(Br)C=CC=C1 13095 [0,1,0,0,0,0|3,0,0]=4 1013 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 1797 [0,1,0,0,0,0|3,0,0]=4 1014 B10R1.61 OB(O)C1=C(F)C=CC=C1 1856 [0,1,0,0,0,0|3,0,0]=4 1015 B10R1.61 OB(O)C1=C(I)C=CC=C1 34200 [0,1,0,0,0,0|3,0,0]=4 1016 B10R1.61 OB(O)C1=C(O)C=CC=C1 9522 [0,1,0,0,0,0|3,0,0]=4 1017 B10R1.245 C=CC1=C(F)C=CC=C1F 25426 [0,1,0,0,0,0|2,0,1]=4 1018 B10R1.245 CC1=C(C#N)C(Br)=NC=C1 9331 [0,1,0,0,0,0|3,0,0]=4 1019 B10R1.245 CC1=C(C#N)C(Cl)=NC=C1 9332 [0,1,0,0,0,0|3,0,0]=4 1020 B10R1.245 CC1=C(C#N)C(N)=NC=C1 5563 [0,1,0,0,0,0|3,0,0]=4 1021 B10R1.245 CC1=C(C#N)C(O)=NC=C1 9328 [0,1,0,0,0,0|3,0,0]=4 1022 B10R1.245 CC1=C(C=O)C(O)=CC=C1 22141 [0,1,0,0,0,0|2,0,0]=3 1023 B10R1.245 CC1=CC=CC(Br)=C1C#N 22122 [0,1,0,0,0,0|2,0,0]=3 1024 B10R1.245 CC1=CC=CC(C)=C1C=O 28414 [0,1,0,0,0,0|2,0,0]=3 1025 B10R1.245 CC1=CC=CC(C)=C1CBr 31264 [0,1,0,0,0,0|2,0,0]=3 1026 B10R1.245 CC1=CC=CC(C)=C1CCl 16611 [0,1,0,0,0,0|2,0,0]=3 1027 B10R1.245 CC1=CC=CC(C)=C1CN 7406 [0,1,0,0,0,0|2,0,0]=3 1028 B10R1.245 CC1=CC=CC(Cl)=C1C#N 23832 [0,1,0,0,0,0|2,0,0]=3 1029 B10R1.245 CC1=CC=CC(Cl)=C1C=O 19866 [0,1,0,0,0,0|2,0,0]=3 1030 B10R1.245 CC1=CC=CC(F)=C1C#N 4790 [0,1,0,0,0,0|2,0,0]=3 1031 B10R1.245 CC1=CC=CC(F)=C1C=O 10067 [0,1,0,0,0,0|2,0,0]=3 1032 B10R1.245 CC1=CC=CC(N)=C1C#N 20160 [0,1,0,0,0,0|2,0,0]=3 1033 B10R1.245 CC1=CC=CC(O)=C1C#N 30777 [0,1,0,0,0,0|2,0,0]=3 1034 B10R1.245 CC1=CC=NC(Cl)=C1C=O 34386 [0,1,0,0,0,0|3,0,0]=4 1035 B10R1.245 CCC1=C(O)C=CC=C1N 28129 [0,1,0,0,0,0|2,0,0]=3 1036 B10R1.245 CNC1=C(F)C=CC=C1F 34785 [0,1,0,0,0,0|2,0,0]=3 1037 B10R1.245 COC1=C(Br)C=CC=C1Br 4108 [0,1,0,0,0,0|1,0,0]=2 1038 B10R1.245 COC1=C(Br)C=CC=C1F 4126 [0,1,0,0,0,0|1,0,0]=2 1039 B10R1.245 COC1=C(C)C=CC=C1C 4115 [0,1,0,0,0,0|0,0,0]=1 1040 B10R1.245 COC1=C(C)NC=CC1=O 36249 [0,1,0,0,0,0|1,0,0]=2 1041 B10R1.245 COC1=C(Cl)C=CC=C1C 5300 [0,1,0,0,0,0|0,0,0]=1 1042 B10R1.245 COC1=C(Cl)C=CC=C1Cl 3682 [0,1,0,0,0,0|1,0,0]=2 1043 B10R1.245 COC1=C(Cl)C=CC=C1F 20256 [0,1,0,0,0,0|1,0,0]=2 1044 B10R1.245 COC1=C(Cl)N=CN=C1Cl 7077 [0,1,0,0,0,0|3,0,0]=4 1045 B10R1.245 COC1=C(Cl)N=CN=C1N 21486 [0,1,0,0,0,0|3,0,0]=4 1046 B10R1.245 COC1=C(F)C=CC=C1F 1968 [0,1,0,0,0,0|1,0,0]=2 1047 B10R1.245 COC1=C(F)C=CC=C1I 3054 [0,1,0,0,0,0|1,0,0]=2 1048 B10R1.245 COC1=C(I)C=CN=C1Br 26876 [0,1,0,0,0,0|2,0,0]=3 1049 B10R1.245 COC1=C(N)C=CC=C1Br 17787 [0,1,0,0,0,0|1,0,0]=2 1050 B10R1.245 COC1=C(N)C=CC=C1Cl 31013 [0,1,0,0,0,0|1,0,0]=2 1051 B10R1.245 COC1=C(N)C=CC=C1F 3021 [0,1,0,0,0,0|1,0,0]=2 1052 B10R1.245 COC1=C(O)C=CC=C1Br 28106 [0,1,0,0,0,0|1,0,0]=2 1053 B10R1.245 COC1=C(O)C=CC=C1Cl 27362 [0,1,0,0,0,0|1,0,0]=2 1054 B10R1.245 COC1=C(O)C=CC=C1F 33437 [0,1,0,0,0,0|1,0,0]=2 1055 B10R1.245 COC1=C(O)C=CN=C1Br 27180 [0,1,0,0,0,0|2,0,0]=3 1056 B10R1.245 COC1=C(O)N=CN=C1O 7100 [0,1,0,0,0,0|3,0,0]=4 1057 B10R1.245 CSC1=C(O)C=CC=C1Br 27603 [0,1,0,0,0,0|1,1,0]=3 1058 B10R1.245 Cc1cccc(Br)c1CBr 31341 [0,1,0,0,0,0|2,0,0]=3 1059 B10R1.245 ClCC1=C(Cl)C=CC=C1Cl 17522 [0,1,0,0,0,0|3,0,0]=4 1060 B10R1.245 FC1=CC=CC(Br)=C1CBr 31302 [0,1,0,0,0,0|3,0,0]=4 1061 B10R1.245 FC1=CC=CC(Cl)=C1CBr 4894 [0,1,0,0,0,0|3,0,0]=4 1062 B10R1.245 FC1=CC=CC(Cl)=C1CCl 7497 [0,1,0,0,0,0|3,0,0]=4 1063 B10R1.245 FC1=CC=CC(F)=C1CBr 4915 [0,1,0,0,0,0|3,0,0]=4 1064 B10R1.245 FC1=CC=CC(F)=C1CCl 2178 [0,1,0,0,0,0|3,0,0]=4 1065 B10R1.245 N#CC1=C(Br)C=CC=C1Cl 28713 [0,1,0,0,0,0|3,0,0]=4 1066 B10R1.245 N#CC1=C(Br)C=CC=C1Cl 30768 [0,1,0,0,0,0|3,0,0]=4 1067 B10R1.245 N#CC1=C(Br)C=CC=C1F 2221 [0,1,0,0,0,0|3,0,0]=4 1068 B10R1.245 N#CC1=C(Br)C=CC=C1I 30769 [0,1,0,0,0,0|3,0,0]=4 1069 B10R1.245 N#CC1=C(Br)C=CC=C1O 28720 [0,1,0,0,0,0|3,0,0]=4 1070 B10R1.245 N#CC1=C(Cl)C=CC=C1F 3423 [0,1,0,0,0,0|3,0,0]=4 1071 B10R1.245 N#CC1=C(Cl)C=CC=C1I 1589 [0,1,0,0,0,0|3,0,0]=4 1072 B10R1.245 N#CC1=C(Cl)C=CC=C1O 25376 [0,1,0,0,0,0|3,0,0]=4 1073 B10R1.245 N#CC1=C(F)C=CC=C1F 8865 [0,1,0,0,0,0|3,0,0]=4 1074 B10R1.245 N#CC1=C(F)C=CC=C1I 4780 [0,1,0,0,0,0|3,0,0]=4 1075 B10R1.245 N#CC1=C(F)C=CC=C1O 2223 [0,1,0,0,0,0|3,0,0]=4 1076 B10R1.245 N#CC1=C(N)C=CC=C1Br 12005 [0,1,0,0,0,0|3,0,0]=4 1077 B10R1.245 N#CC1=C(N)C=CC=C1Cl 4614 [0,1,0,0,0,0|3,0,0]=4 1078 B10R1.245 N#CC1=C(N)C=CC=C1F 4644 [0,1,0,0,0,0|3,0,0]=4 1079 B10R1.245 NCC1=C(Cl)C=CC=C1Cl 15690 [0,1,0,0,0,0|3,0,0]=4 1080 B10R1.245 NCC1=C(Cl)C=CC=C1F 19391 [0,1,0,0,0,0|3,0,0]=4 1081 B10R1.245 NCC1=C(F)C=CC=C1F 2235 [0,1,0,0,0,0|3,0,0]=4 1082 B10R1.245 NCC1=C(N)C=CC=C1F 4705 [0,1,0,0,0,0|3,0,0]=4 1083 B10R1.245 NNC1=C(Cl)C=CC=C1F 3509 [0,1,0,0,0,0|3,0,0]=4 1084 B10R1.245 NNC1=C(F)C=CC=C1F 1083 [0,1,0,0,0,0|3,0,0]=4 1085 B10R1.245 NNc1c(F)cccc1F 28907 [0,1,0,0,0,0|3,0,0]=4 1086 B10R1.245 O=CC1=C(Br)C=CC=C1Cl 27373 [0,1,0,0,0,0|3,0,0]=4 1087 B10R1.245 O=CC1=C(Br)C=CC=C1F 1419 [0,1,0,0,0,0|3,0,0]=4 1088 B10R1.245 O=CC1=C(Br)C=CC=C1O 17006 [0,1,0,0,0,0|3,0,0]=4 1089 B10R1.245 O=CC1=C(Cl)C=CC=C1Cl 8225 [0,1,0,0,0,0|3,0,0]=4 1090 B10R1.245 O=CC1=C(Cl)C=CC=C1F 1434 [0,1,0,0,0,0|3,0,0]=4 1091 B10R1.245 O=CC1=C(Cl)C=CC=C1O 17008 [0,1,0,0,0,0|3,0,0]=4 1092 B10R1.245 O=CC1=C(F)C=CC=C1F 1438 [0,1,0,0,0,0|3,0,0]=4 1093 B10R1.245 O=CC1=C(F)C=CC=C1O 8482 [0,1,0,0,0,0|3,0,0]=4 1094 B10R1.245 O=CC1=C(I)C=CC=C1Cl 22998 [0,1,0,0,0,0|3,0,0]=4 1095 B10R1.245 O=CC1=C(I)C=CC=C1F 1445 [0,1,0,0,0,0|3,0,0]=4 1096 B10R1.245 O=CC1=C(O)C=CC=C1I 30989 [0,1,0,0,0,0|3,0,0]=4 1097 B10R1.245 OCC1=C(Cl)C=CC=C1Cl 14857 [0,1,0,0,0,0|3,0,0]=4 1098 B10R1.245 OCC1=C(Cl)C=CC=C1F 3427 [0,1,0,0,0,0|3,0,0]=4 1099 B10R1.245 OCC1=C(F)C=CC=C1F 4914 [0,1,0,0,0,0|3,0,0]=4 1100 B10R1.245 OCC1=C(F)C=CC=C1I 27470 [0,1,0,0,0,0|3,0,0]=4 1101 B10R2.7 B1OC2=C(C=CC=C2)O1 18191 [0,0,0,1,0,0|2,0,0]=3 1102 B10R2.7 C1=CC2=C(C=C1)NC=N2 11074 [0,0,0,1,0,0|2,0,1]=4 1103 B10R2.7 C1=CC2=C(C=C1)NN=N2 16004 [0,0,0,1,0,0|3,0,0]=4 1104 B10R2.7 C1=CC2=C(C=C1)OC=C2 7003 [0,0,0,1,0,0|0,0,2]=3 1105 B10R2.7 C1=CC2=C(C=C1)OC=N2 21884 [0,0,0,1,0,0|1,0,1]=3 1106 B10R2.7 C1=CC2=C(C=C1)OCC2 6931 [0,0,0,1,0,0|0,0,0]=1 1107 B10R2.7 C1=CC2=C(C=C1)OCO2 2537 [0,0,0,1,0,0|1,0,0]=2 1108 B10R2.7 C1=CC2=C(C=C1)SC=C2 13545 [0,0,0,1,0,0|0,1,2]=4 1109 B10R2.7 C1=CC2=C(C=N1)CNC2 17767 [0,0,0,1,0,0|3,0,0]=4 1110 B10R2.7 C1=CC2=C(C=N1)CNC2 19108 [0,0,0,1,0,0|3,0,0]=4 1111 B10R2.7 C1=CC2=NON=C2C=C1 22999 [0,0,0,1,0,0|3,0,0]=4 1112 B10R2.7 C1=CC2=NSN=C2C=C1 15689 [0,0,0,1,0,0|3,0,0]=4 1113 B10R2.7 C1=CC=C2CC=CC2=C1 20728 [0,0,0,1,0,0|1,0,1]=3 1114 B10R2.7 C1=CC=C2CCCC2=C1 20379 [0,0,0,1,0,0|1,0,0]=2 1115 B10R2.7 C1=CC=C2CNCC2=C1 16248 [0,0,0,1,0,0|2,0,0]=3 1116 B10R2.7 C1=CC=C2CNCC2=C1 16512 [0,0,0,1,0,0|2,0,0]=3 1117 B10R2.7 C1=CC=C2CNCC2=C1 33470 [0,0,0,1,0,0|2,0,0]=3 1118 B10R2.7 C1=CC=C2NCCC2=C1 7502 [0,0,0,1,0,0|1,0,0]=2 1119 B10R2.7 C1=CC=C2NN=CC2=C1 15665 [0,0,0,1,0,0|2,0,1]=4 1120 B10R2.7 C1=CN=C2CCCC2=C1 15900 [0,0,0,1,0,0|2,0,0]=3 1121 B10R2.7 C1=CN=C2CNCC2=C1 11371 [0,0,0,1,0,0|3,0,0]=4 1122 B10R2.7 C1=CN=C2CNCC2=C1 18111 [0,0,0,1,0,0|3,0,0]=4 1123 B10R2.7 C1=CN=C2NCCC2=C1 18022 [0,0,0,1,0,0|2,0,0]=3 1124 B10R2.7 C1=NC=C2NCCC2=C1 18023 [0,0,0,1,0,0|2,0,0]=3 1125 B10R2.320 BrC1CC2=CC=CC=C21 36330 [0,0,0,1,0,0|2,0,0]=3 1126 B8R1.11 CC1=C(C=O)SC=C1 5183 [0,0,0,0,1,0|3,0,0]=4 1127 B8R1.11 CC1=C(C=O)SC=C1 9495 [0,0,0,0,1,0|3,0,0]=4 1128 B8R1.11 CN1C=CC=C1C=O 9617 [0,0,0,0,1,0|3,0,0]=4 1129 B8R1.11 CSC1=NC=CN1C 31662 [0,0,0,0,1,0|2,1,0]=4 1130 B7R1.3 BrC1=CC=CN=C1 2571 [2,0,0,0,0,0|2,0,0]=4 1131 B7R1.3 BrC1=CC=NC=C1 15950 [2,0,0,0,0,0|2,0,0]=4 1132 B7R1.3 BrC1=CC=NC=C1 2589 [2,0,0,0,0,0|2,0,0]=4 1133 B7R1.3 BrC1=NC=CC=C1 2570 [2,0,0,0,0,0|2,0,0]=4 1134 B7R1.3 CC1=CC=CN=N1 17696 [2,0,0,0,0,0|2,0,0]=4 1135 B7R1.3 CC1=CN=CN=C1 7207 [2,0,0,0,0,0|2,0,0]=4 1136 B7R1.3 CC1=NC=CC=C1 15899 [2,0,0,0,0,0|1,0,0]=3 1137 B7R1.3 CC1=NC=CC=N1 21974 [2,0,0,0,0,0|2,0,0]=4 1138 B7R1.3 CC1=NC=CN=C1 8601 [2,0,0,0,0,0|2,0,0]=4 1139 B7R1.3 CC1=NC=NC=C1 20803 [2,0,0,0,0,0|2,0,0]=4 1140 B7R1.3 Cc1ccccn1 18185 [2,0,0,0,0,0|1,0,0]=3 1141 B7R1.3 ClC1=CC=CN=C1 2576 [2,0,0,0,0,0|2,0,0]=4 1142 B7R1.3 ClC1=CC=NC=C1 1195 [2,0,0,0,0,0|2,0,0]=4 1143 B7R1.3 ClC1=CC=NC=C1 23503 [2,0,0,0,0,0|2,0,0]=4 1144 B7R1.3 ClC1=NC=CC=C1 13200 [2,0,0,0,0,0|2,0,0]=4 1145 B7R1.3 FC1=CC=CC=C1 29401 [2,0,0,0,0,0|1,0,0]=3 1146 B7R1.3 FC1=CC=CN=C1 1095 [2,0,0,0,0,0|2,0,0]=4 1147 B7R1.3 FC1=CC=NC=C1 14322 [2,0,0,0,0,0|2,0,0]=4 1148 B7R1.3 FC1=CC=NC=C1 2616 [2,0,0,0,0,0|2,0,0]=4 1149 B7R1.3 FC1=NC=CC=C1 1094 [2,0,0,0,0,0|2,0,0]=4 1150 B7R1.3 IC1=CC=CC=C1 2143 [2,0,0,0,0,0|1,0,0]=3 1151 B7R1.3 IC1=CC=CC=C1 3921 [2,0,0,0,0,0|1,0,0]=3 1152 B7R1.3 IC1=CC=CN=C1 6634 [2,0,0,0,0,0|2,0,0]=4 1153 B7R1.3 IC1=CC=NC=C1 2584 [2,0,0,0,0,0|2,0,0]=4 1154 B7R1.3 IC1=NC=CC=C1 4074 [2,0,0,0,0,0|2,0,0]=4 1155 B7R1.3 NC1=CC=CN=C1 2569 [2,0,0,0,0,0|2,0,0]=4 1156 B7R1.3 NC1=CC=NC=C1 1281 [2,0,0,0,0,0|2,0,0]=4 1157 B7R1.3 NC1=NC=CC=C1 10484 [2,0,0,0,0,0|2,0,0]=4 1158 B7R1.3 OC1=CC=CN=C1 2568 [2,0,0,0,0,0|1,0,0]=3 1159 B7R1.3 OC1=CC=NC=C1 1116 [2,0,0,0,0,0|1,0,0]=3 1160 B7R1.3 OC1=CN=CN=C1 20799 [2,0,0,0,0,0|2,0,0]=4 1161 B7R1.3 OC1=C[NH+]=CN=C1 23934 [2,0,0,0,0,0|2,0,0]=4 1162 B7R1.3 OC1=NC=CC=C1 2567 [2,0,0,0,0,0|1,0,0]=3 1163 B7R1.3 OC1=NC=CC=N1 20310 [2,0,0,0,0,0|2,0,0]=4 1164 B7R1.3 OC1=NC=CC=N1 21046 [2,0,0,0,0,0|2,0,0]=4 1165 B7R1.3 OC1=NC=CN=C1 8869 [2,0,0,0,0,0|2,0,0]=4 1166 B7R1.3 OC1=NC=NC=C1 11012 [2,0,0,0,0,0|2,0,0]=4 1167 B7R1.3 OC1=NC=NC=C1 20805 [2,0,0,0,0,0|2,0,0]=4 1168 B7R1.3 PC1=CC=CC=C1 25514 [2,0,0,0,0,0|1,0,0]=3 1169 B7R1.3 SC1=CC=CC=C1 5421 [2,0,0,0,0,0|0,1,0]=3 1170 B7R1.3 SC1=CC=NC=C1 9746 [2,0,0,0,0,0|1,1,0]=4 1171 B7R1.3 SC1=NC=CC=C1 10835 [2,0,0,0,0,0|1,1,0]=4 1172 B7R1.3 SC1=NC=CC=C1 16329 [2,0,0,0,0,0|1,1,0]=4 1173 B7R1.3 [Li]C1=CC=CC=C1 26659 [2,0,0,0,0,0|1,0,0]=3 1174 B7R1.3 [O-][N+]1=CC=CC=C1 2586 [2,0,0,0,0,0|1,0,1]=4 1175 B7R1.3 [S-]C1=CC=CC=C1 35336 [2,0,0,0,0,0|0,1,0]=3 1176 B7R1.3 [SiH3]C1=CC=CC=C1 25896 [2,0,0,0,0,0|0,1,0]=3 1177 B9R1.1 BrCC1=CC=C(Br)C=C1 7460 [1,1,0,0,0,0|2,0,0]=4 1178 B9R1.1 BrCC1=CC=C(I)C=C1 3557 [1,1,0,0,0,0|2,0,0]=4 1179 B9R1.1 C#CC1=CC=C(C)C=C1 10922 [1,1,0,0,0,0|1,0,1]=4 1180 B9R1.1 C#CC1=CC=C(F)C=C1 16719 [1,1,0,0,0,0|1,0,1]=4 1181 B9R1.1 C#CC1=CC=C(I)C=C1 34237 [1,1,0,0,0,0|1,0,1]=4 1182 B9R1.1 C#CC1=CC=C(N)C=C1 26130 [1,1,0,0,0,0|1,0,1]=4 1183 B9R1.1 C=CC1=CC=C(Cl)C=C1 12659 [1,1,0,0,0,0|1,0,1]=4 1184 B9R1.1 C=CC1=CC=C(N)C=C1 12625 [1,1,0,0,0,0|1,0,1]=4 1185 B9R1.1 CC1=CC=C(C#N)C=C1 8168 [1,1,0,0,0,0|2,0,0]=4 1186 B9R1.1 CC1=CC=C(C=O)C=C1 15497 [1,1,0,0,0,0|2,0,0]=4 1187 B9R1.1 CC1=CC=C(CN)C=C1 10199 [1,1,0,0,0,0|2,0,0]=4 1188 B9R1.1 CC1=CC=C(NN)C=C1 4500 [1,1,0,0,0,0|2,0,0]=4 1189 B9R1.1 CCC1=CC=C(Br)C=C1 3772 [1,1,0,0,0,0|1,0,0]=3 1190 B9R1.1 CCC1=CC=C(C)C=C1 21843 [1,1,0,0,0,0|1,0,0]=3 1191 B9R1.1 CCC1=CC=C(I)C=C1 3877 [1,1,0,0,0,0|1,0,0]=3 1192 B9R1.1 CCC1=CC=C(N)C=C1 26342 [1,1,0,0,0,0|1,0,0]=3 1193 B9R1.1 CCC1=CC=C(O)C=C1 3874 [1,1,0,0,0,0|1,0,0]=3 1194 B9R1.1 CCC1=CC=C(S)C=C1 6813 [1,1,0,0,0,0|1,0,0]=3 1195 B9R1.1 CCC1=CN=C(C)C=C1 10482 [1,1,0,0,0,0|2,0,0]=4 1196 B9R1.1 CCC1=CN=C(C)C=C1 18256 [1,1,0,0,0,0|2,0,0]=4 1197 B9R1.1 CCC1=NC=C(Br)C=C1 16886 [1,1,0,0,0,0|2,0,0]=4 1198 B9R1.1 CCC1=NC=C(N)C=C1 25855 [1,1,0,0,0,0|2,0,0]=4 1199 B9R1.1 CCc1ccc(F)cc1 22752 [1,1,0,0,0,0|1,0,0]=3 1200 B9R1.1 CNC1=CC=C(Cl)C=C1 23344 [1,1,0,0,0,0|1,0,0]=3 1201 B9R1.1 CNC1=CC=C(I)C=C1 28328 [1,1,0,0,0,0|1,0,0]=3 1202 B9R1.1 CNC1=NC=C(Br)C=C1 22084 [1,1,0,0,0,0|2,0,0]=4 1203 B9R1.1 COC1=CC=C(Br)C=C1 3726 [1,1,0,0,0,0|0,0,0]=2 1204 B9R1.1 COC1=CC=C(C)N=C1 6640 [1,1,0,0,0,0|1,0,0]=3 1205 B9R1.1 COC1=CC=C(Cl)C=C1 3616 [1,1,0,0,0,0|0,0,0]=2 1206 B9R1.1 COC1=CC=C(F)C=C1 3475 [1,1,0,0,0,0|0,0,0]=2 1207 B9R1.1 COC1=CC=C(I)C=C1 3911 [1,1,0,0,0,0|0,0,0]=2 1208 B9R1.1 COC1=CC=C(N)C=C1 21392 [1,1,0,0,0,0|0,0,0]=2 1209 B9R1.1 COC1=CC=C(N)C=C1 36098 [1,1,0,0,0,0|0,0,0]=2 1210 B9R1.1 COC1=CC=C(N)N=N1 9536 [1,1,0,0,0,0|2,0,0]=4 1211 B9R1.1 COC1=CC=C(O)C=C1 14584 [1,1,0,0,0,0|0,0,0]=2 1212 B9R1.1 COC1=CC=C(O)C=C1 2276 [1,1,0,0,0,0|0,0,0]=2 1213 B9R1.1 COC1=CC=C(S)C=C1 6822 [1,1,0,0,0,0|0,0,0]=2 1214 B9R1.1 COC1=CC=[N+]([O-])C=C1 2587 [1,1,0,0,0,0|1,0,0]=3 1215 B9R1.1 COC1=CN=C(Br)C=C1 15210 [1,1,0,0,0,0|1,0,0]=3 1216 B9R1.1 COC1=CN=C(Br)C=N1 27287 [1,1,0,0,0,0|2,0,0]=4 1217 B9R1.1 COC1=CN=C(Br)N=C1 26980 [1,1,0,0,0,0|2,0,0]=4 1218 B9R1.1 COC1=CN=C(Cl)C=C1 6222 [1,1,0,0,0,0|1,0,0]=3 1219 B9R1.1 COC1=CN=C(Cl)C=N1 32145 [1,1,0,0,0,0|2,0,0]=4 1220 B9R1.1 COC1=CN=C(Cl)N=C1 13187 [1,1,0,0,0,0|2,0,0]=4 1221 B9R1.1 COC1=CN=C(F)C=C1 33665 [1,1,0,0,0,0|1,0,0]=3 1222 B9R1.1 COC1=CN=C(N)C=C1 23280 [1,1,0,0,0,0|1,0,0]=3 1223 B9R1.1 COC1=CN=C(N)C=N1 17505 [1,1,0,0,0,0|2,0,0]=4 1224 B9R1.1 COC1=CN=C(N)N=C1 20801 [1,1,0,0,0,0|2,0,0]=4 1225 B9R1.1 COC1=NC=C(Br)C=C1 2408 [1,1,0,0,0,0|1,0,0]=3 1226 B9R1.1 COC1=NC=C(Br)C=N1 5264 [1,1,0,0,0,0|2,0,0]=4 1227 B9R1.1 COC1=NC=C(C)C=C1 6609 [1,1,0,0,0,0|1,0,0]=3 1228 B9R1.1 COC1=NC=C(Cl)C=C1 6602 [1,1,0,0,0,0|1,0,0]=3 1229 B9R1.1 COC1=NC=C(F)C=C1 11248 [1,1,0,0,0,0|1,0,0]=3 1230 B9R1.1 COC1=NC=C(I)C=C1 6606 [1,1,0,0,0,0|1,0,0]=3 1231 B9R1.1 COC1=NC=C(N)C=C1 1270 [1,1,0,0,0,0|1,0,0]=3 1232 B9R1.1 COC1=NC=C(O)C=C1 16171 [1,1,0,0,0,0|1,0,0]=3 1233 B9R1.1 CSC1=CC=C(Br)C=C1 10650 [1,1,0,0,0,0|0,1,0]=3 1234 B9R1.1 CSC1=CC=C(C)C=C1 10672 [1,1,0,0,0,0|0,1,0]=3 1235 B9R1.1 CSC1=CC=C(Cl)C=C1 10645 [1,1,0,0,0,0|0,1,0]=3 1236 B9R1.1 CSC1=CC=C(F)C=C1 10641 [1,1,0,0,0,0|0,1,0]=3 1237 B9R1.1 CSC1=CC=C(I)C=C1 10670 [1,1,0,0,0,0|0,1,0]=3 1238 B9R1.1 CSC1=CC=C(N)C=C1 10636 [1,1,0,0,0,0|0,1,0]=3 1239 B9R1.1 CSC1=CC=C(O)C=C1 15277 [1,1,0,0,0,0|0,1,0]=3 1240 B9R1.1 CSC1=CC=C(S)C=C1 6825 [1,1,0,0,0,0|0,1,0]=3 1241 B9R1.1 ClC1=CC=C(CBr)C=C1 36109 [1,1,0,0,0,0|2,0,0]=4 1242 B9R1.1 ClC1=CC=C([Mg]Br)C=C1 24069 [1,1,0,0,0,0|2,0,0]=4 1243 B9R1.1 ClCC1=CC=C(Br)C=C1 2478 [1,1,0,0,0,0|2,0,0]=4 1244 B9R1.1 ClCC1=CC=C(Cl)C=C1 5797 [1,1,0,0,0,0|2,0,0]=4 1245 B9R1.1 FC1=CC=C(CBr)C=C1 7354 [1,1,0,0,0,0|2,0,0]=4 1246 B9R1.1 FC1=CC=C(CCl)C=C1 8864 [1,1,0,0,0,0|2,0,0]=4 1247 B9R1.1 FC1=CC=C(CS)C=C1 6855 [1,1,0,0,0,0|2,0,0]=4 1248 B9R1.1 N#CC1=CC=C(Br)C=C1 3745 [1,1,0,0,0,0|2,0,0]=4 1249 B9R1.1 N#CC1=CC=C(Cl)C=C1 20405 [1,1,0,0,0,0|2,0,0]=4 1250 B9R1.1 N#CC1=CC=C(F)C=C1 1585 [1,1,0,0,0,0|2,0,0]=4 1251 B9R1.1 N#CC1=CC=C(I)C=C1 3936 [1,1,0,0,0,0|2,0,0]=4 1252 B9R1.1 N#CC1=CC=C(N)C=C1 15683 [1,1,0,0,0,0|2,0,0]=4 1253 B9R1.1 NC1=CC=C(C=O)C=C1 7795 [1,1,0,0,0,0|2,0,0]=4 1254 B9R1.1 NC1=CC=C(CBr)C=C1 26393 [1,1,0,0,0,0|2,0,0]=4 1255 B9R1.1 NC1=CC=C(CO)C=C1 7480 [1,1,0,0,0,0|2,0,0]=4 1256 B9R1.1 NCC1=CC=C(Br)C=C1 23806 [1,1,0,0,0,0|2,0,0]=4 1257 B9R1.1 NCC1=CC=C(Br)C=C1 3751 [1,1,0,0,0,0|2,0,0]=4 1258 B9R1.1 NCC1=CC=C(Cl)C=C1 9028 [1,1,0,0,0,0|2,0,0]=4 1259 B9R1.1 NCC1=CC=C(F)C=C1 3408 [1,1,0,0,0,0|2,0,0]=4 1260 B9R1.1 NCC1=CC=C(F)C=C1 4420 [1,1,0,0,0,0|2,0,0]=4 1261 B9R1.1 NCC1=CC=C(I)C=C1 3304 [1,1,0,0,0,0|2,0,0]=4 1262 B9R1.1 NCC1=CC=C(N)C=C1 5803 [1,1,0,0,0,0|2,0,0]=4 1263 B9R1.1 NCC1=CC=C(O)C=C1 26036 [1,1,0,0,0,0|2,0,0]=4 1264 B9R1.1 NNC1=CC=C(Br)C=C1 21916 [1,1,0,0,0,0|2,0,0]=4 1265 B9R1.1 NNC1=CC=C(Br)C=C1 6409 [1,1,0,0,0,0|2,0,0]=4 1266 B9R1.1 NNC1=CC=C(Cl)C=C1 23899 [1,1,0,0,0,0|2,0,0]=4 1267 B9R1.1 NNC1=CC=C(Cl)C=C1 4483 [1,1,0,0,0,0|2,0,0]=4 1268 B9R1.1 NNC1=CC=C(F)C=C1 15913 [1,1,0,0,0,0|2,0,0]=4 1269 B9R1.1 NNC1=CC=C(F)C=C1 3330 [1,1,0,0,0,0|2,0,0]=4 1270 B9R1.1 NNC1=CC=C(I)C=C1 15797 [1,1,0,0,0,0|2,0,0]=4 1271 B9R1.1 O=CC1=CC=C(Br)C=C1 8053 [1,1,0,0,0,0|2,0,0]=4 1272 B9R1.1 O=CC1=CC=C(Cl)C=C1 8078 [1,1,0,0,0,0|2,0,0]=4 1273 B9R1.1 O=CC1=CC=C(F)C=C1 3478 [1,1,0,0,0,0|2,0,0]=4 1274 B9R1.1 O=CC1=CC=C(I)C=C1 5349 [1,1,0,0,0,0|2,0,0]=4 1275 B9R1.1 O=CC1=CC=C(O)C=C1 10188 [1,1,0,0,0,0|2,0,0]=4 1276 B9R1.1 OCC1=CC=C(Br)C=C1 3748 [1,1,0,0,0,0|2,0,0]=4 1277 B9R1.1 OCC1=CC=C(Cl)C=C1 3627 [1,1,0,0,0,0|2,0,0]=4 1278 B9R1.1 OCC1=CC=C(F)C=C1 3487 [1,1,0,0,0,0|2,0,0]=4 1279 B9R1.1 OCC1=CC=C(I)C=C1 4081 [1,1,0,0,0,0|2,0,0]=4 1280 B9R1.1 OCC1=CC=C(O)C=C1 29320 [1,1,0,0,0,0|2,0,0]=4 1281 B9R1.1 OCC1=CC=C(S)C=C1 6879 [1,1,0,0,0,0|2,0,0]=4 1282 B9R1.1 SCC1=CC=C(Br)C=C1 6868 [1,1,0,0,0,0|2,0,0]=4 1283 B9R1.1 SCC1=CC=C(Cl)C=C1 6838 [1,1,0,0,0,0|2,0,0]=4 1284 B9R1.2 BrCC1=CC(Br)=CC=C1 3029 [1,1,0,0,0,0|2,0,0]=4 1285 B9R1.2 BrCC1=CC(I)=CC=C1 28805 [1,1,0,0,0,0|2,0,0]=4 1286 B9R1.2 C#CC1=CC(F)=CC=C1 12891 [1,1,0,0,0,0|1,0,1]=4 1287 B9R1.2 C#CC1=CC(N)=CC=C1 30297 [1,1,0,0,0,0|1,0,1]=4 1288 B9R1.2 C#CC1=CC(N)=CC=C1 4052 [1,1,0,0,0,0|1,0,1]=4 1289 B9R1.2 C#CC1=CC=CC(Br)=C1 19784 [1,1,0,0,0,0|1,0,1]=4 1290 B9R1.2 C#CC1=CC=CC(Cl)=C1 14083 [1,1,0,0,0,0|1,0,1]=4 1291 B9R1.2 C=CC1=CC(Br)=CC=C1 23859 [1,1,0,0,0,0|1,0,1]=4 1292 B9R1.2 CC1=CC(C=O)=CC=C1 15513 [1,1,0,0,0,0|2,0,0]=4 1293 B9R1.2 CC1=CC=CC(CF)=C1 28809 [1,1,0,0,0,0|2,0,0]=4 1294 B9R1.2 CC1=CC=CC(CN)=C1 10198 [1,1,0,0,0,0|2,0,0]=4 1295 B9R1.2 CC1=CC=CC(NN)=C1 6397 [1,1,0,0,0,0|2,0,0]=4 1296 B9R1.2 CCC1=CC(N)=NC=C1 7108 [1,1,0,0,0,0|2,0,0]=4 1297 B9R1.2 CCC1=CC=CC(Br)=C1 3771 [1,1,0,0,0,0|1,0,0]=3 1298 B9R1.2 CCC1=CC=CC(N)=C1 13534 [1,1,0,0,0,0|1,0,0]=3 1299 B9R1.2 CCC1=CC=CC(O)=C1 10772 [1,1,0,0,0,0|1,0,0]=3 1300 B9R1.2 CCC1=NC=CC(Br)=C1 22128 [1,1,0,0,0,0|2,0,0]=4 1301 B9R1.2 CNC1=CC(Br)=CN=C1 34590 [1,1,0,0,0,0|2,0,0]=4 1302 B9R1.2 CNC1=CC(Br)=NC=C1 33713 [1,1,0,0,0,0|2,0,0]=4 1303 B9R1.2 CNC1=CC(Cl)=CC=C1 9202 [1,1,0,0,0,0|1,0,0]=3 1304 B9R1.2 CNC1=CC(F)=CC=C1 24835 [1,1,0,0,0,0|1,0,0]=3 1305 B9R1.2 CNC1=CC=CC(O)=C1 27611 [1,1,0,0,0,0|1,0,0]=3 1306 B9R1.2 CNC1=NC=CC(Br)=C1 32483 [1,1,0,0,0,0|2,0,0]=4 1307 B9R1.2 COC1=CC(Br)=CC=C1 13575 [1,1,0,0,0,0|0,0,0]=2 1308 B9R1.2 COC1=CC(Br)=NC=C1 5957 [1,1,0,0,0,0|1,0,0]=3 1309 B9R1.2 COC1=CC(Br)=NC=N1 28084 [1,1,0,0,0,0|2,0,0]=4 1310 B9R1.2 COC1=CC(Cl)=CC=C1 3615 [1,1,0,0,0,0|0,0,0]=2 1311 B9R1.2 COC1=CC(Cl)=NC=C1 6204 [1,1,0,0,0,0|1,0,0]=3 1312 B9R1.2 COC1=CC(Cl)=NC=N1 7038 [1,1,0,0,0,0|2,0,0]=4 1313 B9R1.2 COC1=CC(F)=CC=C1 3474 [1,1,0,0,0,0|0,0,0]=2 1314 B9R1.2 COC1=CC(F)=NC=C1 34821 [1,1,0,0,0,0|1,0,0]=3 1315 B9R1.2 COC1=CC(I)=CC=C1 3904 [1,1,0,0,0,0|0,0,0]=2 1316 B9R1.2 COC1=CC(I)=NC=N1 28085 [1,1,0,0,0,0|2,0,0]=4 1317 B9R1.2 COC1=CC(N)=NC=C1 16566 [1,1,0,0,0,0|1,0,0]=3 1318 B9R1.2 COC1=CC(N)=NC=C1 5700 [1,1,0,0,0,0|1,0,0]=3 1319 B9R1.2 COC1=CC(N)=NC=N1 2605 [1,1,0,0,0,0|2,0,0]=4 1320 B9R1.2 COC1=CC(O)=CC=C1 13577 [1,1,0,0,0,0|0,0,0]=2 1321 B9R1.2 COC1=CC=CC(Br)=N1 9206 [1,1,0,0,0,0|1,0,0]=3 1322 B9R1.2 COC1=CC=CC(Cl)=N1 13194 [1,1,0,0,0,0|1,0,0]=3 1323 B9R1.2 COC1=CC=CC(I)=N1 9288 [1,1,0,0,0,0|1,0,0]=3 1324 B9R1.2 COC1=CC=CC(N)=C1 8374 [1,1,0,0,0,0|0,0,0]=2 1325 B9R1.2 COC1=CC=CC(N)=N1 12919 [1,1,0,0,0,0|1,0,0]=3 1326 B9R1.2 COC1=CC=CC(S)=C1 6817 [1,1,0,0,0,0|0,0,0]=2 1327 B9R1.2 COC1=CN=CC(Br)=C1 5085 [1,1,0,0,0,0|1,0,0]=3 1328 B9R1.2 COC1=CN=CC(Cl)=N1 32164 [1,1,0,0,0,0|2,0,0]=4 1329 B9R1.2 COC1=CN=CC(I)=C1 16704 [1,1,0,0,0,0|1,0,0]=3 1330 B9R1.2 COC1=CN=CC(N)=C1 22353 [1,1,0,0,0,0|1,0,0]=3 1331 B9R1.2 COC1=CN=CC(N)=N1 17504 [1,1,0,0,0,0|2,0,0]=4 1332 B9R1.2 COC1=CN=CC(O)=C1 27157 [1,1,0,0,0,0|1,0,0]=3 1333 B9R1.2 COC1=CN=NC(O)=C1 28201 [1,1,0,0,0,0|2,0,0]=4 1334 B9R1.2 COC1=NC(Br)=NC=C1 28086 [1,1,0,0,0,0|2,0,0]=4 1335 B9R1.2 COC1=NC(C)=NC=C1 19887 [1,1,0,0,0,0|2,0,0]=4 1336 B9R1.2 COC1=NC(N)=NC=C1 21995 [1,1,0,0,0,0|2,0,0]=4 1337 B9R1.2 COC1=NC=CC(Br)=C1 6657 [1,1,0,0,0,0|1,0,0]=3 1338 B9R1.2 COC1=NC=CC(Br)=N1 33686 [1,1,0,0,0,0|2,0,0]=4 1339 B9R1.2 COC1=NC=CC(C)=C1 6598 [1,1,0,0,0,0|1,0,0]=3 1340 B9R1.2 COC1=NC=CC(Cl)=C1 15650 [1,1,0,0,0,0|1,0,0]=3 1341 B9R1.2 COC1=NC=CC(Cl)=C1 6663 [1,1,0,0,0,0|1,0,0]=3 1342 B9R1.2 COC1=NC=CC(Cl)=N1 23206 [1,1,0,0,0,0|2,0,0]=4 1343 B9R1.2 COC1=NC=CC(F)=C1 6596 [1,1,0,0,0,0|1,0,0]=3 1344 B9R1.2 COC1=NC=CC(I)=C1 17128 [1,1,0,0,0,0|1,0,0]=3 1345 B9R1.2 COC1=NC=CC(N)=C1 32235 [1,1,0,0,0,0|1,0,0]=3 1346 B9R1.2 COC1=NC=CC(N)=C1 6595 [1,1,0,0,0,0|1,0,0]=3 1347 B9R1.2 COC1=NC=CC(N)=N1 28087 [1,1,0,0,0,0|2,0,0]=4 1348 B9R1.2 COC1=NC=CC(O)=C1 35149 [1,1,0,0,0,0|1,0,0]=3 1349 B9R1.2 CSC1=CC(Br)=CC=C1 10649 [1,1,0,0,0,0|0,1,0]=3 1350 B9R1.2 CSC1=CC(C)=CC=C1 10793 [1,1,0,0,0,0|0,1,0]=3 1351 B9R1.2 CSC1=CC(Cl)=CC=C1 10644 [1,1,0,0,0,0|0,1,0]=3 1352 B9R1.2 CSC1=CC(F)=CC=C1 10640 [1,1,0,0,0,0|0,1,0]=3 1353 B9R1.2 CSC1=CC(I)=CC=C1 10669 [1,1,0,0,0,0|0,1,0]=3 1354 B9R1.2 CSC1=CC(N)=CC=C1 10635 [1,1,0,0,0,0|0,1,0]=3 1355 B9R1.2 CSC1=CC=CC(Br)=N1 27610 [1,1,0,0,0,0|1,1,0]=4 1356 B9R1.2 ClC1=CC=CC(CBr)=C1 10765 [1,1,0,0,0,0|2,0,0]=4 1357 B9R1.2 ClCC1=CC(Br)=CC=C1 23319 [1,1,0,0,0,0|2,0,0]=4 1358 B9R1.2 ClCC1=CC(Cl)=CC=C1 7520 [1,1,0,0,0,0|2,0,0]=4 1359 B9R1.2 ClCC1=CC(I)=CC=C1 31286 [1,1,0,0,0,0|2,0,0]=4 1360 B9R1.2 FC1=CC=CC(CBr)=C1 10214 [1,1,0,0,0,0|2,0,0]=4 1361 B9R1.2 FC1=CC=CC(CCl)=C1 7516 [1,1,0,0,0,0|2,0,0]=4 1362 B9R1.2 N#CC1=CC(Br)=CC=C1 1584 [1,1,0,0,0,0|2,0,0]=4 1363 B9R1.2 N#CC1=CC(Cl)=CC=C1 3624 [1,1,0,0,0,0|2,0,0]=4 1364 B9R1.2 N#CC1=CC(F)=CC=C1 1579 [1,1,0,0,0,0|2,0,0]=4 1365 B9R1.2 N#CC1=CC(I)=CC=C1 3935 [1,1,0,0,0,0|2,0,0]=4 1366 B9R1.2 N#CC1=CC(O)=CC=C1 13113 [1,1,0,0,0,0|2,0,0]=4 1367 B9R1.2 N#CC1=CC=CC(S)=C1 26190 [1,1,0,0,0,0|2,0,0]=4 1368 B9R1.2 NC1=CC=CC(CO)=C1 13383 [1,1,0,0,0,0|2,0,0]=4 1369 B9R1.2 NCC1=CC(Br)=CC=C1 21109 [1,1,0,0,0,0|2,0,0]=4 1370 B9R1.2 NCC1=CC(Br)=CC=C1 3750 [1,1,0,0,0,0|2,0,0]=4 1371 B9R1.2 NCC1=CC(F)=CC=C1 4417 [1,1,0,0,0,0|2,0,0]=4 1372 B9R1.2 NCC1=CC(I)=CC=C1 3302 [1,1,0,0,0,0|2,0,0]=4 1373 B9R1.2 NCC1=CC(N)=CC=C1 5802 [1,1,0,0,0,0|2,0,0]=4 1374 B9R1.2 NNC1=CC(Br)=CC=C1 23212 [1,1,0,0,0,0|2,0,0]=4 1375 B9R1.2 NNC1=CC(Cl)=CC=C1 7529 [1,1,0,0,0,0|2,0,0]=4 1376 B9R1.2 NNC1=CC(F)=CC=C1 3341 [1,1,0,0,0,0|2,0,0]=4 1377 B9R1.2 O=CC1=CC(Br)=CC=C1 3728 [1,1,0,0,0,0|2,0,0]=4 1378 B9R1.2 O=CC1=CC(Cl)=CC=C1 10800 [1,1,0,0,0,0|2,0,0]=4 1379 B9R1.2 O=CC1=CC(F)=CC=C1 3477 [1,1,0,0,0,0|2,0,0]=4 1380 B9R1.2 O=CC1=CC(I)=CC=C1 3917 [1,1,0,0,0,0|2,0,0]=4 1381 B9R1.2 O=CC1=CC(O)=CC=C1 7767 [1,1,0,0,0,0|2,0,0]=4 1382 B9R1.2 OCC1=CC(Br)=CC=C1 3747 [1,1,0,0,0,0|2,0,0]=4 1383 B9R1.2 OCC1=CC(Cl)=CC=C1 3626 [1,1,0,0,0,0|2,0,0]=4 1384 B9R1.2 OCC1=CC(F)=CC=C1 3486 [1,1,0,0,0,0|2,0,0]=4 1385 B9R1.2 OCC1=CC(I)=CC=C1 24776 [1,1,0,0,0,0|2,0,0]=4 1386 B9R1.6 CC(=O)C1=CC=CN=C1 1301 [1,1,0,0,0,0|2,0,0]=4 1387 B9R1.6 CC(=O)C1=CC=NC=C1 7542 [1,1,0,0,0,0|2,0,0]=4 1388 B9R1.6 CC(=O)C1=NC=CC=C1 13363 [1,1,0,0,0,0|2,0,0]=4 1389 B9R1.6 CC(Cl)C1=CC=CC=C1 10204 [1,1,0,0,0,0|1,0,0]=3 1390 B9R1.6 CC(N)C1=CC=CC=C1 21079 [1,1,0,0,0,0|1,0,0]=3 1391 B9R1.6 CN(C)C1=CC=NC=C1 2377 [1,1,0,0,0,0|2,0,0]=4 1392 B9R1.6 CN(C)C1=NC=CC=C1 14996 [1,1,0,0,0,0|2,0,0]=4 1393 B9R1.6 CP(C)C1=CC=CC=C1 6420 [1,1,0,0,0,0|1,0,0]=3 1394 B9R1.6 C[C@@H](N)c1ccccc1 6026 [1,1,0,0,0,0|1,0,0]=3 1395 B9R1.6 C[C@@H](N)c1ccccc1 6060 [1,1,0,0,0,0|1,0,0]=3 1396 B9R1.6 C[C@@H](N)c1ccccc1 9918 [1,1,0,0,0,0|1,0,0]=3 1397 B9R1.6 C[C@@H](O)C1=CC=CN=C1 27201 [1,1,0,0,0,0|2,0,0]=4 1398 B9R1.6 C[C@@H](O)C1=NC=CC=C1 5699 [1,1,0,0,0,0|2,0,0]=4 1399 B9R1.6 C[C@@H](O)c1ccccc1 6851 [1,1,0,0,0,0|1,0,0]=3 1400 B9R1.6 C[C@H](N)c1ccccc1 6025 [1,1,0,0,0,0|1,0,0]=3 1401 B9R1.6 C[C@H](N)c1ccccc1 6061 [1,1,0,0,0,0|1,0,0]=3 1402 B9R1.6 C[C@H](O)C1=NC=CC=C1 5701 [1,1,0,0,0,0|2,0,0]=4 1403 B9R1.6 C[C@H](O)c1ccccc1 6858 [1,1,0,0,0,0|1,0,0]=3 1404 B9R1.6 ClP(Cl)C1=CC=CC=C1 6469 [1,1,0,0,0,0|2,0,0]=4 1405 B9R1.6 FC(Cl)C1=CC=CC=C1 15923 [1,1,0,0,0,0|2,0,0]=4 1406 B9R1.6 NC(=S)C1=CC=CC=C1 13565 [1,1,0,0,0,0|2,0,0]=4 1407 B9R1.6 NC(=S)C1=CC=CC=C1 18582 [1,1,0,0,0,0|2,0,0]=4 1408 B9R1.6 O=C(Cl)C1=CC=CC=C1 22045 [1,1,0,0,0,0|2,0,0]=4 1409 B9R1.6 OB(O)C1=CC=CC=C1 1753 [1,1,0,0,0,0|2,0,0]=4 1410 B9R1.6 OC(=S)C1=CC=CC=C1 36202 [1,1,0,0,0,0|2,0,0]=4 1411 B9R1.8 BrCCC1=CC=CN=C1 21399 [1,1,0,0,0,0|2,0,0]=4 1412 B9R1.8 BrCCC1=NC=CC=C1 23421 [1,1,0,0,0,0|2,0,0]=4 1413 B9R1.8 Br[Mg]CC1=CC=CC=C1 20182 [1,1,0,0,0,0|2,0,0]=4 1414 B9R1.8 C=CCC1=CC=CC=C1 29358 [1,1,0,0,0,0|1,0,1]=4 1415 B9R1.8 C=CSC1=CC=CC=C1 10778 [1,1,0,0,0,0|0,1,1]=4 1416 B9R1.8 CCCC1=CC=CC=C1 10852 [1,1,0,0,0,0|1,0,0]=3 1417 B9R1.8 CCCC1=CC=NC=C1 15021 [1,1,0,0,0,0|2,0,0]=4 1418 B9R1.8 CCOC1=CC=NC=C1 1125 [1,1,0,0,0,0|1,0,0]=3 1419 B9R1.8 CCOC1=NC=CC=C1 1126 [1,1,0,0,0,0|1,0,0]=3 1420 B9R1.8 CCSC1=CC=CC=C1 10773 [1,1,0,0,0,0|0,1,0]=3 1421 B9R1.8 CNCC1=CC=CC=C1 19910 [1,1,0,0,0,0|1,0,0]=3 1422 B9R1.8 CNCC1=CC=CC=C1 25218 [1,1,0,0,0,0|1,0,0]=3 1423 B9R1.8 CNCC1=CC=CC=C1 5801 [1,1,0,0,0,0|1,0,0]=3 1424 B9R1.8 COCC1=CC=CC=C1 15300 [1,1,0,0,0,0|0,0,0]=2 1425 B9R1.8 ClCCC1=CC=CC=C1 26674 [1,1,0,0,0,0|1,0,0]=3 1426 B9R1.8 ClCCC1=CC=CN=C1 23929 [1,1,0,0,0,0|2,0,0]=4 1427 B9R1.8 ClCSC1=CC=CC=C1 10735 [1,1,0,0,0,0|0,1,0]=3 1428 B9R1.8 NCCC1=CC=CN=C1 13196 [1,1,0,0,0,0|2,0,0]=4 1429 B9R1.8 NCCC1=CC=CN=C1 14084 [1,1,0,0,0,0|2,0,0]=4 1430 B9R1.8 NCCC1=CC=NC=C1 13447 [1,1,0,0,0,0|2,0,0]=4 1431 B9R1.8 NCCC1=NC=CC=C1 2592 [1,1,0,0,0,0|2,0,0]=4 1432 B9R1.8 NCCc1ccccc1 21077 [1,1,0,0,0,0|1,0,0]=3 1433 B9R1.8 NNCC1=CC=CC=C1 29056 [1,1,0,0,0,0|2,0,0]=4 1434 B9R1.8 NOCC1=CC=CC=C1 24804 [1,1,0,0,0,0|1,0,0]=3 1435 B9R1.8 NOCC1=CC=CC=C1 7095 [1,1,0,0,0,0|1,0,0]=3 1436 B9R1.8 OCCC1=NC=CC=C1 2593 [1,1,0,0,0,0|2,0,0]=4 1437 B9R1.8 ONCC1=CC=CC=C1 25520 [1,1,0,0,0,0|2,0,0]=4 1438 B9R1.8 S=C=NC1=CC=CC=C1 18702 [1,1,0,0,0,0|1,0,1]=4 1439 B9R1.8 SCCC1=CC=CN=C1 25052 [1,1,0,0,0,0|2,0,0]=4 1440 B9R1.8 SCCC1=NC=CC=C1 25015 [1,1,0,0,0,0|2,0,0]=4 1441 B9R1.3 Brc1cccc(Br)c1I 28458 [1,1,0,0,0,0|2,0,0]=4 1442 B9R1.3 CC1=C(Br)C(Br)=CC=C1 31563 [1,1,0,0,0,0|1,0,0]=3 1443 B9R1.3 CC1=C(Br)C(Br)=NC=C1 5395 [1,1,0,0,0,0|2,0,0]=4 1444 B9R1.3 CC1=C(Br)C(Cl)=CC=C1 3598 [1,1,0,0,0,0|1,0,0]=3 1445 B9R1.3 CC1=C(Br)C(Cl)=NC=C1 1290 [1,1,0,0,0,0|2,0,0]=4 1446 B9R1.3 CC1=C(Br)C(F)=CC=C1 4518 [1,1,0,0,0,0|1,0,0]=3 1447 B9R1.3 CC1=C(Br)C(I)=CC=C1 31571 [1,1,0,0,0,0|1,0,0]=3 1448 B9R1.3 CC1=C(Br)C(N)=NC=C1 22221 [1,1,0,0,0,0|2,0,0]=4 1449 B9R1.3 CC1=C(Br)C(O)=NC=C1 6522 [1,1,0,0,0,0|2,0,0]=4 1450 B9R1.3 CC1=C(Br)C=CC=C1Br 3926 [1,1,0,0,0,0|1,0,0]=3 1451 B9R1.3 CC1=C(Br)C=CC=C1Cl 3601 [1,1,0,0,0,0|1,0,0]=3 1452 B9R1.3 CC1=C(Br)C=CC=C1F 3236 [1,1,0,0,0,0|1,0,0]=3 1453 B9R1.3 CC1=C(Br)C=CN=C1Cl 6178 [1,1,0,0,0,0|2,0,0]=4 1454 B9R1.3 CC1=C(Br)C=CN=C1F 6313 [1,1,0,0,0,0|2,0,0]=4 1455 B9R1.3 CC1=C(Br)C=NC=C1Br 17566 [1,1,0,0,0,0|2,0,0]=4 1456 B9R1.3 CC1=C(C)C(Br)=CC=C1 3766 [1,1,0,0,0,0|0,0,0]=2 1457 B9R1.3 CC1=C(C)C(I)=CC=C1 3865 [1,1,0,0,0,0|0,0,0]=2 1458 B9R1.3 CC1=C(Cl)C(Cl)=NC=C1 5404 [1,1,0,0,0,0|2,0,0]=4 1459 B9R1.3 CC1=C(Cl)C(F)=CC=C1 8351 [1,1,0,0,0,0|1,0,0]=3 1460 B9R1.3 CC1=C(Cl)C(N)=NC=C1 5557 [1,1,0,0,0,0|2,0,0]=4 1461 B9R1.3 CC1=C(Cl)C=CC=C1Cl 3701 [1,1,0,0,0,0|1,0,0]=3 1462 B9R1.3 CC1=C(Cl)C=CC=C1F 1607 [1,1,0,0,0,0|1,0,0]=3 1463 B9R1.3 CC1=C(Cl)C=CC=C1I 3654 [1,1,0,0,0,0|1,0,0]=3 1464 B9R1.3 CC1=C(Cl)C=CN=C1Cl 5462 [1,1,0,0,0,0|2,0,0]=4 1465 B9R1.3 CC1=C(Cl)C=NC=C1Cl 6617 [1,1,0,0,0,0|2,0,0]=4 1466 B9R1.3 CC1=C(F)C(Br)=CC=C1 4521 [1,1,0,0,0,0|1,0,0]=3 1467 B9R1.3 CC1=C(F)C(Br)=NC=C1 10596 [1,1,0,0,0,0|2,0,0]=4 1468 B9R1.3 CC1=C(F)C(Cl)=CC=C1 1608 [1,1,0,0,0,0|1,0,0]=3 1469 B9R1.3 CC1=C(F)C(Cl)=NC=C1 6134 [1,1,0,0,0,0|2,0,0]=4 1470 B9R1.3 CC1=C(F)C(F)=CC=C1 1610 [1,1,0,0,0,0|1,0,0]=3 1471 B9R1.3 CC1=C(F)C(I)=CC=C1 1617 [1,1,0,0,0,0|1,0,0]=3 1472 B9R1.3 CC1=C(F)C=CC=C1F 1614 [1,1,0,0,0,0|1,0,0]=3 1473 B9R1.3 CC1=C(F)C=CC=C1I 1620 [1,1,0,0,0,0|1,0,0]=3 1474 B9R1.3 CC1=C(I)C(Br)=CC=C1 26178 [1,1,0,0,0,0|1,0,0]=3 1475 B9R1.3 CC1=C(I)C(Br)=NC=C1 5911 [1,1,0,0,0,0|2,0,0]=4 1476 B9R1.3 CC1=C(I)C(Cl)=CC=C1 3655 [1,1,0,0,0,0|1,0,0]=3 1477 B9R1.3 CC1=C(I)C(F)=CC=C1 4552 [1,1,0,0,0,0|1,0,0]=3 1478 B9R1.3 CC1=C(I)C=CN=C1Cl 17059 [1,1,0,0,0,0|2,0,0]=4 1479 B9R1.3 CC1=C(I)C=CN=C1Cl 29231 [1,1,0,0,0,0|2,0,0]=4 1480 B9R1.3 CC1=C(I)C=CN=C1F 6315 [1,1,0,0,0,0|2,0,0]=4 1481 B9R1.3 CC1=C(N)C(Br)=NC=C1 1238 [1,1,0,0,0,0|2,0,0]=4 1482 B9R1.3 CC1=C(N)C(Cl)=CC=C1 22391 [1,1,0,0,0,0|1,0,0]=3 1483 B9R1.3 CC1=C(N)C(Cl)=NC=C1 1244 [1,1,0,0,0,0|2,0,0]=4 1484 B9R1.3 CC1=C(N)C(F)=NC=C1 2984 [1,1,0,0,0,0|2,0,0]=4 1485 B9R1.3 CC1=C(N)C(N)=CC=C1 4538 [1,1,0,0,0,0|1,0,0]=3 1486 B9R1.3 CC1=C(N)C(N)=NC=C1 5377 [1,1,0,0,0,0|2,0,0]=4 1487 B9R1.3 CC1=C(N)C(O)=NC=C1 6707 [1,1,0,0,0,0|2,0,0]=4 1488 B9R1.3 CC1=C(N)C=CC=C1Br 3529 [1,1,0,0,0,0|1,0,0]=3 1489 B9R1.3 CC1=C(N)C=CC=C1Cl 26446 [1,1,0,0,0,0|1,0,0]=3 1490 B9R1.3 CC1=C(N)C=CC=C1F 1510 [1,1,0,0,0,0|1,0,0]=3 1491 B9R1.3 CC1=C(N)C=CC=C1I 31570 [1,1,0,0,0,0|1,0,0]=3 1492 B9R1.3 CC1=C(O)C(Cl)=NC=C1 6140 [1,1,0,0,0,0|1,0,0]=3 1493 B9R1.3 CC1=C(O)C(O)=CC=C1 17861 [1,1,0,0,0,0|0,0,0]=2 1494 B9R1.3 CC1=C(O)C=CC=C1Br 31089 [1,1,0,0,0,0|0,0,0]=2 1495 B9R1.3 CC1=C(O)C=CC=C1Cl 3670 [1,1,0,0,0,0|0,0,0]=2 1496 B9R1.3 CC1=C(O)C=CC=C1F 4121 [1,1,0,0,0,0|0,0,0]=2 1497 B9R1.3 CC1=C(O)C=CC=C1N 15039 [1,1,0,0,0,0|0,0,0]=2 1498 B9R1.3 CC1=C(O)C=CC=C1O 15385 [1,1,0,0,0,0|0,0,0]=2 1499 B9R1.3 CC1=CC=CC(Br)=C1Cl 23023 [1,1,0,0,0,0|1,0,0]=3 1500 B9R1.3 CC1=CC=CC(Br)=C1N 15573 [1,1,0,0,0,0|1,0,0]=3 1501 B9R1.3 CC1=CC=CC(Br)=C1O 31130 [1,1,0,0,0,0|0,0,0]=2 1502 B9R1.3 CC1=CC=CC(C)=C1Br 3206 [1,1,0,0,0,0|1,0,0]=3 1503 B9R1.3 CC1=CC=CC(C)=C1Cl 3643 [1,1,0,0,0,0|1,0,0]=3 1504 B9R1.3 CC1=CC=CC(C)=C1F 4407 [1,1,0,0,0,0|1,0,0]=3 1505 B9R1.3 CC1=CC=CC(C)=C1I 3867 [1,1,0,0,0,0|1,0,0]=3 1506 B9R1.3 CC1=CC=CC(C)=C1N 17593 [1,1,0,0,0,0|1,0,0]=3 1507 B9R1.3 CC1=CC=CC(C)=C1O 21746 [1,1,0,0,0,0|0,0,0]=2 1508 B9R1.3 CC1=CC=CC(C)=C1S 15272 [1,1,0,0,0,0|0,1,0]=3 1509 B9R1.3 CC1=CC=CC(C)=[N+]1[O-] 22578 [1,1,0,0,0,0|1,0,1]=4 1510 B9R1.3 CC1=CC=CC(Cl)=C1C 3638 [1,1,0,0,0,0|0,0,0]=2 1511 B9R1.3 CC1=CC=CC(Cl)=C1O 3669 [1,1,0,0,0,0|0,0,0]=2 1512 B9R1.3 CC1=CC=CC(F)=C1C 4408 [1,1,0,0,0,0|0,0,0]=2 1513 B9R1.3 CC1=CC=CC(F)=C1N 4470 [1,1,0,0,0,0|1,0,0]=3 1514 B9R1.3 CC1=CC=CC(F)=C1O 28383 [1,1,0,0,0,0|0,0,0]=2 1515 B9R1.3 CC1=CC=CC(N)=C1Br 20315 [1,1,0,0,0,0|1,0,0]=3 1516 B9R1.3 CC1=CC=CC(N)=C1Br 31002 [1,1,0,0,0,0|1,0,0]=3 1517 B9R1.3 CC1=CC=CC(N)=C1Cl 26411 [1,1,0,0,0,0|1,0,0]=3 1518 B9R1.3 CC1=CC=CC(N)=C1F 1536 [1,1,0,0,0,0|1,0,0]=3 1519 B9R1.3 CC1=CC=CC(N)=C1I 31058 [1,1,0,0,0,0|1,0,0]=3 1520 B9R1.3 CC1=CC=CC(O)=C1Br 31086 [1,1,0,0,0,0|1,0,0]=3 1521 B9R1.3 CC1=CC=CC(O)=C1Cl 31108 [1,1,0,0,0,0|1,0,0]=3 1522 B9R1.3 CC1=CC=CC(O)=C1F 4120 [1,1,0,0,0,0|1,0,0]=3 1523 B9R1.3 CC1=CC=CC(O)=C1I 27685 [1,1,0,0,0,0|1,0,0]=3 1524 B9R1.3 CC1=CC=CC(O)=C1N 2104 [1,1,0,0,0,0|1,0,0]=3 1525 B9R1.3 CC1=CC=CC(S)=C1C 6883 [1,1,0,0,0,0|0,0,0]=2 1526 B9R1.3 CC1=CC=CC(S)=C1N 21907 [1,1,0,0,0,0|1,0,0]=3 1527 B9R1.3 CC1=CN=CC(Br)=C1N 17044 [1,1,0,0,0,0|2,0,0]=4 1528 B9R1.3 CC1=CN=CC(C)=C1Cl 19477 [1,1,0,0,0,0|2,0,0]=4 1529 B9R1.3 CC1=NC=CC(C)=C1Br 27953 [1,1,0,0,0,0|2,0,0]=4 1530 B9R1.3 CC1=NC=CC(C)=C1N 25038 [1,1,0,0,0,0|2,0,0]=4 1531 B9R1.3 CC1=NC=CC(Cl)=C1C 33641 [1,1,0,0,0,0|1,0,0]=3 1532 B9R1.3 CC1=NC=CC(Cl)=C1Cl 6612 [1,1,0,0,0,0|2,0,0]=4 1533 B9R1.3 CC1=NC=CC(N)=C1Cl 6652 [1,1,0,0,0,0|2,0,0]=4 1534 B9R1.3 CN1C(=O)C=CC=C1Br 27775 [1,1,0,0,0,0|1,0,1]=4 1535 B9R1.3 CN1C=CC=C(Br)C1=O 27721 [1,1,0,0,0,0|1,0,1]=4 1536 B9R1.3 CN1C=CC=C(O)C1=O 17740 [1,1,0,0,0,0|1,0,1]=4 1537 B9R1.3 ClC1=C(Cl)C(I)=CC=C1 3690 [1,1,0,0,0,0|2,0,0]=4 1538 B9R1.3 ClC1=CC=CC(Br)=C1Cl 3607 [1,1,0,0,0,0|2,0,0]=4 1539 B9R1.3 ClC1=CC=CC(Cl)=C1Br 3610 [1,1,0,0,0,0|2,0,0]=4 1540 B9R1.3 ClC1=CC=CC(Cl)=C1Cl 9584 [1,1,0,0,0,0|2,0,0]=4 1541 B9R1.3 ClC1=CC=CC(Cl)=C1I 9581 [1,1,0,0,0,0|2,0,0]=4 1542 B9R1.3 Clc1c(Br)cccc1Br 28453 [1,1,0,0,0,0|2,0,0]=4 1543 B9R1.3 FC1=C(Br)C(I)=CC=C1 27720 [1,1,0,0,0,0|2,0,0]=4 1544 B9R1.3 FC1=C(Br)C=CC=C1Br 28456 [1,1,0,0,0,0|2,0,0]=4 1545 B9R1.3 FC1=C(Br)C=CC=C1I 33430 [1,1,0,0,0,0|2,0,0]=4 1546 B9R1.3 FC1=C(Cl)C=CC=C1Cl 2311 [1,1,0,0,0,0|2,0,0]=4 1547 B9R1.3 FC1=C(F)C(I)=CC=C1 28462 [1,1,0,0,0,0|2,0,0]=4 1548 B9R1.3 FC1=CC=CC(Br)=C1Br 28457 [1,1,0,0,0,0|2,0,0]=4 1549 B9R1.3 FC1=CC=CC(Br)=C1Cl 4335 [1,1,0,0,0,0|2,0,0]=4 1550 B9R1.3 FC1=CC=CC(F)=C1Br 3034 [1,1,0,0,0,0|2,0,0]=4 1551 B9R1.3 FC1=CC=CC(F)=C1Cl 3416 [1,1,0,0,0,0|2,0,0]=4 1552 B9R1.3 FC1=CC=CC(F)=C1F 1067 [1,1,0,0,0,0|2,0,0]=4 1553 B9R1.3 FC1=CC=CC(F)=C1I 28463 [1,1,0,0,0,0|2,0,0]=4 1554 B9R1.3 Fc1c(Cl)cccc1Br 4338 [1,1,0,0,0,0|2,0,0]=4 1555 B9R1.3 Fc1c(Cl)cccc1I 4340 [1,1,0,0,0,0|2,0,0]=4 1556 B9R1.3 Fc1cccc(Cl)c1Cl 4380 [1,1,0,0,0,0|2,0,0]=4 1557 B9R1.3 Fc1cccc(Cl)c1F 4396 [1,1,0,0,0,0|2,0,0]=4 1558 B9R1.3 NC1=C(Br)C(Cl)=CC=C1 27264 [1,1,0,0,0,0|2,0,0]=4 1559 B9R1.3 NC1=C(Br)C(F)=CC=C1 1523 [1,1,0,0,0,0|2,0,0]=4 1560 B9R1.3 NC1=C(Br)C=CC=C1Br 28295 [1,1,0,0,0,0|2,0,0]=4 1561 B9R1.3 NC1=C(Br)C=CC=C1Cl 28270 [1,1,0,0,0,0|2,0,0]=4 1562 B9R1.3 NC1=C(Br)C=CC=C1F 2923 [1,1,0,0,0,0|2,0,0]=4 1563 B9R1.3 NC1=C(Cl)C(Br)=CC=C1 31029 [1,1,0,0,0,0|2,0,0]=4 1564 B9R1.3 NC1=C(Cl)C(Cl)=CC=C1 10752 [1,1,0,0,0,0|2,0,0]=4 1565 B9R1.3 NC1=C(Cl)C(F)=CC=C1 1527 [1,1,0,0,0,0|2,0,0]=4 1566 B9R1.3 NC1=C(Cl)C=CC=C1F 1528 [1,1,0,0,0,0|2,0,0]=4 1567 B9R1.3 NC1=C(Cl)C=CC=C1I 10508 [1,1,0,0,0,0|2,0,0]=4 1568 B9R1.3 NC1=C(F)C(Br)=CC=C1 25916 [1,1,0,0,0,0|2,0,0]=4 1569 B9R1.3 NC1=C(F)C(Cl)=CC=C1 1529 [1,1,0,0,0,0|2,0,0]=4 1570 B9R1.3 NC1=C(F)C(F)=CC=C1 1530 [1,1,0,0,0,0|2,0,0]=4 1571 B9R1.3 NC1=C(F)C=CC=C1F 4034 [1,1,0,0,0,0|2,0,0]=4 1572 B9R1.3 NC1=C(F)C=CC=C1I 10507 [1,1,0,0,0,0|2,0,0]=4 1573 B9R1.3 NC1=C(I)C(Cl)=CC=C1 10506 [1,1,0,0,0,0|2,0,0]=4 1574 B9R1.3 NC1=C(I)C(F)=CC=C1 1533 [1,1,0,0,0,0|2,0,0]=4 1575 B9R1.3 NC1=C(N)C(Cl)=CC=C1 30997 [1,1,0,0,0,0|2,0,0]=4 1576 B9R1.3 NC1=C(N)C(O)=NC=C1 25039 [1,1,0,0,0,0|2,0,0]=4 1577 B9R1.3 NC1=C(O)C(Br)=CC=C1 18136 [1,1,0,0,0,0|1,0,0]=3 1578 B9R1.3 NC1=C(O)C(Cl)=CC=C1 31102 [1,1,0,0,0,0|1,0,0]=3 1579 B9R1.3 NC1=C(O)C(F)=CC=C1 10659 [1,1,0,0,0,0|1,0,0]=3 1580 B9R1.3 NC1=C(O)C=CC=C1Br 21871 [1,1,0,0,0,0|1,0,0]=3 1581 B9R1.3 NC1=C(O)C=CC=C1Cl 31115 [1,1,0,0,0,0|1,0,0]=3 1582 B9R1.3 NC1=C(O)C=CC=C1F 31125 [1,1,0,0,0,0|1,0,0]=3 1583 B9R1.3 NC1=C(O)C=CC=C1O 19659 [1,1,0,0,0,0|1,0,0]=3 1584 B9R1.3 NC1=C(S)C=CC=C1Br 21898 [1,1,0,0,0,0|1,1,0]=4 1585 B9R1.3 NC1=C(S)C=CC=C1Cl 21897 [1,1,0,0,0,0|1,1,0]=4 1586 B9R1.3 NC1=CC=CC(O)=C1N 2129 [1,1,0,0,0,0|1,0,0]=3 1587 B9R1.3 NC1=NC=CC(Br)=C1O 5605 [1,1,0,0,0,0|2,0,0]=4 1588 B9R1.3 NC1=NC=CC(Cl)=C1O 5611 [1,1,0,0,0,0|2,0,0]=4 1589 B9R1.3 NC1=NC=CC(F)=C1O 5616 [1,1,0,0,0,0|2,0,0]=4 1590 B9R1.3 Nc1cccc(F)c1N 27516 [1,1,0,0,0,0|2,0,0]=4 1591 B9R1.3 O=C1NC=CC(O)=C1Cl 16904 [1,1,0,0,0,0|2,0,0]=4 1592 B9R1.3 OC1=C(Br)C(Br)=CC=C1 22618 [1,1,0,0,0,0|1,0,0]=3 1593 B9R1.3 OC1=C(Br)C(Cl)=CC=C1 17551 [1,1,0,0,0,0|1,0,0]=3 1594 B9R1.3 OC1=C(Br)C(F)=CC=C1 2834 [1,1,0,0,0,0|1,0,0]=3 1595 B9R1.3 OC1=C(Br)C(I)=CC=C1 22616 [1,1,0,0,0,0|1,0,0]=3 1596 B9R1.3 OC1=C(Br)C=CC=C1Cl 17552 [1,1,0,0,0,0|1,0,0]=3 1597 B9R1.3 OC1=C(Br)C=CC=C1F 1487 [1,1,0,0,0,0|1,0,0]=3 1598 B9R1.3 OC1=C(Br)C=CC=C1I 27392 [1,1,0,0,0,0|1,0,0]=3 1599 B9R1.3 OC1=C(Br)C=NC=C1Br 11306 [1,1,0,0,0,0|2,0,0]=4 1600 B9R1.3 OC1=C(Cl)C(Br)=CC=C1 16946 [1,1,0,0,0,0|1,0,0]=3 1601 B9R1.3 OC1=C(Cl)C(Cl)=CC=C1 3696 [1,1,0,0,0,0|1,0,0]=3 1602 B9R1.3 OC1=C(Cl)C(F)=CC=C1 9615 [1,1,0,0,0,0|1,0,0]=3 1603 B9R1.3 OC1=C(Cl)C=CC=C1Cl 17274 [1,1,0,0,0,0|1,0,0]=3 1604 B9R1.3 OC1=C(Cl)C=CC=C1F 2853 [1,1,0,0,0,0|1,0,0]=3 1605 B9R1.3 OC1=C(Cl)C=CC=C1I 27391 [1,1,0,0,0,0|1,0,0]=3 1606 B9R1.3 OC1=C(Cl)C=CN=C1Cl 33321 [1,1,0,0,0,0|2,0,0]=4 1607 B9R1.3 OC1=C(Cl)C=CN=C1I 26786 [1,1,0,0,0,0|2,0,0]=4 1608 B9R1.3 OC1=C(Cl)C=NC=C1Cl 2583 [1,1,0,0,0,0|2,0,0]=4 1609 B9R1.3 OC1=C(F)C(Br)=CC=C1 16947 [1,1,0,0,0,0|1,0,0]=3 1610 B9R1.3 OC1=C(F)C(Cl)=CC=C1 2855 [1,1,0,0,0,0|1,0,0]=3 1611 B9R1.3 OC1=C(F)C(F)=CC=C1 1494 [1,1,0,0,0,0|1,0,0]=3 1612 B9R1.3 OC1=C(F)C(F)=NC=C1 22308 [1,1,0,0,0,0|2,0,0]=4 1613 B9R1.3 OC1=C(F)C(I)=CC=C1 33275 [1,1,0,0,0,0|1,0,0]=3 1614 B9R1.3 OC1=C(F)C=CC=C1F 1495 [1,1,0,0,0,0|1,0,0]=3 1615 B9R1.3 OC1=C(F)C=CC=C1I 1497 [1,1,0,0,0,0|1,0,0]=3 1616 B9R1.3 OC1=C(I)C(Br)=CC=C1 22617 [1,1,0,0,0,0|1,0,0]=3 1617 B9R1.3 OC1=C(I)C(Cl)=CC=C1 28363 [1,1,0,0,0,0|1,0,0]=3 1618 B9R1.3 OC1=C(I)C(F)=CC=C1 33428 [1,1,0,0,0,0|1,0,0]=3 1619 B9R1.3 OC1=CC=CC(Br)=C1O 19085 [1,1,0,0,0,0|1,0,0]=3 1620 B9R1.3 OC1=CC=CC(Cl)=C1O 18911 [1,1,0,0,0,0|1,0,0]=3 1621 B9R1.3 OC1=CC=CC(F)=C1O 4142 [1,1,0,0,0,0|1,0,0]=3 1622 B9R1.3 OC1=CC=CC(O)=C1Br 34182 [1,1,0,0,0,0|1,0,0]=3 1623 B9R1.3 OC1=CC=CC(O)=C1Cl 28103 [1,1,0,0,0,0|1,0,0]=3 1624 B9R1.3 OC1=CC=CC(O)=C1F 4141 [1,1,0,0,0,0|1,0,0]=3 1625 B9R1.3 OC1=CC=CC(O)=C1I 34463 [1,1,0,0,0,0|1,0,0]=3 1626 B9R1.3 SC1=C(Cl)C(Cl)=CC=C1 6796 [1,1,0,0,0,0|1,1,0]=4 1627 B9R1.3 SC1=C(Cl)C=CC=C1Cl 6802 [1,1,0,0,0,0|1,1,0]=4 1628 B9R1.3 [O-][n+]1cccc(O)c1Br 5908 [1,1,0,0,0,0|2,0,0]=4 1629 B9R1.3 [O-][n+]1cccc(O)c1Br 5909 [1,1,0,0,0,0|2,0,0]=4 1630 B9R1.69 BrC1=C(I)C=CC(I)=C1 25907 [1,1,0,0,0,0|2,0,0]=4 1631 B9R1.69 BrC1=CC(Br)=C(Br)C=C1 28486 [1,1,0,0,0,0|2,0,0]=4 1632 B9R1.69 CC1=C(Br)C=C(Br)C=C1 3915 [1,1,0,0,0,0|1,0,0]=3 1633 B9R1.69 CC1=C(Br)C=C(Cl)C=C1 3599 [1,1,0,0,0,0|1,0,0]=3 1634 B9R1.69 CC1=C(Br)C=C(F)C=C1 1602 [1,1,0,0,0,0|1,0,0]=3 1635 B9R1.69 CC1=C(Br)C=C(N)C=C1 5336 [1,1,0,0,0,0|1,0,0]=3 1636 B9R1.69 CC1=C(Br)C=C(O)C=C1 27670 [1,1,0,0,0,0|1,0,0]=3 1637 B9R1.69 CC1=C(Br)C=CC(Br)=C1 3922 [1,1,0,0,0,0|1,0,0]=3 1638 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 3600 [1,1,0,0,0,0|1,0,0]=3 1639 B9R1.69 CC1=C(Br)C=CC(Cl)=N1 6208 [1,1,0,0,0,0|2,0,0]=4 1640 B9R1.69 CC1=C(Br)C=CC(F)=C1 1603 [1,1,0,0,0,0|1,0,0]=3 1641 B9R1.69 CC1=C(Br)C=CC(F)=N1 6317 [1,1,0,0,0,0|2,0,0]=4 1642 B9R1.69 CC1=C(Br)C=CC(I)=C1 3791 [1,1,0,0,0,0|1,0,0]=3 1643 B9R1.69 CC1=C(Br)C=CC(N)=C1 4339 [1,1,0,0,0,0|1,0,0]=3 1644 B9R1.69 CC1=C(Br)C=CC(N)=C1 5368 [1,1,0,0,0,0|1,0,0]=3 1645 B9R1.69 CC1=C(Br)C=CC(N)=N1 1237 [1,1,0,0,0,0|2,0,0]=4 1646 B9R1.69 CC1=C(Br)C=CC(O)=C1 2201 [1,1,0,0,0,0|1,0,0]=3 1647 B9R1.69 CC1=C(Br)C=CC(O)=N1 6565 [1,1,0,0,0,0|2,0,0]=4 1648 B9R1.69 CC1=C(C)C=C(Br)C=C1 3764 [1,1,0,0,0,0|0,0,0]=2 1649 B9R1.69 CC1=C(C)C=C(Cl)C=C1 3641 [1,1,0,0,0,0|0,0,0]=2 1650 B9R1.69 CC1=C(C)C=C(F)C=C1 14118 [1,1,0,0,0,0|0,0,0]=2 1651 B9R1.69 CC1=C(C)C=C(I)C=C1 3105 [1,1,0,0,0,0|0,0,0]=2 1652 B9R1.69 CC1=C(C)C=C(O)C=C1 21761 [1,1,0,0,0,0|0,0,0]=2 1653 B9R1.69 CC1=C(C)C=C(S)C=C1 6812 [1,1,0,0,0,0|0,0,0]=2 1654 B9R1.69 CC1=C(C)N=C(N)C=C1 26060 [1,1,0,0,0,0|1,0,0]=3 1655 B9R1.69 CC1=C(C)N=C(N)C=N1 32175 [1,1,0,0,0,0|2,0,0]=4 1656 B9R1.69 CC1=C(C)N=C(O)C=N1 34143 [1,1,0,0,0,0|2,0,0]=4 1657 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 3603 [1,1,0,0,0,0|1,0,0]=3 1658 B9R1.69 CC1=C(Cl)C=C(F)C=C1 1605 [1,1,0,0,0,0|1,0,0]=3 1659 B9R1.69 CC1=C(Cl)C=C(I)C=C1 3652 [1,1,0,0,0,0|1,0,0]=3 1660 B9R1.69 CC1=C(Cl)C=C(N)C=C1 19746 [1,1,0,0,0,0|1,0,0]=3 1661 B9R1.69 CC1=C(Cl)C=C(O)C=C1 3671 [1,1,0,0,0,0|1,0,0]=3 1662 B9R1.69 CC1=C(Cl)C=C(O)C=N1 34283 [1,1,0,0,0,0|2,0,0]=4 1663 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 3604 [1,1,0,0,0,0|1,0,0]=3 1664 B9R1.69 CC1=C(Cl)C=CC(Cl)=C1 3700 [1,1,0,0,0,0|1,0,0]=3 1665 B9R1.69 CC1=C(Cl)C=CC(F)=C1 1606 [1,1,0,0,0,0|1,0,0]=3 1666 B9R1.69 CC1=C(Cl)C=CC(I)=C1 3653 [1,1,0,0,0,0|1,0,0]=3 1667 B9R1.69 CC1=C(Cl)C=CC(N)=C1 3439 [1,1,0,0,0,0|1,0,0]=3 1668 B9R1.69 CC1=C(Cl)C=CC(N)=N1 5718 [1,1,0,0,0,0|2,0,0]=4 1669 B9R1.69 CC1=C(Cl)N=C(N)C=C1 35154 [1,1,0,0,0,0|2,0,0]=4 1670 B9R1.69 CC1=C(F)C=C(Br)C=C1 1601 [1,1,0,0,0,0|1,0,0]=3 1671 B9R1.69 CC1=C(F)C=C(Cl)C=C1 3437 [1,1,0,0,0,0|1,0,0]=3 1672 B9R1.69 CC1=C(F)C=C(F)C=C1 1612 [1,1,0,0,0,0|1,0,0]=3 1673 B9R1.69 CC1=C(F)C=C(I)C=C1 1618 [1,1,0,0,0,0|1,0,0]=3 1674 B9R1.69 CC1=C(F)C=C(N)C=C1 1509 [1,1,0,0,0,0|1,0,0]=3 1675 B9R1.69 CC1=C(F)C=C(O)C=C1 1499 [1,1,0,0,0,0|1,0,0]=3 1676 B9R1.69 CC1=C(F)C=C(S)C=C1 6872 [1,1,0,0,0,0|1,0,0]=3 1677 B9R1.69 CC1=C(F)C=CC(Br)=C1 1599 [1,1,0,0,0,0|1,0,0]=3 1678 B9R1.69 CC1=C(F)C=CC(Br)=N1 1135 [1,1,0,0,0,0|2,0,0]=4 1679 B9R1.69 CC1=C(F)C=CC(Cl)=C1 1609 [1,1,0,0,0,0|1,0,0]=3 1680 B9R1.69 CC1=C(F)C=CC(Cl)=N1 6219 [1,1,0,0,0,0|2,0,0]=4 1681 B9R1.69 CC1=C(F)C=CC(F)=C1 1613 [1,1,0,0,0,0|1,0,0]=3 1682 B9R1.69 CC1=C(F)C=CC(I)=C1 1619 [1,1,0,0,0,0|1,0,0]=3 1683 B9R1.69 CC1=C(F)C=CC(N)=C1 1513 [1,1,0,0,0,0|1,0,0]=3 1684 B9R1.69 CC1=C(F)C=CC(N)=N1 26666 [1,1,0,0,0,0|2,0,0]=4 1685 B9R1.69 CC1=C(F)C=CC(O)=C1 1501 [1,1,0,0,0,0|1,0,0]=3 1686 B9R1.69 CC1=C(I)C=C(Cl)C=C1 3657 [1,1,0,0,0,0|1,0,0]=3 1687 B9R1.69 CC1=C(I)C=C(F)C=C1 1622 [1,1,0,0,0,0|1,0,0]=3 1688 B9R1.69 CC1=C(I)C=C(N)C=C1 3314 [1,1,0,0,0,0|1,0,0]=3 1689 B9R1.69 CC1=C(I)C=CC(Br)=C1 3793 [1,1,0,0,0,0|1,0,0]=3 1690 B9R1.69 CC1=C(I)C=CC(Cl)=C1 25479 [1,1,0,0,0,0|1,0,0]=3 1691 B9R1.69 CC1=C(I)C=CC(Cl)=N1 13524 [1,1,0,0,0,0|2,0,0]=4 1692 B9R1.69 CC1=C(I)C=CC(F)=C1 1624 [1,1,0,0,0,0|1,0,0]=3 1693 B9R1.69 CC1=C(I)C=CC(F)=N1 13525 [1,1,0,0,0,0|2,0,0]=4 1694 B9R1.69 CC1=C(I)C=CC(N)=N1 13519 [1,1,0,0,0,0|2,0,0]=4 1695 B9R1.69 CC1=C(I)C=CC(O)=C1 23022 [1,1,0,0,0,0|1,0,0]=3 1696 B9R1.69 CC1=C(N)C=C(Br)C=C1 3801 [1,1,0,0,0,0|1,0,0]=3 1697 B9R1.69 CC1=C(N)C=C(Cl)C=C1 14280 [1,1,0,0,0,0|1,0,0]=3 1698 B9R1.69 CC1=C(N)C=C(Cl)C=C1 35457 [1,1,0,0,0,0|1,0,0]=3 1699 B9R1.69 CC1=C(N)C=C(F)C=C1 1512 [1,1,0,0,0,0|1,0,0]=3 1700 B9R1.69 CC1=C(N)C=C(I)C=C1 31023 [1,1,0,0,0,0|1,0,0]=3 1701 B9R1.69 CC1=C(N)C=C(N)C=C1 21656 [1,1,0,0,0,0|1,0,0]=3 1702 B9R1.69 CC1=C(N)C=C(O)C=C1 4524 [1,1,0,0,0,0|1,0,0]=3 1703 B9R1.69 CC1=C(N)C=CC(Br)=C1 15188 [1,1,0,0,0,0|1,0,0]=3 1704 B9R1.69 CC1=C(N)C=CC(Br)=C1 3800 [1,1,0,0,0,0|1,0,0]=3 1705 B9R1.69 CC1=C(N)C=CC(Br)=C1 3803 [1,1,0,0,0,0|1,0,0]=3 1706 B9R1.69 CC1=C(N)C=CC(Br)=N1 1117 [1,1,0,0,0,0|2,0,0]=4 1707 B9R1.69 CC1=C(N)C=CC(Cl)=C1 10759 [1,1,0,0,0,0|1,0,0]=3 1708 B9R1.69 CC1=C(N)C=CC(F)=C1 1508 [1,1,0,0,0,0|1,0,0]=3 1709 B9R1.69 CC1=C(N)C=CC(I)=C1 3318 [1,1,0,0,0,0|1,0,0]=3 1710 B9R1.69 CC1=C(N)C=CC(N)=N1 5495 [1,1,0,0,0,0|2,0,0]=4 1711 B9R1.69 CC1=C(N)C=CC(O)=C1 22012 [1,1,0,0,0,0|1,0,0]=3 1712 B9R1.69 CC1=C(N)C=NC(F)=C1 17516 [1,1,0,0,0,0|2,0,0]=4 1713 B9R1.69 CC1=C(O)C=C(Br)C=C1 4132 [1,1,0,0,0,0|0,0,0]=2 1714 B9R1.69 CC1=C(O)C=C(Cl)C=C1 3674 [1,1,0,0,0,0|0,0,0]=2 1715 B9R1.69 CC1=C(O)C=C(F)C=C1 1502 [1,1,0,0,0,0|0,0,0]=2 1716 B9R1.69 CC1=C(O)C=C(N)C=C1 8207 [1,1,0,0,0,0|0,0,0]=2 1717 B9R1.69 CC1=C(O)C=C(O)C=C1 27666 [1,1,0,0,0,0|0,0,0]=2 1718 B9R1.69 CC1=C(O)C=CC(Br)=C1 7106 [1,1,0,0,0,0|0,0,0]=2 1719 B9R1.69 CC1=C(O)C=CC(Cl)=C1 3673 [1,1,0,0,0,0|0,0,0]=2 1720 B9R1.69 CC1=C(O)C=CC(F)=C1 1500 [1,1,0,0,0,0|0,0,0]=2 1721 B9R1.69 CC1=C(O)C=CC(S)=C1 6863 [1,1,0,0,0,0|0,0,0]=2 1722 B9R1.69 CC1=C(S)C=C(Cl)C=C1 6881 [1,1,0,0,0,0|0,1,0]=3 1723 B9R1.69 CC1=C(S)C=CC(F)=C1 6870 [1,1,0,0,0,0|0,1,0]=3 1724 B9R1.69 CC1=CC(=O)C=CC1=O 14604 [1,1,0,0,0,0|0,0,1]=3 1725 B9R1.69 CC1=CC(Br)=C(Br)C=C1 3930 [1,1,0,0,0,0|2,0,0]=4 1726 B9R1.69 CC1=CC(Br)=C(C)C=C1 3763 [1,1,0,0,0,0|1,0,0]=3 1727 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 3602 [1,1,0,0,0,0|2,0,0]=4 1728 B9R1.69 CC1=CC(Br)=C(F)C=C1 1600 [1,1,0,0,0,0|2,0,0]=4 1729 B9R1.69 CC1=CC(Br)=C(I)C=C1 3792 [1,1,0,0,0,0|2,0,0]=4 1730 B9R1.69 CC1=CC(Br)=C(N)C=C1 3799 [1,1,0,0,0,0|2,0,0]=4 1731 B9R1.69 CC1=CC(Br)=C(N)C=C1 3802 [1,1,0,0,0,0|2,0,0]=4 1732 B9R1.69 CC1=CC(Br)=C(O)C=C1 4096 [1,1,0,0,0,0|1,0,0]=3 1733 B9R1.69 CC1=CC(Br)=C(O)C=N1 30312 [1,1,0,0,0,0|2,0,0]=4 1734 B9R1.69 CC1=CC(Br)=CN=C1Br 1138 [1,1,0,0,0,0|2,0,0]=4 1735 B9R1.69 CC1=CC(Br)=CN=C1Cl 1104 [1,1,0,0,0,0|2,0,0]=4 1736 B9R1.69 CC1=CC(Br)=CN=C1F 1136 [1,1,0,0,0,0|2,0,0]=4 1737 B9R1.69 CC1=CC(Br)=CN=C1I 6573 [1,1,0,0,0,0|2,0,0]=4 1738 B9R1.69 CC1=CC(Br)=CN=C1N 1236 [1,1,0,0,0,0|2,0,0]=4 1739 B9R1.69 CC1=CC(Br)=CN=C1O 6562 [1,1,0,0,0,0|1,0,0]=3 1740 B9R1.69 CC1=CC(Br)=NC=C1Br 2411 [1,1,0,0,0,0|2,0,0]=4 1741 B9R1.69 CC1=CC(Br)=NC=C1N 5960 [1,1,0,0,0,0|2,0,0]=4 1742 B9R1.69 CC1=CC(C)=C(Br)C=C1 3762 [1,1,0,0,0,0|1,0,0]=3 1743 B9R1.69 CC1=CC(C)=C(Cl)C=C1 3639 [1,1,0,0,0,0|1,0,0]=3 1744 B9R1.69 CC1=CC(C)=C(I)C=C1 3869 [1,1,0,0,0,0|1,0,0]=3 1745 B9R1.69 CC1=CC(C)=C(N)C=C1 15152 [1,1,0,0,0,0|1,0,0]=3 1746 B9R1.69 CC1=CC(C)=C(N)C=N1 25045 [1,1,0,0,0,0|2,0,0]=4 1747 B9R1.69 CC1=CC(C)=C(O)C=C1 21747 [1,1,0,0,0,0|0,0,0]=2 1748 B9R1.69 CC1=CC(C)=C(S)C=C1 6810 [1,1,0,0,0,0|0,1,0]=3 1749 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 9504 [1,1,0,0,0,0|2,0,0]=4 1750 B9R1.69 CC1=CC(Cl)=C(C)C=C1 3640 [1,1,0,0,0,0|1,0,0]=3 1751 B9R1.69 CC1=CC(Cl)=C(F)C=C1 3436 [1,1,0,0,0,0|2,0,0]=4 1752 B9R1.69 CC1=CC(Cl)=C(I)C=C1 3656 [1,1,0,0,0,0|2,0,0]=4 1753 B9R1.69 CC1=CC(Cl)=C(N)C=C1 2472 [1,1,0,0,0,0|2,0,0]=4 1754 B9R1.69 CC1=CC(Cl)=C(O)C=C1 3672 [1,1,0,0,0,0|1,0,0]=3 1755 B9R1.69 CC1=CC(Cl)=CN=C1Br 1285 [1,1,0,0,0,0|2,0,0]=4 1756 B9R1.69 CC1=CC(Cl)=CN=C1Cl 15129 [1,1,0,0,0,0|2,0,0]=4 1757 B9R1.69 CC1=CC(Cl)=CN=C1F 6318 [1,1,0,0,0,0|2,0,0]=4 1758 B9R1.69 CC1=CC(Cl)=CN=C1N 1243 [1,1,0,0,0,0|2,0,0]=4 1759 B9R1.69 CC1=CC(Cl)=CN=C1O 9824 [1,1,0,0,0,0|1,0,0]=3 1760 B9R1.69 CC1=CC(Cl)=NC=C1Br 6207 [1,1,0,0,0,0|2,0,0]=4 1761 B9R1.69 CC1=CC(Cl)=NC=C1Cl 15130 [1,1,0,0,0,0|2,0,0]=4 1762 B9R1.69 CC1=CC(Cl)=NC=C1F 10460 [1,1,0,0,0,0|2,0,0]=4 1763 B9R1.69 CC1=CC(Cl)=NC=C1I 13517 [1,1,0,0,0,0|2,0,0]=4 1764 B9R1.69 CC1=CC(Cl)=NC=C1N 6206 [1,1,0,0,0,0|2,0,0]=4 1765 B9R1.69 CC1=CC(F)=C(Br)C=C1 1604 [1,1,0,0,0,0|2,0,0]=4 1766 B9R1.69 CC1=CC(F)=C(C)C=C1 35429 [1,1,0,0,0,0|1,0,0]=3 1767 B9R1.69 CC1=CC(F)=C(Cl)C=C1 1611 [1,1,0,0,0,0|2,0,0]=4 1768 B9R1.69 CC1=CC(F)=C(F)C=C1 1615 [1,1,0,0,0,0|2,0,0]=4 1769 B9R1.69 CC1=CC(F)=C(I)C=C1 1621 [1,1,0,0,0,0|2,0,0]=4 1770 B9R1.69 CC1=CC(F)=C(N)C=C1 1511 [1,1,0,0,0,0|2,0,0]=4 1771 B9R1.69 CC1=CC(F)=CN=C1Br 5965 [1,1,0,0,0,0|2,0,0]=4 1772 B9R1.69 CC1=CC(F)=CN=C1Cl 6220 [1,1,0,0,0,0|2,0,0]=4 1773 B9R1.69 CC1=CC(F)=CN=C1N 17148 [1,1,0,0,0,0|2,0,0]=4 1774 B9R1.69 CC1=CC(F)=NC=C1Br 3547 [1,1,0,0,0,0|2,0,0]=4 1775 B9R1.69 CC1=CC(F)=NC=C1Cl 15262 [1,1,0,0,0,0|2,0,0]=4 1776 B9R1.69 CC1=CC(F)=NC=C1I 13514 [1,1,0,0,0,0|2,0,0]=4 1777 B9R1.69 CC1=CC(I)=C(C)C=C1 3875 [1,1,0,0,0,0|1,0,0]=3 1778 B9R1.69 CC1=CC(I)=C(F)C=C1 1623 [1,1,0,0,0,0|2,0,0]=4 1779 B9R1.69 CC1=CC(I)=C(N)C=C1 5353 [1,1,0,0,0,0|2,0,0]=4 1780 B9R1.69 CC1=CC(I)=CN=C1Br 5968 [1,1,0,0,0,0|2,0,0]=4 1781 B9R1.69 CC1=CC(I)=CN=C1Cl 6221 [1,1,0,0,0,0|2,0,0]=4 1782 B9R1.69 CC1=CC(I)=CN=C1F 6322 [1,1,0,0,0,0|2,0,0]=4 1783 B9R1.69 CC1=CC(I)=CN=C1N 1264 [1,1,0,0,0,0|2,0,0]=4 1784 B9R1.69 CC1=CC(N)=C(Br)C=C1 4337 [1,1,0,0,0,0|2,0,0]=4 1785 B9R1.69 CC1=CC(N)=C(Cl)C=C1 18921 [1,1,0,0,0,0|2,0,0]=4 1786 B9R1.69 CC1=CC(N)=C(F)C=C1 1507 [1,1,0,0,0,0|2,0,0]=4 1787 B9R1.69 CC1=CC(N)=C(I)C=C1 20232 [1,1,0,0,0,0|2,0,0]=4 1788 B9R1.69 CC1=CC(N)=C(N)C=C1 19699 [1,1,0,0,0,0|2,0,0]=4 1789 B9R1.69 CC1=CC(N)=C(S)C=C1 24155 [1,1,0,0,0,0|1,1,0]=4 1790 B9R1.69 CC1=CC(N)=CN=C1Br 1129 [1,1,0,0,0,0|2,0,0]=4 1791 B9R1.69 CC1=CC(N)=CN=C1Cl 1247 [1,1,0,0,0,0|2,0,0]=4 1792 B9R1.69 CC1=CC(N)=CN=C1F 1258 [1,1,0,0,0,0|2,0,0]=4 1793 B9R1.69 CC1=CC(N)=CN=C1N 5492 [1,1,0,0,0,0|2,0,0]=4 1794 B9R1.69 CC1=CC(N)=NC=C1Br 2241 [1,1,0,0,0,0|2,0,0]=4 1795 B9R1.69 CC1=CC(N)=NC=C1Cl 5717 [1,1,0,0,0,0|2,0,0]=4 1796 B9R1.69 CC1=CC(N)=NC=C1F 1256 [1,1,0,0,0,0|2,0,0]=4 1797 B9R1.69 CC1=CC(N)=NC=C1I 9289 [1,1,0,0,0,0|2,0,0]=4 1798 B9R1.69 CC1=CC(N)=NC=C1N 5494 [1,1,0,0,0,0|2,0,0]=4 1799 B9R1.69 CC1=CC(O)=C(Br)C=C1 25283 [1,1,0,0,0,0|1,0,0]=3 1800 B9R1.69 CC1=CC(O)=C(C)C=C1 21763 [1,1,0,0,0,0|0,0,0]=2 1801 B9R1.69 CC1=CC(O)=C(Cl)C=C1 3668 [1,1,0,0,0,0|1,0,0]=3 1802 B9R1.69 CC1=CC(O)=C(F)C=C1 1498 [1,1,0,0,0,0|1,0,0]=3 1803 B9R1.69 CC1=CC(O)=C(N)C=C1 11254 [1,1,0,0,0,0|1,0,0]=3 1804 B9R1.69 CC1=CC(O)=CN=C1Br 5966 [1,1,0,0,0,0|2,0,0]=4 1805 B9R1.69 CC1=CC(O)=CN=C1Cl 12478 [1,1,0,0,0,0|2,0,0]=4 1806 B9R1.69 CC1=CC(O)=CN=C1F 6320 [1,1,0,0,0,0|2,0,0]=4 1807 B9R1.69 CC1=CC(O)=NC=C1Br 6564 [1,1,0,0,0,0|2,0,0]=4 1808 B9R1.69 CC1=CC(O)=NC=C1N 6706 [1,1,0,0,0,0|2,0,0]=4 1809 B9R1.69 CC1=CC(S)=C(C)C=C1 6811 [1,1,0,0,0,0|0,1,0]=3 1810 B9R1.69 CC1=CC(S)=C(N)C=C1 18333 [1,1,0,0,0,0|1,1,0]=4 1811 B9R1.69 CC1=CC=C(Br)C(C)=N1 13806 [1,1,0,0,0,0|2,0,0]=4 1812 B9R1.69 CC1=CC=C(Br)C(O)=N1 6531 [1,1,0,0,0,0|2,0,0]=4 1813 B9R1.69 CC1=CC=C(Br)N=C1N 31947 [1,1,0,0,0,0|2,0,0]=4 1814 B9R1.69 CC1=CC=C(Cl)N=C1Cl 24157 [1,1,0,0,0,0|2,0,0]=4 1815 B9R1.69 CC1=CC=C(N)C(C)=N1 2075 [1,1,0,0,0,0|2,0,0]=4 1816 B9R1.69 CC1=CC=C(O)C(Br)=N1 5906 [1,1,0,0,0,0|2,0,0]=4 1817 B9R1.69 CC1=CC=C(O)C(C)=N1 22495 [1,1,0,0,0,0|1,0,0]=3 1818 B9R1.69 CC1=CC=C(O)C(Cl)=N1 6143 [1,1,0,0,0,0|2,0,0]=4 1819 B9R1.69 CC1=CC=C(O)C(F)=N1 6285 [1,1,0,0,0,0|2,0,0]=4 1820 B9R1.69 CC1=CC=C(O)C(I)=N1 6570 [1,1,0,0,0,0|2,0,0]=4 1821 B9R1.69 CC1=CC=C(O)C(N)=N1 5622 [1,1,0,0,0,0|2,0,0]=4 1822 B9R1.69 CC1=CN=C(Br)C(C)=C1 16831 [1,1,0,0,0,0|2,0,0]=4 1823 B9R1.69 CC1=CN=C(Br)C(O)=C1 5904 [1,1,0,0,0,0|2,0,0]=4 1824 B9R1.69 CC1=CN=C(C)C(Br)=C1 35361 [1,1,0,0,0,0|2,0,0]=4 1825 B9R1.69 CC1=CN=C(C)C(C)=C1 15901 [1,1,0,0,0,0|1,0,0]=3 1826 B9R1.69 CC1=CN=C(C)C(C)=N1 8613 [1,1,0,0,0,0|2,0,0]=4 1827 B9R1.69 CC1=CN=C(C)C=C1Br 45193 [1,1,0,0,0,0|2,0,0]=4 1828 B9R1.69 CC1=CN=C(C)N=C1O 26180 [1,1,0,0,0,0|2,0,0]=4 1829 B9R1.69 CC1=CN=C(Cl)C(O)=C1 6141 [1,1,0,0,0,0|2,0,0]=4 1830 B9R1.69 CC1=CN=C(Cl)C=C1Cl 5464 [1,1,0,0,0,0|2,0,0]=4 1831 B9R1.69 CC1=CN=C(Cl)C=C1I 27337 [1,1,0,0,0,0|2,0,0]=4 1832 B9R1.69 CC1=CN=C(F)C=C1Br 36220 [1,1,0,0,0,0|2,0,0]=4 1833 B9R1.69 CC1=CN=C(F)C=C1I 1305 [1,1,0,0,0,0|2,0,0]=4 1834 B9R1.69 CC1=CN=C(N)C(O)=C1 5621 [1,1,0,0,0,0|2,0,0]=4 1835 B9R1.69 CC1=CN=C(O)C(Br)=C1 6529 [1,1,0,0,0,0|2,0,0]=4 1836 B9R1.69 CC1=CN=C(O)C(I)=C1 26967 [1,1,0,0,0,0|2,0,0]=4 1837 B9R1.69 CC1=CN=C(O)C(N)=C1 6518 [1,1,0,0,0,0|2,0,0]=4 1838 B9R1.69 CC1=CN=C(O)N=C1O 9313 [1,1,0,0,0,0|2,0,0]=4 1839 B9R1.69 CC1=NC(Br)=CC=C1Br 3580 [1,1,0,0,0,0|2,0,0]=4 1840 B9R1.69 CC1=NC(Br)=CC=C1Cl 27063 [1,1,0,0,0,0|2,0,0]=4 1841 B9R1.69 CC1=NC(Cl)=CC=C1N 1246 [1,1,0,0,0,0|2,0,0]=4 1842 B9R1.69 CC1=NC(F)=CC=C1N 1131 [1,1,0,0,0,0|2,0,0]=4 1843 B9R1.69 CC1=NC=C(Br)C=C1Br 16457 [1,1,0,0,0,0|2,0,0]=4 1844 B9R1.69 CC1=NC=C(Br)C=C1Cl 27884 [1,1,0,0,0,0|2,0,0]=4 1845 B9R1.69 CC1=NC=C(Br)C=C1F 27017 [1,1,0,0,0,0|2,0,0]=4 1846 B9R1.69 CC1=NC=C(Br)C=C1N 17523 [1,1,0,0,0,0|2,0,0]=4 1847 B9R1.69 CC1=NC=C(Br)N=C1C 33316 [1,1,0,0,0,0|2,0,0]=4 1848 B9R1.69 CC1=NC=C(Cl)N=C1C 32158 [1,1,0,0,0,0|2,0,0]=4 1849 B9R1.69 CC1=NC=C(O)C=C1Br 6702 [1,1,0,0,0,0|2,0,0]=4 1850 B9R1.69 CN1C=C(Br)C=CC1=O 33527 [1,1,0,0,0,0|1,0,1]=4 1851 B9R1.69 CN1C=C(N)C=CC1=O 27642 [1,1,0,0,0,0|1,0,1]=4 1852 B9R1.69 CN1C=CC(Br)=CC1=O 27776 [1,1,0,0,0,0|1,0,1]=4 1853 B9R1.69 CN1C=CC(I)=CC1=O 27673 [1,1,0,0,0,0|1,0,1]=4 1854 B9R1.69 ClC1=C(Br)C=CC(Br)=C1 3633 [1,1,0,0,0,0|2,0,0]=4 1855 B9R1.69 ClC1=C(Br)C=CC(I)=C1 16805 [1,1,0,0,0,0|2,0,0]=4 1856 B9R1.69 ClC1=C(Cl)C=C(Br)C=C1 3611 [1,1,0,0,0,0|2,0,0]=4 1857 B9R1.69 ClC1=C(Cl)C=C(I)C=C1 3691 [1,1,0,0,0,0|2,0,0]=4 1858 B9R1.69 ClC1=C(I)C=C(Br)C=C1 35933 [1,1,0,0,0,0|2,0,0]=4 1859 B9R1.69 ClC1=C(I)C=CC(Br)=C1 3592 [1,1,0,0,0,0|2,0,0]=4 1860 B9R1.69 ClC1=C(I)C=CC(I)=C1 24307 [1,1,0,0,0,0|2,0,0]=4 1861 B9R1.69 ClC1=CC(Br)=C(Cl)C=C1 3609 [1,1,0,0,0,0|2,0,0]=4 1862 B9R1.69 ClC1=CC(Cl)=C(Br)C=C1 3608 [1,1,0,0,0,0|2,0,0]=4 1863 B9R1.69 ClC1=CC(Cl)=C(I)C=C1 3692 [1,1,0,0,0,0|2,0,0]=4 1864 B9R1.69 ClC1=CC(I)=C(Cl)C=C1 3694 [1,1,0,0,0,0|2,0,0]=4 1865 B9R1.69 Clc1cc(I)ccc1Br 4272 [1,1,0,0,0,0|2,0,0]=4 1866 B9R1.69 Clc1ccc(I)c(Br)c1 27432 [1,1,0,0,0,0|2,0,0]=4 1867 B9R1.69 FC1=C(Br)C=C(Br)C=C1 3446 [1,1,0,0,0,0|2,0,0]=4 1868 B9R1.69 FC1=C(Br)C=C(Cl)C=C1 3210 [1,1,0,0,0,0|2,0,0]=4 1869 B9R1.69 FC1=C(Br)C=C(I)C=C1 13485 [1,1,0,0,0,0|2,0,0]=4 1870 B9R1.69 FC1=C(Br)C=CC(Br)=C1 3448 [1,1,0,0,0,0|2,0,0]=4 1871 B9R1.69 FC1=C(Br)C=CC(Cl)=C1 3209 [1,1,0,0,0,0|2,0,0]=4 1872 B9R1.69 FC1=C(Br)C=CC(I)=C1 3231 [1,1,0,0,0,0|2,0,0]=4 1873 B9R1.69 FC1=C(Cl)C=C(Br)C=C1 2169 [1,1,0,0,0,0|2,0,0]=4 1874 B9R1.69 FC1=C(Cl)C=C(Cl)C=C1 2312 [1,1,0,0,0,0|2,0,0]=4 1875 B9R1.69 FC1=C(Cl)C=C(I)C=C1 3433 [1,1,0,0,0,0|2,0,0]=4 1876 B9R1.69 FC1=C(Cl)C=C(S)C=C1 2857 [1,1,0,0,0,0|2,0,0]=4 1877 B9R1.69 FC1=C(Cl)C=CC(Br)=C1 2255 [1,1,0,0,0,0|2,0,0]=4 1878 B9R1.69 FC1=C(Cl)C=CC(Cl)=C1 3454 [1,1,0,0,0,0|2,0,0]=4 1879 B9R1.69 FC1=C(Cl)C=CC(I)=C1 9517 [1,1,0,0,0,0|2,0,0]=4 1880 B9R1.69 FC1=C(F)C=C(Br)C=C1 2303 [1,1,0,0,0,0|2,0,0]=4 1881 B9R1.69 FC1=C(F)C=C(Cl)C=C1 3417 [1,1,0,0,0,0|2,0,0]=4 1882 B9R1.69 FC1=C(F)C=C(I)C=C1 3461 [1,1,0,0,0,0|2,0,0]=4 1883 B9R1.69 FC1=C(F)C=C(S)C=C1 6772 [1,1,0,0,0,0|2,0,0]=4 1884 B9R1.69 FC1=C(I)C=C(Br)C=C1 4294 [1,1,0,0,0,0|2,0,0]=4 1885 B9R1.69 FC1=C(I)C=C(Cl)C=C1 8538 [1,1,0,0,0,0|2,0,0]=4 1886 B9R1.69 FC1=C(I)C=CC(Br)=C1 3232 [1,1,0,0,0,0|2,0,0]=4 1887 B9R1.69 FC1=C(I)C=CC(I)=C1 4404 [1,1,0,0,0,0|2,0,0]=4 1888 B9R1.69 FC1=C(S)C=CC(Br)=C1 28392 [1,1,0,0,0,0|1,1,0]=4 1889 B9R1.69 FC1=CC(Br)=C(Br)C=C1 3445 [1,1,0,0,0,0|2,0,0]=4 1890 B9R1.69 FC1=CC(Br)=C(F)C=C1 2302 [1,1,0,0,0,0|2,0,0]=4 1891 B9R1.69 FC1=CC(Br)=C(I)C=C1 3234 [1,1,0,0,0,0|2,0,0]=4 1892 B9R1.69 FC1=CC(Cl)=C(Br)C=C1 3755 [1,1,0,0,0,0|2,0,0]=4 1893 B9R1.69 FC1=CC(Cl)=C(Cl)C=C1 3453 [1,1,0,0,0,0|2,0,0]=4 1894 B9R1.69 FC1=CC(Cl)=C(F)C=C1 8529 [1,1,0,0,0,0|2,0,0]=4 1895 B9R1.69 FC1=CC(Cl)=C(I)C=C1 3434 [1,1,0,0,0,0|2,0,0]=4 1896 B9R1.69 FC1=CC(Cl)=C(S)C=C1 2850 [1,1,0,0,0,0|1,1,0]=4 1897 B9R1.69 FC1=CC(F)=C(Br)C=C1 2301 [1,1,0,0,0,0|2,0,0]=4 1898 B9R1.69 FC1=CC(F)=C(Cl)C=C1 3415 [1,1,0,0,0,0|2,0,0]=4 1899 B9R1.69 FC1=CC(F)=C(F)C=C1 1068 [1,1,0,0,0,0|2,0,0]=4 1900 B9R1.69 FC1=CC(F)=C(I)C=C1 3463 [1,1,0,0,0,0|2,0,0]=4 1901 B9R1.69 FC1=CC(F)=C(S)C=C1 2875 [1,1,0,0,0,0|1,1,0]=4 1902 B9R1.69 FC1=CC(I)=C(Br)C=C1 3233 [1,1,0,0,0,0|2,0,0]=4 1903 B9R1.69 FC1=CC(I)=C(Cl)C=C1 3432 [1,1,0,0,0,0|2,0,0]=4 1904 B9R1.69 FC1=CC(I)=C(F)C=C1 4402 [1,1,0,0,0,0|2,0,0]=4 1905 B9R1.69 FC1=CC(S)=C(F)C=C1 6873 [1,1,0,0,0,0|1,1,0]=4 1906 B9R1.69 FC1=CC=C(Cl)C(F)=C1 4271 [1,1,0,0,0,0|2,0,0]=4 1907 B9R1.69 FC1=CC=C(Cl)C=C1F 4274 [1,1,0,0,0,0|2,0,0]=4 1908 B9R1.69 Fc1cc(Cl)ccc1I 3435 [1,1,0,0,0,0|2,0,0]=4 1909 B9R1.69 Fc1ccc(Cl)c(Br)c1 4270 [1,1,0,0,0,0|2,0,0]=4 1910 B9R1.69 NC1=C(Br)C=C(Br)C=C1 3447 [1,1,0,0,0,0|2,0,0]=4 1911 B9R1.69 NC1=C(Br)C=C(Cl)C=C1 3576 [1,1,0,0,0,0|2,0,0]=4 1912 B9R1.69 NC1=C(Br)C=C(F)C=C1 2918 [1,1,0,0,0,0|2,0,0]=4 1913 B9R1.69 NC1=C(Br)C=C(I)C=C1 5331 [1,1,0,0,0,0|2,0,0]=4 1914 B9R1.69 NC1=C(Br)C=CC(Br)=C1 3452 [1,1,0,0,0,0|2,0,0]=4 1915 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 3577 [1,1,0,0,0,0|2,0,0]=4 1916 B9R1.69 NC1=C(Br)C=CC(F)=C1 1524 [1,1,0,0,0,0|2,0,0]=4 1917 B9R1.69 NC1=C(Br)C=CC(O)=C1 32237 [1,1,0,0,0,0|2,0,0]=4 1918 B9R1.69 NC1=C(Cl)C=C(Br)C=C1 3578 [1,1,0,0,0,0|2,0,0]=4 1919 B9R1.69 NC1=C(Cl)C=C(Cl)C=C1 20789 [1,1,0,0,0,0|2,0,0]=4 1920 B9R1.69 NC1=C(Cl)C=C(F)C=C1 2943 [1,1,0,0,0,0|2,0,0]=4 1921 B9R1.69 NC1=C(Cl)C=C(I)C=C1 3811 [1,1,0,0,0,0|2,0,0]=4 1922 B9R1.69 NC1=C(Cl)C=C(O)C=C1 29212 [1,1,0,0,0,0|2,0,0]=4 1923 B9R1.69 NC1=C(Cl)C=C(O)C=C1 4513 [1,1,0,0,0,0|2,0,0]=4 1924 B9R1.69 NC1=C(Cl)C=CC(Cl)=C1 10755 [1,1,0,0,0,0|2,0,0]=4 1925 B9R1.69 NC1=C(Cl)C=CC(F)=C1 1517 [1,1,0,0,0,0|2,0,0]=4 1926 B9R1.69 NC1=C(F)C=C(Br)C=C1 1525 [1,1,0,0,0,0|2,0,0]=4 1927 B9R1.69 NC1=C(F)C=C(Br)C=C1 5316 [1,1,0,0,0,0|2,0,0]=4 1928 B9R1.69 NC1=C(F)C=C(Cl)C=C1 1514 [1,1,0,0,0,0|2,0,0]=4 1929 B9R1.69 NC1=C(F)C=C(F)C=C1 2294 [1,1,0,0,0,0|2,0,0]=4 1930 B9R1.69 NC1=C(F)C=C(I)C=C1 1532 [1,1,0,0,0,0|2,0,0]=4 1931 B9R1.69 NC1=C(F)C=C(O)C=C1 19088 [1,1,0,0,0,0|2,0,0]=4 1932 B9R1.69 NC1=C(F)C=C(O)C=C1 2832 [1,1,0,0,0,0|2,0,0]=4 1933 B9R1.69 NC1=C(F)C=C(S)C=C1 6878 [1,1,0,0,0,0|2,0,0]=4 1934 B9R1.69 NC1=C(F)C=CC(Br)=C1 13482 [1,1,0,0,0,0|2,0,0]=4 1935 B9R1.69 NC1=C(F)C=CC(Br)=C1 5319 [1,1,0,0,0,0|2,0,0]=4 1936 B9R1.69 NC1=C(F)C=CC(Cl)=C1 1515 [1,1,0,0,0,0|2,0,0]=4 1937 B9R1.69 NC1=C(F)C=CC(F)=C1 1531 [1,1,0,0,0,0|2,0,0]=4 1938 B9R1.69 NC1=C(F)C=CC(O)=C1 4776 [1,1,0,0,0,0|2,0,0]=4 1939 B9R1.69 NC1=C(I)C=C(Br)C=C1 3784 [1,1,0,0,0,0|2,0,0]=4 1940 B9R1.69 NC1=C(I)C=C(Cl)C=C1 3645 [1,1,0,0,0,0|2,0,0]=4 1941 B9R1.69 NC1=C(I)C=C(F)C=C1 3413 [1,1,0,0,0,0|2,0,0]=4 1942 B9R1.69 NC1=C(I)C=CC(Br)=C1 5332 [1,1,0,0,0,0|2,0,0]=4 1943 B9R1.69 NC1=C(I)C=CC(Cl)=C1 5286 [1,1,0,0,0,0|2,0,0]=4 1944 B9R1.69 NC1=C(I)C=CC(F)=C1 1535 [1,1,0,0,0,0|2,0,0]=4 1945 B9R1.69 NC1=C(N)C=C(Br)C=C1 4315 [1,1,0,0,0,0|2,0,0]=4 1946 B9R1.69 NC1=C(N)C=C(Cl)C=C1 4350 [1,1,0,0,0,0|2,0,0]=4 1947 B9R1.69 NC1=C(N)C=C(I)C=C1 28451 [1,1,0,0,0,0|2,0,0]=4 1948 B9R1.69 NC1=C(O)C=C(Br)C=C1 10469 [1,1,0,0,0,0|1,0,0]=3 1949 B9R1.69 NC1=C(O)C=C(Cl)C=C1 1478 [1,1,0,0,0,0|1,0,0]=3 1950 B9R1.69 NC1=C(O)C=C(F)C=C1 2828 [1,1,0,0,0,0|1,0,0]=3 1951 B9R1.69 NC1=C(O)C=C(O)C=C1 27733 [1,1,0,0,0,0|1,0,0]=3 1952 B9R1.69 NC1=C(O)C=CC(Br)=C1 4511 [1,1,0,0,0,0|1,0,0]=3 1953 B9R1.69 NC1=C(O)C=CC(F)=C1 2825 [1,1,0,0,0,0|1,0,0]=3 1954 B9R1.69 NC1=C(O)C=NC(Cl)=C1 24434 [1,1,0,0,0,0|2,0,0]=4 1955 B9R1.69 NC1=C(S)C=C(Br)C=C1 21899 [1,1,0,0,0,0|1,1,0]=4 1956 B9R1.69 NC1=C(S)C=C(Cl)C=C1 21806 [1,1,0,0,0,0|1,1,0]=4 1957 B9R1.69 NC1=C(S)C=C(F)C=C1 21900 [1,1,0,0,0,0|1,1,0]=4 1958 B9R1.69 NC1=C(S)C=CC(Cl)=C1 5427 [1,1,0,0,0,0|1,1,0]=4 1959 B9R1.69 NC1=CC(Br)=C(Cl)C=C1 5307 [1,1,0,0,0,0|2,0,0]=4 1960 B9R1.69 NC1=CC(Br)=C(F)C=C1 2924 [1,1,0,0,0,0|2,0,0]=4 1961 B9R1.69 NC1=CC(Br)=C(I)C=C1 5323 [1,1,0,0,0,0|2,0,0]=4 1962 B9R1.69 NC1=CC(Br)=C(N)C=C1 28448 [1,1,0,0,0,0|2,0,0]=4 1963 B9R1.69 NC1=CC(Br)=C(O)C=C1 31097 [1,1,0,0,0,0|1,0,0]=3 1964 B9R1.69 NC1=CC(Br)=CC=C1Cl 3132 [1,1,0,0,0,0|2,0,0]=4 1965 B9R1.69 NC1=CC(Br)=CN=C1O 6513 [1,1,0,0,0,0|2,0,0]=4 1966 B9R1.69 NC1=CC(Cl)=C(Br)C=C1 3579 [1,1,0,0,0,0|2,0,0]=4 1967 B9R1.69 NC1=CC(Cl)=C(Cl)C=C1 2563 [1,1,0,0,0,0|2,0,0]=4 1968 B9R1.69 NC1=CC(Cl)=C(F)C=C1 2951 [1,1,0,0,0,0|2,0,0]=4 1969 B9R1.69 NC1=CC(Cl)=C(I)C=C1 3812 [1,1,0,0,0,0|2,0,0]=4 1970 B9R1.69 NC1=CC(Cl)=C(O)C=C1 18907 [1,1,0,0,0,0|1,0,0]=3 1971 B9R1.69 NC1=CC(Cl)=CN=C1O 6515 [1,1,0,0,0,0|2,0,0]=4 1972 B9R1.69 NC1=CC(F)=C(Br)C=C1 1526 [1,1,0,0,0,0|2,0,0]=4 1973 B9R1.69 NC1=CC(F)=C(Cl)C=C1 1516 [1,1,0,0,0,0|2,0,0]=4 1974 B9R1.69 NC1=CC(F)=C(F)C=C1 2295 [1,1,0,0,0,0|2,0,0]=4 1975 B9R1.69 NC1=CC(F)=C(I)C=C1 1534 [1,1,0,0,0,0|2,0,0]=4 1976 B9R1.69 NC1=CC(F)=C(O)C=C1 2831 [1,1,0,0,0,0|1,0,0]=3 1977 B9R1.69 NC1=CC(I)=C(N)C=C1 13068 [1,1,0,0,0,0|2,0,0]=4 1978 B9R1.69 NC1=CC(N)=C(Br)C=C1 27515 [1,1,0,0,0,0|2,0,0]=4 1979 B9R1.69 NC1=CC(N)=C(F)C=C1 2538 [1,1,0,0,0,0|2,0,0]=4 1980 B9R1.69 NC1=CC(O)=C(Cl)C=C1 21902 [1,1,0,0,0,0|1,0,0]=3 1981 B9R1.69 NC1=CC(O)=CN=C1O 5518 [1,1,0,0,0,0|2,0,0]=4 1982 B9R1.69 NC1=CC=C(F)C=C1N 4357 [1,1,0,0,0,0|2,0,0]=4 1983 B9R1.69 NC1=CN=C(Cl)C=C1O 24435 [1,1,0,0,0,0|2,0,0]=4 1984 B9R1.69 NC1=CN=C(O)C(N)=C1 6446 [1,1,0,0,0,0|2,0,0]=4 1985 B9R1.69 NC1=NC=C(Br)C=C1O 18742 [1,1,0,0,0,0|2,0,0]=4 1986 B9R1.69 NC1=NC=C(F)C=C1O 5620 [1,1,0,0,0,0|2,0,0]=4 1987 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 3594 [1,1,0,0,0,0|1,0,0]=3 1988 B9R1.69 OC1=C(Br)C=C(F)C=C1 1485 [1,1,0,0,0,0|1,0,0]=3 1989 B9R1.69 OC1=C(Br)C=C(I)C=C1 27942 [1,1,0,0,0,0|1,0,0]=3 1990 B9R1.69 OC1=C(Br)C=CC(Br)=C1 14527 [1,1,0,0,0,0|1,0,0]=3 1991 B9R1.69 OC1=C(Br)C=CC(Cl)=C1 10956 [1,1,0,0,0,0|1,0,0]=3 1992 B9R1.69 OC1=C(Br)C=CC(F)=C1 1964 [1,1,0,0,0,0|1,0,0]=3 1993 B9R1.69 OC1=C(Cl)C=C(Br)C=C1 3596 [1,1,0,0,0,0|1,0,0]=3 1994 B9R1.69 OC1=C(Cl)C=C(F)C=C1 2372 [1,1,0,0,0,0|1,0,0]=3 1995 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 1476 [1,1,0,0,0,0|1,0,0]=3 1996 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 24852 [1,1,0,0,0,0|1,0,0]=3 1997 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 3697 [1,1,0,0,0,0|1,0,0]=3 1998 B9R1.69 OC1=C(Cl)C=CC(F)=C1 2146 [1,1,0,0,0,0|1,0,0]=3 1999 B9R1.69 OC1=C(Cl)C=CC(I)=C1 3651 [1,1,0,0,0,0|1,0,0]=3 2000 B9R1.69 OC1=C(F)C=C(Br)C=C1 1488 [1,1,0,0,0,0|1,0,0]=3 2001 B9R1.69 OC1=C(F)C=C(Cl)C=C1 2861 [1,1,0,0,0,0|1,0,0]=3 2002 B9R1.69 OC1=C(F)C=C(F)C=C1 2874 [1,1,0,0,0,0|1,0,0]=3 2003 B9R1.69 OC1=C(F)C=C(I)C=C1 26350 [1,1,0,0,0,0|1,0,0]=3 2004 B9R1.69 OC1=C(F)C=CC(Br)=C1 1490 [1,1,0,0,0,0|1,0,0]=3 2005 B9R1.69 OC1=C(F)C=CC(Cl)=C1 1492 [1,1,0,0,0,0|1,0,0]=3 2006 B9R1.69 OC1=C(F)C=CC(F)=C1 3464 [1,1,0,0,0,0|1,0,0]=3 2007 B9R1.69 OC1=C(F)C=CC(I)=C1 18134 [1,1,0,0,0,0|1,0,0]=3 2008 B9R1.69 OC1=C(I)C=C(Br)C=C1 28356 [1,1,0,0,0,0|1,0,0]=3 2009 B9R1.69 OC1=C(I)C=C(Cl)C=C1 28364 [1,1,0,0,0,0|1,0,0]=3 2010 B9R1.69 OC1=C(I)C=C(F)C=C1 28090 [1,1,0,0,0,0|1,0,0]=3 2011 B9R1.69 OC1=C(I)C=CC(Br)=C1 31124 [1,1,0,0,0,0|1,0,0]=3 2012 B9R1.69 OC1=C(I)C=CC(Cl)=C1 9582 [1,1,0,0,0,0|1,0,0]=3 2013 B9R1.69 OC1=C(I)C=CC(F)=C1 28089 [1,1,0,0,0,0|1,0,0]=3 2014 B9R1.69 OC1=C(I)C=CC(I)=C1 28127 [1,1,0,0,0,0|1,0,0]=3 2015 B9R1.69 OC1=CC(Br)=C(Br)C=C1 33264 [1,1,0,0,0,0|2,0,0]=4 2016 B9R1.69 OC1=CC(Br)=C(Cl)C=C1 3595 [1,1,0,0,0,0|2,0,0]=4 2017 B9R1.69 OC1=CC(Br)=C(F)C=C1 1486 [1,1,0,0,0,0|2,0,0]=4 2018 B9R1.69 OC1=CC(Br)=CN=C1Cl 35784 [1,1,0,0,0,0|2,0,0]=4 2019 B9R1.69 OC1=CC(Br)=CN=C1I 26867 [1,1,0,0,0,0|2,0,0]=4 2020 B9R1.69 OC1=CC(Br)=CN=C1O 5415 [1,1,0,0,0,0|2,0,0]=4 2021 B9R1.69 OC1=CC(Cl)=C(Br)C=C1 3597 [1,1,0,0,0,0|2,0,0]=4 2022 B9R1.69 OC1=CC(Cl)=C(Cl)C=C1 3698 [1,1,0,0,0,0|2,0,0]=4 2023 B9R1.69 OC1=CC(Cl)=C(F)C=C1 2856 [1,1,0,0,0,0|2,0,0]=4 2024 B9R1.69 OC1=CC(Cl)=C(I)C=C1 27608 [1,1,0,0,0,0|2,0,0]=4 2025 B9R1.69 OC1=CC(Cl)=CN=C1Br 5893 [1,1,0,0,0,0|2,0,0]=4 2026 B9R1.69 OC1=CC(Cl)=CN=C1Cl 26871 [1,1,0,0,0,0|2,0,0]=4 2027 B9R1.69 OC1=CC(Cl)=CN=C1F 6268 [1,1,0,0,0,0|2,0,0]=4 2028 B9R1.69 OC1=CC(Cl)=CN=C1O 5416 [1,1,0,0,0,0|2,0,0]=4 2029 B9R1.69 OC1=CC(F)=C(Br)C=C1 1489 [1,1,0,0,0,0|2,0,0]=4 2030 B9R1.69 OC1=CC(F)=C(Cl)C=C1 1493 [1,1,0,0,0,0|2,0,0]=4 2031 B9R1.69 OC1=CC(F)=C(F)C=C1 2315 [1,1,0,0,0,0|2,0,0]=4 2032 B9R1.69 OC1=CC(F)=C(I)C=C1 27944 [1,1,0,0,0,0|2,0,0]=4 2033 B9R1.69 OC1=CC(F)=C(O)C=C1 16452 [1,1,0,0,0,0|1,0,0]=3 2034 B9R1.69 OC1=CC(F)=CN=C1Br 10597 [1,1,0,0,0,0|2,0,0]=4 2035 B9R1.69 OC1=CC(F)=CN=C1Cl 17054 [1,1,0,0,0,0|2,0,0]=4 2036 B9R1.69 OC1=CC(I)=C(Cl)C=C1 28365 [1,1,0,0,0,0|2,0,0]=4 2037 B9R1.69 OC1=CC(I)=C(F)C=C1 33431 [1,1,0,0,0,0|2,0,0]=4 2038 B9R1.69 OC1=CC(O)=C(Br)C=C1 27082 [1,1,0,0,0,0|1,0,0]=3 2039 B9R1.69 OC1=CC(O)=C(Cl)C=C1 44767 [1,1,0,0,0,0|1,0,0]=3 2040 B9R1.69 OC1=CC(O)=C(F)C=C1 22656 [1,1,0,0,0,0|1,0,0]=3 2041 B9R1.69 OC1=CC(O)=NC=C1Cl 19875 [1,1,0,0,0,0|2,0,0]=4 2042 B9R1.69 OC1=CC=C(Cl)C=C1Cl 22008 [1,1,0,0,0,0|1,0,0]=3 2043 B9R1.69 OC1=CC=C(Cl)C=C1O 2215 [1,1,0,0,0,0|1,0,0]=3 2044 B9R1.69 OC1=CC=C(F)C=C1O 4143 [1,1,0,0,0,0|1,0,0]=3 2045 B9R1.69 OC1=CC=C(F)N=C1Br 36086 [1,1,0,0,0,0|2,0,0]=4 2046 B9R1.69 OC1=CC=C(F)N=C1F 22312 [1,1,0,0,0,0|2,0,0]=4 2047 B9R1.69 OC1=NC=C(Br)C=C1Br 6448 [1,1,0,0,0,0|2,0,0]=4 2048 B9R1.69 OC1=NC=C(Br)C=C1I 26900 [1,1,0,0,0,0|2,0,0]=4 2049 B9R1.69 OC1=NC=C(Cl)C=C1Br 6524 [1,1,0,0,0,0|2,0,0]=4 2050 B9R1.69 OC1=NC=C(Cl)C=C1Cl 6510 [1,1,0,0,0,0|2,0,0]=4 2051 B9R1.69 OC1=NC=C(Cl)C=C1F 6542 [1,1,0,0,0,0|2,0,0]=4 2052 B9R1.69 OC1=NC=C(F)C=C1Br 14287 [1,1,0,0,0,0|2,0,0]=4 2053 B9R1.69 OC1=NC=C(F)C=C1I 23345 [1,1,0,0,0,0|2,0,0]=4 2054 B9R1.69 SC1=C(Cl)C=C(Cl)C=C1 6798 [1,1,0,0,0,0|1,1,0]=4 2055 B9R1.69 SC1=C(Cl)C=CC(Cl)=C1 6801 [1,1,0,0,0,0|1,1,0]=4 2056 B9R1.69 SC1=CC(Cl)=C(Cl)C=C1 6803 [1,1,0,0,0,0|2,0,0]=4 2057 B9R1.14 COC1=C(C=O)OC=C1 31930 [0,1,0,0,1,0|1,0,1]=4 2058 B9R1.14 COC1=C(C=O)SC=C1 35392 [0,1,0,0,1,0|1,0,1]=4 2059 B9R1.14 COC1=CSC=C1OC 15752 [0,1,0,0,1,0|1,0,0]=3 2060 B9R1.27 CCC1=C(C)NC=C1C 29942 [0,1,0,0,1,0|2,0,0]=4 2061 B9R1.33 CCOC1=C(C)N=CO1 8651 [0,1,0,0,1,0|2,0,0]=4 2062 B9R1.41 CC(=O)C1=C(C)C=CS1 5186 [0,1,0,0,1,0|2,0,0]=4 2063 B9R1.41 CC(=O)C1=CC=CN1C 27052 [0,1,0,0,1,0|2,0,0]=4 2064 B9R1.41 CC(=O)C1=CNC=C1C 22818 [0,1,0,0,1,0|2,0,0]=4 2065 B11R1.8 CC1=C(C#N)C=C(F)C=C1F 8342 [0,2,0,0,0,0|2,0,0]=4 2066 B11R1.8 COC1=C(C)C(C)=CC(C)=C1 2688 [0,2,0,0,0,0|0,0,0]=2 2067 B11R1.8 COC1=C(F)C(F)=CC(Br)=C1 14832 [0,2,0,0,0,0|1,0,0]=3 2068 B11R1.8 COC1=C(N)C(C)=CC(Br)=C1 19713 [0,2,0,0,0,0|1,0,0]=3 2069 B11R1.13 CC1=C(CC#N)C=CC=C1Br 31542 [0,2,0,0,0,0|1,0,1]=4 2070 B11R1.13 CC1=C(CC#N)C=CC=C1I 31546 [0,2,0,0,0,0|1,0,1]=4 2071 B11R1.13 CC1=C(Cl)C=CC=C1N=C=S 10477 [0,2,0,0,0,0|1,0,1]=4 2072 B11R1.13 CC1=C(N=C=O)C=CC=C1Cl 27293 [0,2,0,0,0,0|1,0,1]=4 2073 B11R1.13 CC1=CC=CC(CC#N)=C1C 10639 [0,2,0,0,0,0|1,0,1]=4 2074 B11R1.13 CCOC1=C(F)C(F)=CC=C1 2326 [0,2,0,0,0,0|1,0,0]=3 2075 B11R1.13 CCOC1=CC=CC(Br)=C1I 19689 [0,2,0,0,0,0|1,0,0]=3 2076 B11R1.13 OCCC1=C(Cl)C(Cl)=CC=C1 31585 [0,2,0,0,0,0|2,0,0]=4 2077 B11R1.72 CC1=C(C#N)C(F)=CC=C1Br 30838 [0,2,0,0,0,0|2,0,0]=4 2078 B11R1.72 COC1=C(Br)C=CC(F)=C1F 34206 [0,2,0,0,0,0|1,0,0]=3 2079 B11R1.72 COC1=C(Cl)C(C)=CC=C1F 8449 [0,2,0,0,0,0|1,0,0]=3 2080 B11R1.72 COC1=C(Cl)C(F)=CC=C1F 8440 [0,2,0,0,0,0|1,0,0]=3 2081 B11R1.72 COC1=C(F)C(C)=CC=C1Cl 8450 [0,2,0,0,0,0|1,0,0]=3 2082 B11R1.72 COC1=C(F)C(C)=CC=C1F 7145 [0,2,0,0,0,0|1,0,0]=3 2083 B11R1.72 COC1=C(F)C(Cl)=CC=C1F 8441 [0,2,0,0,0,0|1,0,0]=3 2084 B11R1.72 COC1=C(F)C(F)=CC=C1F 1965 [0,2,0,0,0,0|1,0,0]=3 2085 B11R1.72 COC1=C(F)C(F)=CC=C1N 28341 [0,2,0,0,0,0|1,0,0]=3 2086 B11R1.72 COC1=C(O)C(F)=CC=C1Br 33736 [0,2,0,0,0,0|1,0,0]=3 2087 B11R1.159 CC(=O)C1=C(C)C(Br)=CC=C1 31204 [0,2,0,0,0,0|1,0,0]=3 2088 B11R1.159 CC(=O)C1=C(C)C(C)=CC=C1 19771 [0,2,0,0,0,0|1,0,0]=3 2089 B11R1.159 CC(=O)C1=C(Cl)C(Br)=CC=C1 31198 [0,2,0,0,0,0|2,0,0]=4 2090 B11R1.159 CC(=O)C1=C(Cl)C(Cl)=CC=C1 3368 [0,2,0,0,0,0|2,0,0]=4 2091 B11R1.159 CC(=O)C1=C(Cl)C(F)=CC=C1 31183 [0,2,0,0,0,0|2,0,0]=4 2092 B11R1.159 CC(=O)C1=C(F)C(Br)=CC=C1 4095 [0,2,0,0,0,0|2,0,0]=4 2093 B11R1.159 CC(=O)C1=C(F)C(C)=CC=C1 31221 [0,2,0,0,0,0|2,0,0]=4 2094 B11R1.159 CC(=O)C1=C(F)C(Cl)=CC=C1 29140 [0,2,0,0,0,0|2,0,0]=4 2095 B11R1.159 CC(=O)C1=C(F)C(F)=CC=C1 4211 [0,2,0,0,0,0|2,0,0]=4 2096 B11R1.159 CC(=O)C1=C(F)C(O)=CC=C1 33429 [0,2,0,0,0,0|2,0,0]=4 2097 B11R1.159 CC(=O)C1=C(N)C(C)=CC=C1 29253 [0,2,0,0,0,0|2,0,0]=4 2098 B11R1.159 CC(=O)C1=C(N)C(Cl)=CC=C1 29249 [0,2,0,0,0,0|2,0,0]=4 2099 B11R1.159 CC(=O)C1=C(N)C(F)=CC=C1 34667 [0,2,0,0,0,0|2,0,0]=4 2100 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 35768 [0,2,0,0,0,0|2,0,0]=4 2101 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 29262 [0,2,0,0,0,0|2,0,0]=4 2102 B11R1.159 CC(=O)C1=C(O)C(Cl)=CC=C1 31195 [0,2,0,0,0,0|2,0,0]=4 2103 B11R1.159 CC(=O)C1=C(O)C(F)=CC=C1 19786 [0,2,0,0,0,0|2,0,0]=4 2104 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 3281 [0,2,0,0,0,0|2,0,0]=4 2105 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 33767 [0,2,0,0,0,0|2,0,0]=4 2106 B11R1.159 CC(=O)c1cccc(N)c1O 10346 [0,2,0,0,0,0|2,0,0]=4 2107 B11R1.159 CC(C)C1=C(O)C(O)=CC=C1 34649 [0,2,0,0,0,0|2,0,0]=4 2108 B11R1.159 CC(C)C1=CC=CC(Br)=C1O 33834 [0,2,0,0,0,0|2,0,0]=4 2109 B11R1.159 CC(C)C1=CC=CC(Cl)=C1O 28112 [0,2,0,0,0,0|2,0,0]=4 2110 B11R1.159 CC(C)C1=CC=CC(O)=C1F 27792 [0,2,0,0,0,0|2,0,0]=4 2111 B11R1.159 CC1=C(B(O)O)C=CC=C1F 26416 [0,2,0,0,0,0|2,0,0]=4 2112 B11R1.159 CC1=C(Br)C=CC=C1[N+](=O)[O-] 3823 [0,2,0,0,0,0|2,0,0]=4 2113 B11R1.159 CC1=C(C(=O)O)C=CC=C1Br 4717 [0,2,0,0,0,0|2,0,0]=4 2114 B11R1.159 CC1=C(C(=O)O)C=CC=C1Cl 8362 [0,2,0,0,0,0|2,0,0]=4 2115 B11R1.159 CC1=C(C(=O)O)C=CC=C1F 1329 [0,2,0,0,0,0|2,0,0]=4 2116 B11R1.159 CC1=C(C(=O)O)C=CC=C1I 22968 [0,2,0,0,0,0|2,0,0]=4 2117 B11R1.159 CC1=C(C(=O)O)C=CC=C1N 10921 [0,2,0,0,0,0|2,0,0]=4 2118 B11R1.159 CC1=C(C(=O)O)C=CC=C1O 15694 [0,2,0,0,0,0|2,0,0]=4 2119 B11R1.159 CC1=C(Cl)C=CC=C1[N+](=O)[O-] 14277 [0,2,0,0,0,0|2,0,0]=4 2120 B11R1.159 CC1=C(F)C=CC=C1[N+](=O)[O-] 1594 [0,2,0,0,0,0|2,0,0]=4 2121 B11R1.159 CC1=C(N)C=CC=C1[N+](=O)[O-] 4480 [0,2,0,0,0,0|2,0,0]=4 2122 B11R1.159 CC1=C(O)C=CC=C1[N+](=O)[O-] 2030 [0,2,0,0,0,0|2,0,0]=4 2123 B11R1.159 CC1=CC=CC(B(O)O)=C1C 5037 [0,2,0,0,0,0|2,0,0]=4 2124 B11R1.159 CC1=CC=CC(C(=O)Cl)=C1C 28637 [0,2,0,0,0,0|2,0,0]=4 2125 B11R1.159 CC1=CC=CC(C(=O)O)=C1C 2549 [0,2,0,0,0,0|2,0,0]=4 2126 B11R1.159 CC1=CC=CC(C(C)C)=C1N 4031 [0,2,0,0,0,0|2,0,0]=4 2127 B11R1.265 CC1=C(C#N)C(C#N)=CC=C1 17450 [0,2,0,0,0,0|2,0,0]=4 2128 B11R1.265 CC1=CC=CC(C=O)=C1C#N 30981 [0,2,0,0,0,0|2,0,0]=4 2129 B11R1.265 CCC1=C(C#N)C(O)=CC=C1 27793 [0,2,0,0,0,0|1,0,1]=4 2130 B11R1.265 CCC1=C(C=O)C(O)=CC=C1 27796 [0,2,0,0,0,0|1,0,1]=4 2131 B11R1.265 COC1=C(C#N)C(=O)NC=C1 12986 [0,2,0,0,0,0|1,0,1]=4 2132 B11R1.265 COC1=C(C#N)C(C)=CC=C1 30778 [0,2,0,0,0,0|0,0,1]=3 2133 B11R1.265 COC1=C(C#N)C=CC=C1Br 30807 [0,2,0,0,0,0|0,0,1]=3 2134 B11R1.265 COC1=C(C#N)C=CC=C1F 25287 [0,2,0,0,0,0|0,0,1]=3 2135 B11R1.265 COC1=C(C#N)C=CC=C1O 27945 [0,2,0,0,0,0|0,0,1]=3 2136 B11R1.265 COC1=C(C=O)C(Br)=CC=N1 27959 [0,2,0,0,0,0|1,0,1]=4 2137 B11R1.265 COC1=C(C=O)C(C)=CC=C1 34133 [0,2,0,0,0,0|0,0,1]=3 2138 B11R1.265 COC1=C(C=O)C(Cl)=CC=N1 35811 [0,2,0,0,0,0|1,0,1]=4 2139 B11R1.265 COC1=C(C=O)C(I)=CC=N1 19522 [0,2,0,0,0,0|1,0,1]=4 2140 B11R1.265 COC1=C(C=O)C(O)=CC=C1 8210 [0,2,0,0,0,0|0,0,1]=3 2141 B11R1.265 COC1=C(C=O)C=CC=C1C 30962 [0,2,0,0,0,0|0,0,0]=2 2142 B11R1.265 COC1=C(C=O)C=CC=C1Cl 28396 [0,2,0,0,0,0|0,0,1]=3 2143 B11R1.265 COC1=C(C=O)C=CC=C1F 1446 [0,2,0,0,0,0|0,0,1]=3 2144 B11R1.265 COC1=C(C=O)C=CN=C1Br 26878 [0,2,0,0,0,0|1,0,1]=4 2145 B11R1.265 COC1=C(OC)C(N)=NC=N1 13331 [0,2,0,0,0,0|2,0,0]=4 2146 B11R1.265 COC1=CC=CC(Br)=C1C#N 30770 [0,2,0,0,0,0|0,0,1]=3 2147 B11R1.265 COC1=CC=CC(Cl)=C1C#N 33423 [0,2,0,0,0,0|0,0,1]=3 2148 B11R1.265 COC1=CC=CC(Cl)=C1C=O 30889 [0,2,0,0,0,0|0,0,1]=3 2149 B11R1.265 COC1=CC=CC(F)=C1C#N 10117 [0,2,0,0,0,0|0,0,1]=3 2150 B11R1.265 COC1=CC=CC(F)=C1C=O 8486 [0,2,0,0,0,0|0,0,1]=3 2151 B11R1.265 COC1=CC=CC(F)=C1CBr 31344 [0,2,0,0,0,0|0,0,0]=2 2152 B11R1.265 COC1=CC=CC(F)=C1CN 4421 [0,2,0,0,0,0|0,0,0]=2 2153 B11R1.265 COC1=CC=CC(F)=C1OC 28467 [0,2,0,0,0,0|0,0,0]=2 2154 B11R1.265 COC1=CC=CC(O)=C1OC 28109 [0,2,0,0,0,0|0,0,0]=2 2155 B11R1.265 COC1=CC=NC(Cl)=C1C#N 23455 [0,2,0,0,0,0|1,0,1]=4 2156 B11R1.265 COC1=CC=NC(N)=C1C#N 9629 [0,2,0,0,0,0|1,0,1]=4 2157 B11R1.265 COC1=CN=CC(Br)=C1C=O 27699 [0,2,0,0,0,0|1,0,1]=4 2158 B11R1.265 COC1=CN=CC(N)=C1C#N 16548 [0,2,0,0,0,0|1,0,1]=4 2159 B11R1.265 COC1=NC=CC(I)=C1OC 26917 [0,2,0,0,0,0|1,0,0]=3 2160 B11R1.265 CSC1=CC=CC(Cl)=C1C=O 27636 [0,2,0,0,0,0|0,1,1]=4 2161 B11R1.265 N#CC1=C(CBr)C(Br)=CC=C1 31272 [0,2,0,0,0,0|2,0,0]=4 2162 B11R1.265 N#CC1=C(CBr)C(F)=CC=C1 31273 [0,2,0,0,0,0|2,0,0]=4 2163 B11R1.265 N#CC1=C(CBr)C=CC=C1F 31314 [0,2,0,0,0,0|2,0,0]=4 2164 B11R1.265 N#Cc1cccc(Cl)c1CBr 24724 [0,2,0,0,0,0|2,0,0]=4 2165 B11R1.267 CC1=C(C=O)C=CC=C1C#N 30984 [0,2,0,0,0,0|2,0,0]=4 2166 B11R1.267 CCC1=CC=CC(CC)=C1Br 33409 [0,2,0,0,0,0|2,0,0]=4 2167 B11R1.267 COC1=C(C)C(CCl)=NC=C1 22658 [0,2,0,0,0,0|1,0,0]=3 2168 B11R1.267 COC1=CC=CC(C#N)=C1F 4782 [0,2,0,0,0,0|1,0,0]=3 2169 B11R1.267 COC1=CC=CC(C#N)=C1I 33270 [0,2,0,0,0,0|1,0,0]=3 2170 B11R1.267 COC1=CC=CC(C#N)=C1N 19797 [0,2,0,0,0,0|1,0,0]=3 2171 B11R1.267 COC1=CC=CC(C#N)=C1O 19922 [0,2,0,0,0,0|1,0,0]=3 2172 B11R1.267 COC1=CC=CC(C=O)=C1F 4224 [0,2,0,0,0,0|1,0,0]=3 2173 B11R1.267 COC1=CC=CC(CO)=C1F 16855 [0,2,0,0,0,0|1,0,0]=3 2174 B11R1.267 COC1=CC=CC(CO)=C1O 10255 [0,2,0,0,0,0|1,0,0]=3 2175 B11R1.267 COC1=CC=CC(OC)=C1Br 25397 [0,2,0,0,0,0|1,0,0]=3 2176 B11R1.267 COC1=CC=CC(OC)=C1C 4545 [0,2,0,0,0,0|0,0,0]=2 2177 B11R1.267 COC1=CC=CC(OC)=C1Cl 4405 [0,2,0,0,0,0|1,0,0]=3 2178 B11R1.267 COC1=CC=CC(OC)=C1N 4419 [0,2,0,0,0,0|1,0,0]=3 2179 B11R1.267 COC1=CC=CC(OC)=C1O 10985 [0,2,0,0,0,0|1,0,0]=3 2180 B11R1.267 COC1=CN=CC(OC)=C1N 34187 [0,2,0,0,0,0|2,0,0]=4 2181 B11R1.267 COC1=NC=CC(C#N)=C1F 34654 [0,2,0,0,0,0|2,0,0]=4 2182 B11R1.267 COC1=NC=CC(C=O)=C1Cl 17167 [0,2,0,0,0,0|2,0,0]=4 2183 B11R1.267 COc1cccc(C=O)c1C 30950 [0,2,0,0,0,0|0,0,0]=2 2184 B11R1.267 COc1ccnc(CO)c1C 21118 [0,2,0,0,0,0|1,0,0]=3 2185 B11R1.278 CC1=C(C#N)C=CC(F)=C1F 4769 [0,2,0,0,0,0|2,0,0]=4 2186 B11R1.278 CC1=C(C=O)C=CC(F)=C1F 28156 [0,2,0,0,0,0|2,0,0]=4 2187 B11R1.278 CC1=C(F)C(C)=C(C=O)C=C1 16353 [0,2,0,0,0,0|2,0,0]=4 2188 B11R1.278 COC1=C(Br)C(F)=C(F)C=C1 28353 [0,2,0,0,0,0|1,0,0]=3 2189 B11R1.278 COC1=C(C)C(C)=C(I)C=C1 31149 [0,2,0,0,0,0|0,0,0]=2 2190 B11R1.278 COC1=C(F)C(F)=C(Br)C=C1 10081 [0,2,0,0,0,0|1,0,0]=3 2191 B11R1.278 COC1=C(F)C(F)=C(C)C=C1 7139 [0,2,0,0,0,0|1,0,0]=3 2192 B11R1.278 COC1=C(F)C(F)=C(F)C=C1 28390 [0,2,0,0,0,0|1,0,0]=3 2193 B11R1.17 CCCOC1=C(O)C=CC=C1 13203 [0,2,0,0,0,0|1,0,0]=3 2194 B11R1.17 CCCOC1=NC=CC=C1I 31888 [0,2,0,0,0,0|2,0,0]=4 2195 B11R1.17 CCCOC1=NC=CC=C1N 31889 [0,2,0,0,0,0|2,0,0]=4 2196 B11R1.17 FC1=C(OCCBr)C=CC=C1 16330 [0,2,0,0,0,0|1,0,0]=3 2197 B11R1.17 NCCOC1=C(F)C=CC=C1 19159 [0,2,0,0,0,0|1,0,0]=3 2198 B11R1.17 O=CCCC1=C(Cl)C=CC=C1 24068 [0,2,0,0,0,0|2,0,0]=4 2199 B11R1.17 O=CCCC1=C(F)C=CC=C1 31588 [0,2,0,0,0,0|2,0,0]=4 2200 B11R1.41 CCOC1=C(C#N)C=CC=C1 4773 [0,2,0,0,0,0|0,0,1]=3 2201 B11R1.41 CCOC1=C(C=O)C=CC=C1 9726 [0,2,0,0,0,0|0,0,1]=3 2202 B11R1.41 CCOC1=C(CN)C=CC=C1 7400 [0,2,0,0,0,0|0,0,0]=2 2203 B11R1.41 CCOC1=C(OC)C=CC=C1 3067 [0,2,0,0,0,0|0,0,0]=2 2204 B11R1.41 CCOC1=CC=NC=C1C=O 34477 [0,2,0,0,0,0|1,0,1]=4 2205 B11R1.41 COC1=C(CC=O)C=CC=C1 17222 [0,2,0,0,0,0|0,0,0]=2 2206 B11R1.41 COC1=C(CCN)C=CC=C1 23973 [0,2,0,0,0,0|0,0,0]=2 2207 B11R1.41 COC1=C(CCO)C=CC=C1 24377 [0,2,0,0,0,0|0,0,0]=2 2208 B11R1.41 O=CC1=C(CCBr)C=CC=C1 19638 [0,2,0,0,0,0|1,0,1]=4 2209 B11R1.81 CC1=C(CC#N)C=CC(Br)=C1 31471 [0,2,0,0,0,0|1,0,1]=4 2210 B11R1.81 CC1=C(CC#N)C=CC(F)=C1 31533 [0,2,0,0,0,0|1,0,1]=4 2211 B11R1.81 CCCC1=C(O)C=C(O)C=C1 25562 [0,2,0,0,0,0|2,0,0]=4 2212 B11R1.81 CCOC1=C(C)N=C(N)C=C1 34422 [0,2,0,0,0,0|1,0,0]=3 2213 B11R1.81 CCOC1=C(Cl)C=C(Cl)C=C1 9513 [0,2,0,0,0,0|1,0,0]=3 2214 B11R1.81 CCOC1=C(Cl)C=C(F)C=C1 3155 [0,2,0,0,0,0|1,0,0]=3 2215 B11R1.81 CCOC1=C(F)C=C(Cl)C=C1 3163 [0,2,0,0,0,0|1,0,0]=3 2216 B11R1.81 CCOC1=C(N)C=C(N)C=C1 3168 [0,2,0,0,0,0|1,0,0]=3 2217 B11R1.81 CCOC1=NC=C(Br)C=C1Br 6231 [0,2,0,0,0,0|2,0,0]=4 2218 B11R1.81 CCOC1=NC=C(Br)C=C1I 26897 [0,2,0,0,0,0|2,0,0]=4 2219 B11R1.81 CNCC1=C(Cl)C=C(Cl)C=C1 22904 [0,2,0,0,0,0|2,0,0]=4 2220 B11R1.81 COCC1=C(N)C=C(Br)C=C1 31052 [0,2,0,0,0,0|1,0,0]=3 2221 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 31586 [0,2,0,0,0,0|2,0,0]=4 2222 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 23388 [0,2,0,0,0,0|2,0,0]=4 2223 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 28140 [0,2,0,0,0,0|2,0,0]=4 2224 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 28149 [0,2,0,0,0,0|2,0,0]=4 2225 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 3830 [0,2,0,0,0,0|2,0,0]=4 2226 B11R1.86 CC(=O)OC1=C(Br)C=CC=C1 3055 [0,2,0,0,0,0|1,0,0]=3 2227 B11R1.86 CC(=O)OC1=C(F)C=CC=C1 3059 [0,2,0,0,0,0|1,0,0]=3 2228 B11R1.86 CC(=O)OC1=C(I)C=CC=C1 3062 [0,2,0,0,0,0|1,0,0]=3 2229 B11R1.86 CC(C)OC1=C(Br)C=CC=C1 3828 [0,2,0,0,0,0|1,0,0]=3 2230 B11R1.86 CC(C)OC1=C(O)C=CC=C1 13205 [0,2,0,0,0,0|1,0,0]=3 2231 B11R1.86 CC(C)OC1=NC=CC=C1Br 6576 [0,2,0,0,0,0|2,0,0]=4 2232 B11R1.86 CC(C)OC1=NC=CC=C1I 16561 [0,2,0,0,0,0|2,0,0]=4 2233 B11R1.86 CC(C)SC1=C(N)C=CC=C1 31985 [0,2,0,0,0,0|1,1,0]=4 2234 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 20124 [0,2,0,0,0,0|1,0,1]=4 2235 B11R1.86 CC1=C(CC(N)=O)C=CC=C1 17571 [0,2,0,0,0,0|1,0,1]=4 2236 B11R1.86 FC(F)OC1=C(Br)C=CC=C1 25489 [0,2,0,0,0,0|1,0,0]=3 2237 B11R1.86 NC1=C(OC(F)F)C=CC=C1 8465 [0,2,0,0,0,0|1,0,0]=3 2238 B11R1.182 CC1=C(CC#N)C=C(Br)C=C1 31474 [0,2,0,0,0,0|1,0,1]=4 2239 B11R1.182 CC1=C(CC#N)C=C(F)C=C1 4176 [0,2,0,0,0,0|1,0,1]=4 2240 B11R1.182 CC1=CC(CC#N)=C(C)C=C1 21905 [0,2,0,0,0,0|1,0,1]=4 2241 B11R1.182 CCOC1=C(Br)C=CC(N)=C1 1919 [0,2,0,0,0,0|1,0,0]=3 2242 B11R1.182 CCOC1=C(Cl)C=CC(F)=C1 3157 [0,2,0,0,0,0|1,0,0]=3 2243 B11R1.182 CCOC1=C(F)C=CC(Cl)=C1 3166 [0,2,0,0,0,0|1,0,0]=3 2244 B11R1.222 CCC(=O)C1=C(F)C=CC=C1 19917 [0,2,0,0,0,0|2,0,0]=4 2245 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 21422 [0,2,0,0,0,0|2,0,0]=4 2246 B11R1.222 CCC(C)C1=C(N)C=CC=C1 28284 [0,2,0,0,0,0|2,0,0]=4 2247 B11R1.222 CCC(O)C1=C(F)C=CC=C1 19915 [0,2,0,0,0,0|2,0,0]=4 2248 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 3956 [0,2,0,0,0,0|1,0,0]=3 2249 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 17290 [0,2,0,0,0,0|2,0,0]=4 2250 B11R1.222 COC(=O)C1=C(C)N=CC=C1 2218 [0,2,0,0,0,0|1,0,0]=3 2251 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 3707 [0,2,0,0,0,0|1,0,0]=3 2252 B11R1.222 COC(=O)C1=C(Cl)N=CC=C1 15917 [0,2,0,0,0,0|2,0,0]=4 2253 B11R1.222 COC(=O)C1=C(F)C=CC=C1 3565 [0,2,0,0,0,0|1,0,0]=3 2254 B11R1.222 COC(=O)C1=C(F)N=CC=C1 10628 [0,2,0,0,0,0|2,0,0]=4 2255 B11R1.222 COC(=O)C1=C(I)C=CC=C1 10568 [0,2,0,0,0,0|1,0,0]=3 2256 B11R1.222 COC(=O)C1=C(N)C=NC=C1 9599 [0,2,0,0,0,0|2,0,0]=4 2257 B11R1.222 COC(=O)C1=C(N)C=NC=C1 9760 [0,2,0,0,0,0|2,0,0]=4 2258 B11R1.222 COC(=O)C1=C(N)N=CC=C1 16778 [0,2,0,0,0,0|2,0,0]=4 2259 B11R1.222 COC(=O)C1=CC=CC=C1C 15492 [0,2,0,0,0,0|0,0,0]=2 2260 B11R1.222 COC(=O)C1=CC=CC=C1N 13629 [0,2,0,0,0,0|1,0,0]=3 2261 B11R1.222 COC(=O)C1=CC=CC=C1S 10565 [0,2,0,0,0,0|1,0,0]=3 2262 B11R1.222 COC(=O)C1=CC=CN=C1Br 14383 [0,2,0,0,0,0|2,0,0]=4 2263 B11R1.222 COC(=O)C1=CC=CNC1=O 19579 [0,2,0,0,0,0|2,0,0]=4 2264 B11R1.222 COC(=O)C1=CN=CC=C1C 21351 [0,2,0,0,0,0|1,0,0]=3 2265 B11R1.222 COC(=O)C1=CN=CC=C1N 25347 [0,2,0,0,0,0|2,0,0]=4 2266 B11R1.222 COC(=O)C1=NC=CC=C1Cl 32244 [0,2,0,0,0,0|2,0,0]=4 2267 B11R1.222 COC(=O)C1=NC=CC=C1O 25563 [0,2,0,0,0,0|2,0,0]=4 2268 B11R1.222 NC1=C(C(=O)CBr)C=CC=C1 29244 [0,2,0,0,0,0|2,0,0]=4 2269 B11R1.222 NCC(=O)C1=C(Cl)C=CC=C1 29248 [0,2,0,0,0,0|2,0,0]=4 2270 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 29130 [0,2,0,0,0,0|2,0,0]=4 2271 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 19367 [0,2,0,0,0,0|2,0,0]=4 2272 B11R1.222 NC[C@@H](O)C1=C(Cl)C=CC=C1 19368 [0,2,0,0,0,0|2,0,0]=4 2273 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 16835 [0,2,0,0,0,0|2,0,0]=4 2274 B11R1.222 O=C(CBr)c1ccccc1Cl 11080 [0,2,0,0,0,0|2,0,0]=4 2275 B11R1.222 OC[C@@H](O)C1=C(Cl)C=CC=C1 16150 [0,2,0,0,0,0|2,0,0]=4 2276 B11R1.605 CC1=CC=CC(C)=C1CC#N 12533 [0,2,0,0,0,0|1,0,1]=4 2277 B11R1.605 CCCC1=C(O)C=CC=C1O 19795 [0,2,0,0,0,0|2,0,0]=4 2278 B11R1.37 BrCc1ccc(Br)cc1CBr 31349 [0,2,0,0,0,0|2,0,0]=4 2279 B11R1.37 C#CC1=C(OC)C=C(O)C=C1 45209 [0,2,0,0,0,0|0,0,1]=3 2280 B11R1.37 CCC1=C(C=O)C=C(Br)C=C1 30974 [0,2,0,0,0,0|1,0,1]=4 2281 B11R1.37 CCC1=C(C=O)C=CC(O)=C1 28097 [0,2,0,0,0,0|1,0,1]=4 2282 B11R1.37 COC1=C(C#N)C=C(Br)C=C1 33822 [0,2,0,0,0,0|0,0,1]=3 2283 B11R1.37 COC1=C(C#N)C=C(Br)C=N1 22053 [0,2,0,0,0,0|1,0,1]=4 2284 B11R1.37 COC1=C(C#N)C=C(Cl)C=C1 3662 [0,2,0,0,0,0|0,0,1]=3 2285 B11R1.37 COC1=C(C#N)C=C(F)C=C1 3502 [0,2,0,0,0,0|0,0,1]=3 2286 B11R1.37 COC1=C(C#N)C=C(I)C=C1 8166 [0,2,0,0,0,0|0,0,1]=3 2287 B11R1.37 COC1=C(C#N)C=CC(Br)=C1 12802 [0,2,0,0,0,0|0,0,1]=3 2288 B11R1.37 COC1=C(C#N)C=CC(C)=C1 28757 [0,2,0,0,0,0|0,0,1]=3 2289 B11R1.37 COC1=C(C#N)C=CC(F)=C1 4786 [0,2,0,0,0,0|0,0,1]=3 2290 B11R1.37 COC1=C(C#N)C=CC(O)=C1 27703 [0,2,0,0,0,0|0,0,1]=3 2291 B11R1.37 COC1=C(C=O)C=C(Br)C=C1 2644 [0,2,0,0,0,0|0,0,1]=3 2292 B11R1.37 COC1=C(C=O)C=C(Cl)C=C1 2639 [0,2,0,0,0,0|0,0,1]=3 2293 B11R1.37 COC1=C(C=O)C=C(Cl)C=N1 26870 [0,2,0,0,0,0|1,0,1]=4 2294 B11R1.37 COC1=C(C=O)C=C(F)C=C1 2636 [0,2,0,0,0,0|0,0,1]=3 2295 B11R1.37 COC1=C(C=O)C=C(F)C=N1 16100 [0,2,0,0,0,0|1,0,1]=4 2296 B11R1.37 COC1=C(C=O)C=CC(Br)=C1 30906 [0,2,0,0,0,0|0,0,1]=3 2297 B11R1.37 COC1=C(C=O)C=CC(C)=C1 18122 [0,2,0,0,0,0|0,0,1]=3 2298 B11R1.37 COC1=C(C=O)C=CC(Cl)=C1 28397 [0,2,0,0,0,0|0,0,1]=3 2299 B11R1.37 COC1=C(C=O)C=CC(F)=C1 2635 [0,2,0,0,0,0|0,0,1]=3 2300 B11R1.37 COC1=C(C=O)C=CC(F)=N1 27961 [0,2,0,0,0,0|1,0,1]=4 2301 B11R1.37 COC1=C(C=O)C=CC(O)=C1 8130 [0,2,0,0,0,0|0,0,1]=3 2302 B11R1.37 COC1=C(CBr)C=C(F)C=C1 4924 [0,2,0,0,0,0|0,0,0]=2 2303 B11R1.37 COC1=C(CBr)C=CC(Br)=C1 31309 [0,2,0,0,0,0|0,0,0]=2 2304 B11R1.37 COC1=C(CBr)C=CC(F)=C1 31307 [0,2,0,0,0,0|0,0,0]=2 2305 B11R1.37 COC1=C(CN)C=CC(F)=C1 31244 [0,2,0,0,0,0|0,0,0]=2 2306 B11R1.37 COC1=C(CO)C=C(Br)C=C1 4888 [0,2,0,0,0,0|0,0,0]=2 2307 B11R1.37 COC1=C(CO)C=C(F)C=C1 27472 [0,2,0,0,0,0|0,0,0]=2 2308 B11R1.37 COC1=C(CO)C=CC(F)=C1 31306 [0,2,0,0,0,0|0,0,0]=2 2309 B11R1.37 COC1=C(NN)C=C(Cl)C=C1 4473 [0,2,0,0,0,0|1,0,0]=3 2310 B11R1.37 COC1=C(NN)C=CC(Cl)=C1 34865 [0,2,0,0,0,0|1,0,0]=3 2311 B11R1.37 COC1=C(OC)C=C(Br)C=C1 3037 [0,2,0,0,0,0|0,0,0]=2 2312 B11R1.37 COC1=C(OC)C=C(C)C=C1 23595 [0,2,0,0,0,0|0,0,0]=2 2313 B11R1.37 COC1=C(OC)C=C(Cl)C=C1 25469 [0,2,0,0,0,0|0,0,0]=2 2314 B11R1.37 COC1=C(OC)C=C(I)C=C1 3052 [0,2,0,0,0,0|0,0,0]=2 2315 B11R1.37 COC1=C(OC)C=C(N)C=C1 22907 [0,2,0,0,0,0|0,0,0]=2 2316 B11R1.37 COC1=C(OC)C=C(O)C=C1 4113 [0,2,0,0,0,0|0,0,0]=2 2317 B11R1.37 COC1=C(OC)C=C(S)C=C1 6823 [0,2,0,0,0,0|0,0,0]=2 2318 B11R1.37 COC1=CC(Br)=CN=C1C#N 16550 [0,2,0,0,0,0|1,0,1]=4 2319 B11R1.37 COC1=CC(Cl)=CN=C1OC 26919 [0,2,0,0,0,0|1,0,0]=3 2320 B11R1.37 COC1=CC=C(F)C=C1OC 3048 [0,2,0,0,0,0|0,0,0]=2 2321 B11R1.37 COC1=NC=C(Br)C=C1C=O 9207 [0,2,0,0,0,0|1,0,1]=4 2322 B11R1.37 COC1=NC=C(Br)C=C1CO 34518 [0,2,0,0,0,0|1,0,0]=3 2323 B11R1.37 COC1=NC=C(Cl)C=C1CO 26862 [0,2,0,0,0,0|1,0,0]=3 2324 B11R1.37 COC1=NC=C(F)C=C1C#N 35983 [0,2,0,0,0,0|1,0,1]=4 2325 B11R1.37 N#CC1=C(CBr)C=C(F)C=C1 4906 [0,2,0,0,0,0|2,0,0]=4 2326 B11R1.37 N#CC1=C(CBr)C=CC(F)=C1 31271 [0,2,0,0,0,0|2,0,0]=4 2327 B11R1.37 N#CC1=C(CCl)C=C(F)C=C1 31342 [0,2,0,0,0,0|2,0,0]=4 2328 B11R1.37 N#CC1=C(CO)C=C(F)C=C1 27452 [0,2,0,0,0,0|2,0,0]=4 2329 B11R1.37 OCC1=CC=C(F)C=C1CO 2198 [0,2,0,0,0,0|2,0,0]=4 2330 B11R1.53 CC(=O)C1=C(C#N)C=CC=C1 19789 [0,2,0,0,0,0|1,0,1]=4 2331 B11R1.53 CC(C)C1=C(C=O)C=CC=C1 27833 [0,2,0,0,0,0|1,0,1]=4 2332 B11R1.53 CCC1=C(B(O)O)C=CC=C1 14050 [0,2,0,0,0,0|2,0,0]=4 2333 B11R1.53 CCC1=C(C(=O)O)C=CC=C1 9869 [0,2,0,0,0,0|1,0,1]=4 2334 B11R1.53 COC1=C(B(O)O)C=CC=C1 1865 [0,2,0,0,0,0|1,0,0]=3 2335 B11R1.53 COC1=C(B(O)O)C=CN=C1 23549 [0,2,0,0,0,0|2,0,0]=4 2336 B11R1.53 COC1=C(B(O)O)C=NC=C1 34816 [0,2,0,0,0,0|2,0,0]=4 2337 B11R1.53 COC1=C(B(O)O)C=NC=C1 6432 [0,2,0,0,0,0|2,0,0]=4 2338 B11R1.53 COC1=C(C(=O)O)C=CC=C1 18488 [0,2,0,0,0,0|0,0,1]=3 2339 B11R1.53 COC1=C(C(=O)O)C=CC=N1 20354 [0,2,0,0,0,0|1,0,1]=4 2340 B11R1.53 COC1=C(C(=O)O)C=CN=C1 10457 [0,2,0,0,0,0|1,0,1]=4 2341 B11R1.53 COC1=C(C(C)=O)C=CC=C1 4278 [0,2,0,0,0,0|0,0,0]=2 2342 B11R1.53 COC1=C(C(C)=O)C=NC=C1 33637 [0,2,0,0,0,0|1,0,0]=3 2343 B11R1.53 COC1=C(C(C)O)C=CC=C1 25006 [0,2,0,0,0,0|0,0,0]=2 2344 B11R1.53 COC1=C(C(N)=S)C=CC=C1 35098 [0,2,0,0,0,0|0,0,1]=3 2345 B11R1.53 COC1=C([C@@H](C)N)C=CC=C1 24748 [0,2,0,0,0,0|0,0,0]=2 2346 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 24747 [0,2,0,0,0,0|0,0,0]=2 2347 B11R1.53 COC1=C([N+](=O)[O-])C=CC=C1 9645 [0,2,0,0,0,0|1,0,0]=3 2348 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 14990 [0,2,0,0,0,0|2,0,0]=4 2349 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 6689 [0,2,0,0,0,0|2,0,0]=4 2350 B11R1.53 COC1=CC=CC=C1C(=O)Cl 26362 [0,2,0,0,0,0|0,0,1]=3 2351 B11R1.53 COC1=CC=CN=C1B(O)O 24108 [0,2,0,0,0,0|2,0,0]=4 2352 B11R1.53 COC1=CC=CN=C1[N+](=O)[O-] 3990 [0,2,0,0,0,0|2,0,0]=4 2353 B11R1.53 COC1=CC=NC=C1C(=O)O 33397 [0,2,0,0,0,0|1,0,1]=4 2354 B11R1.53 COC1=NC=CC=C1B(O)O 5046 [0,2,0,0,0,0|2,0,0]=4 2355 B11R1.53 COC1=NC=CC=C1C(C)=O 27866 [0,2,0,0,0,0|1,0,0]=3 2356 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] 6593 [0,2,0,0,0,0|2,0,0]=4 2357 B11R1.53 COC1=NC=CN=C1C(C)C 8619 [0,2,0,0,0,0|2,0,0]=4 2358 B11R1.53 CSC1=C(C(=O)O)C=CC=C1 10324 [0,2,0,0,0,0|0,1,1]=4 2359 B11R1.53 CSC1=C([N+](=O)[O-])C=CC=C1 2110 [0,2,0,0,0,0|1,1,0]=4 2360 B11R1.53 N#CC1=C(C(F)F)C=CC=C1 30772 [0,2,0,0,0,0|2,0,0]=4 2361 B11R1.53 O=C(O)c1ccccc1CBr 23937 [0,2,0,0,0,0|2,0,0]=4 2362 B11R1.53 O=[N+]([O-])C1=C(CBr)C=CC=C1 7493 [0,2,0,0,0,0|2,0,0]=4 2363 B11R1.53 O=[N+]([O-])C1=C(CO)C=CC=C1 7474 [0,2,0,0,0,0|2,0,0]=4 2364 B11R1.53 OB(O)C1=C(CBr)C=CC=C1 7781 [0,2,0,0,0,0|2,0,0]=4 2365 B11R1.53 OCC1=C(B(O)O)C=CC=C1 1724 [0,2,0,0,0,0|2,0,0]=4 2366 B11R1.53 OCC1=C(B(O)O)C=CC=C1 5079 [0,2,0,0,0,0|2,0,0]=4 2367 B11R1.166 CC(=O)C1=C(Br)C=C(Br)C=C1 29275 [0,2,0,0,0,0|2,0,0]=4 2368 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 29258 [0,2,0,0,0,0|2,0,0]=4 2369 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=C1 8533 [0,2,0,0,0,0|2,0,0]=4 2370 B11R1.166 CC(=O)C1=C(Br)C=C(N)C=C1 28228 [0,2,0,0,0,0|2,0,0]=4 2371 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 29261 [0,2,0,0,0,0|2,0,0]=4 2372 B11R1.166 CC(=O)C1=C(C)C=C(Br)C=C1 31226 [0,2,0,0,0,0|1,0,0]=3 2373 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 3376 [0,2,0,0,0,0|1,0,0]=3 2374 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 29273 [0,2,0,0,0,0|1,0,0]=3 2375 B11R1.166 CC(=O)C1=C(C)C=C(O)C=C1 24792 [0,2,0,0,0,0|1,0,0]=3 2376 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 3265 [0,2,0,0,0,0|2,0,0]=4 2377 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 13619 [0,2,0,0,0,0|2,0,0]=4 2378 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 4187 [0,2,0,0,0,0|2,0,0]=4 2379 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 28238 [0,2,0,0,0,0|2,0,0]=4 2380 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 29270 [0,2,0,0,0,0|2,0,0]=4 2381 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 24789 [0,2,0,0,0,0|2,0,0]=4 2382 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 4207 [0,2,0,0,0,0|2,0,0]=4 2383 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 4213 [0,2,0,0,0,0|2,0,0]=4 2384 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 24419 [0,2,0,0,0,0|2,0,0]=4 2385 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 36301 [0,2,0,0,0,0|2,0,0]=4 2386 B11R1.166 CC(=O)C1=C(N)C=C(F)C=C1 27374 [0,2,0,0,0,0|2,0,0]=4 2387 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 19929 [0,2,0,0,0,0|2,0,0]=4 2388 B11R1.166 CC(=O)C1=C(O)C=C(C)C=C1 16935 [0,2,0,0,0,0|2,0,0]=4 2389 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 29061 [0,2,0,0,0,0|2,0,0]=4 2390 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 13252 [0,2,0,0,0,0|2,0,0]=4 2391 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 28229 [0,2,0,0,0,0|2,0,0]=4 2392 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 3375 [0,2,0,0,0,0|2,0,0]=4 2393 B11R1.166 CC(C)C1=C(O)C=C(O)C=C1 35906 [0,2,0,0,0,0|2,0,0]=4 2394 B11R1.166 CC1=C(B(O)O)C=CC(Cl)=C1 29614 [0,2,0,0,0,0|2,0,0]=4 2395 B11R1.166 CC1=C(B(O)O)C=CC(F)=C1 1852 [0,2,0,0,0,0|2,0,0]=4 2396 B11R1.166 CC1=C(B(O)O)C=CC(O)=C1 29621 [0,2,0,0,0,0|2,0,0]=4 2397 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 4029 [0,2,0,0,0,0|2,0,0]=4 2398 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 4570 [0,2,0,0,0,0|2,0,0]=4 2399 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 1327 [0,2,0,0,0,0|2,0,0]=4 2400 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 10924 [0,2,0,0,0,0|2,0,0]=4 2401 B11R1.166 CC1=C(N(C)C)C=CC(Br)=C1 5343 [0,2,0,0,0,0|1,0,0]=3 2402 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Br)=C1 31561 [0,2,0,0,0,0|2,0,0]=4 2403 B11R1.166 CC1=C([N+](=O)[O-])C=CC(F)=C1 1598 [0,2,0,0,0,0|2,0,0]=4 2404 B11R1.166 CC1=C([N+](=O)[O-])C=CC(N)=C1 12456 [0,2,0,0,0,0|2,0,0]=4 2405 B11R1.166 CC1=CC(Br)=C(N(C)C)C=C1 5342 [0,2,0,0,0,0|2,0,0]=4 2406 B11R1.166 CC1=CC(C)=C(B(O)O)C=C1 9565 [0,2,0,0,0,0|2,0,0]=4 2407 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 15441 [0,2,0,0,0,0|2,0,0]=4 2408 B11R1.166 CC1=CC(C)=C(C(F)F)C=C1 28468 [0,2,0,0,0,0|2,0,0]=4 2409 B11R1.166 CC1=CC(O)=CC=C1[N+](=O)[O-] 21648 [0,2,0,0,0,0|2,0,0]=4 2410 B11R1.166 CN(C)C1=C(Br)C=C(F)C=C1 5227 [0,2,0,0,0,0|2,0,0]=4 2411 B11R1.166 CN(C)C1=C(Cl)C=C(Br)C=C1 5366 [0,2,0,0,0,0|2,0,0]=4 2412 B11R1.166 CN(C)C1=C(Cl)C=C(F)C=C1 5235 [0,2,0,0,0,0|2,0,0]=4 2413 B11R1.166 CN(C)C1=C(F)C=C(Br)C=C1 5229 [0,2,0,0,0,0|2,0,0]=4 2414 B11R1.166 CN(C)C1=C(F)C=C(Cl)C=C1 5236 [0,2,0,0,0,0|2,0,0]=4 2415 B11R1.166 CN(C)C1=C(F)C=C(F)C=C1 5240 [0,2,0,0,0,0|2,0,0]=4 2416 B11R1.166 C[C@H](O)C1=C(Cl)C=C(F)C=C1 15575 [0,2,0,0,0,0|2,0,0]=4 2417 B11R1.277 CC1=C(C#N)C=C(F)C(Br)=C1 28719 [0,2,0,0,0,0|2,0,0]=4 2418 B11R1.277 CC1=C(C#N)C=C(F)C(F)=C1 8343 [0,2,0,0,0,0|2,0,0]=4 2419 B11R1.277 CC1=C(C=O)C=C(F)C(Br)=C1 2102 [0,2,0,0,0,0|2,0,0]=4 2420 B11R1.277 CC1=CC(C)=C(C=O)C=C1C 16351 [0,2,0,0,0,0|2,0,0]=4 2421 B11R1.277 CC1=CC(C=O)=C(C)C=C1Cl 27575 [0,2,0,0,0,0|2,0,0]=4 2422 B11R1.277 CC1=CC(C=O)=C(C)C=C1O 22697 [0,2,0,0,0,0|2,0,0]=4 2423 B11R1.277 COC1=C(Br)C=C(F)C(F)=C1 5223 [0,2,0,0,0,0|1,0,0]=3 2424 B11R1.277 COC1=C(Cl)C=C(F)C(Br)=C1 4557 [0,2,0,0,0,0|1,0,0]=3 2425 B11R1.277 COC1=C(F)C=C(Br)C(C)=N1 15216 [0,2,0,0,0,0|2,0,0]=4 2426 B11R1.277 COC1=C(F)C=C(Br)C(F)=C1 2653 [0,2,0,0,0,0|1,0,0]=3 2427 B11R1.277 COC1=C(I)N=C(I)C(Br)=C1 27237 [0,2,0,0,0,0|2,0,0]=4 2428 B11R1.277 COC1=C(O)C=C(Br)C(Cl)=C1 34577 [0,2,0,0,0,0|1,0,0]=3 2429 B11R1.277 COC1=C(O)C=C(F)C(Br)=C1 28355 [0,2,0,0,0,0|1,0,0]=3 2430 B11R1.277 COC1=CC(Br)=C(Cl)C=C1N 16224 [0,2,0,0,0,0|1,0,0]=3 2431 B11R1.277 COC1=CC(C)=C(N)C=C1C 31055 [0,2,0,0,0,0|0,0,0]=2 2432 B11R1.277 COC1=CC(N)=C(Br)C=C1C 31046 [0,2,0,0,0,0|0,0,0]=2 2433 B11R1.277 COC1=CC(N)=C(Cl)C=C1Cl 4393 [0,2,0,0,0,0|1,0,0]=3 2434 B11R1.277 COC1=CC(N)=C(F)C=C1F 10078 [0,2,0,0,0,0|1,0,0]=3 2435 B11R1.277 Cc1cc(C#N)c(C)cc1O 30763 [0,2,0,0,0,0|2,0,0]=4 2436 B11R1.279 CC1=C(C#N)C=CC(C=O)=C1 30973 [0,2,0,0,0,0|2,0,0]=4 2437 B11R1.279 COC1=C(Br)C=C(C#N)C=C1 3795 [0,2,0,0,0,0|1,0,0]=3 2438 B11R1.279 COC1=C(Br)C=C(C=O)C=C1 2643 [0,2,0,0,0,0|1,0,0]=3 2439 B11R1.279 COC1=C(Br)N=C(CO)C=C1 26737 [0,2,0,0,0,0|2,0,0]=4 2440 B11R1.279 COC1=C(C)C=C(C=O)C=C1 14879 [0,2,0,0,0,0|0,0,0]=2 2441 B11R1.279 COC1=C(C)C=C(CO)C=C1 24130 [0,2,0,0,0,0|0,0,0]=2 2442 B11R1.279 COC1=C(Cl)C=C(C#N)C=C1 3661 [0,2,0,0,0,0|1,0,0]=3 2443 B11R1.279 COC1=C(Cl)C=C(C=O)C=C1 2638 [0,2,0,0,0,0|1,0,0]=3 2444 B11R1.279 COC1=C(Cl)C=C(CBr)C=C1 31299 [0,2,0,0,0,0|1,0,0]=3 2445 B11R1.279 COC1=C(Cl)C=C(NN)C=C1 35436 [0,2,0,0,0,0|1,0,0]=3 2446 B11R1.279 COC1=C(F)C=C(C#N)C=C1 18462 [0,2,0,0,0,0|1,0,0]=3 2447 B11R1.279 COC1=C(F)C=C(C=O)C=C1 1448 [0,2,0,0,0,0|1,0,0]=3 2448 B11R1.279 COC1=C(F)C=C(CBr)C=C1 4923 [0,2,0,0,0,0|1,0,0]=3 2449 B11R1.279 COC1=C(N)C=C(C=O)C=C1 19765 [0,2,0,0,0,0|1,0,0]=3 2450 B11R1.279 COC1=C(O)C=C(C#N)C=C1 4806 [0,2,0,0,0,0|1,0,0]=3 2451 B11R1.279 COC1=C(O)C=C(C=O)C=C1 7770 [0,2,0,0,0,0|1,0,0]=3 2452 B11R1.279 COC1=C(O)C=C(CO)C=C1 15050 [0,2,0,0,0,0|1,0,0]=3 2453 B11R1.279 COC1=CC(Br)=C(OC)C=C1 19785 [0,2,0,0,0,0|1,0,0]=3 2454 B11R1.279 COC1=CC(C)=C(C#N)C=C1 25451 [0,2,0,0,0,0|2,0,0]=4 2455 B11R1.279 COC1=CC(C)=C(C=O)C=C1 30912 [0,2,0,0,0,0|2,0,0]=4 2456 B11R1.279 COC1=CC(C)=C(OC)C=C1 4543 [0,2,0,0,0,0|0,0,0]=2 2457 B11R1.279 COC1=CC(F)=C(OC)C=C1 3050 [0,2,0,0,0,0|1,0,0]=3 2458 B11R1.279 COC1=CC(N)=C(OC)C=C1 25396 [0,2,0,0,0,0|1,0,0]=3 2459 B11R1.279 COC1=CC(O)=C(OC)C=C1 27372 [0,2,0,0,0,0|1,0,0]=3 2460 B11R1.279 COC1=CC(S)=C(OC)C=C1 6852 [0,2,0,0,0,0|1,0,0]=3 2461 B11R1.279 COC1=NC=C(C=O)C=C1Cl 17090 [0,2,0,0,0,0|2,0,0]=4 2462 B11R1.279 COc1ccc(CN)cc1F 31259 [0,2,0,0,0,0|1,0,0]=3 2463 B11R1.464 CC1=CC(Br)=CC(C)=C1C#N 25874 [0,2,0,0,0,0|2,0,0]=4 2464 B11R1.464 CC1=CC(Br)=CC(C)=C1CO 24281 [0,2,0,0,0,0|2,0,0]=4 2465 B11R1.464 CC1=CC(C)=C(C=O)C(C)=C1 3071 [0,2,0,0,0,0|2,0,0]=4 2466 B11R1.464 CC1=CC(C)=C(CBr)C(C)=C1 22050 [0,2,0,0,0,0|2,0,0]=4 2467 B11R1.464 CC1=CC(C)=C(CCl)C(C)=C1 7456 [0,2,0,0,0,0|2,0,0]=4 2468 B11R1.464 CC1=CC(C)=C(CN)C(C)=C1 7408 [0,2,0,0,0,0|2,0,0]=4 2469 B11R1.464 CC1=CC(C)=C(CO)C(C)=C1 7455 [0,2,0,0,0,0|2,0,0]=4 2470 B11R1.464 CC1=CC(F)=CC(Br)=C1C#N 4710 [0,2,0,0,0,0|2,0,0]=4 2471 B11R1.464 CC1=CC(F)=CC(Br)=C1C=O 1424 [0,2,0,0,0,0|2,0,0]=4 2472 B11R1.464 CC1=CC(F)=CC(Br)=C1CO 31318 [0,2,0,0,0,0|2,0,0]=4 2473 B11R1.464 CC1=CC(F)=CC(C)=C1C#N 30764 [0,2,0,0,0,0|2,0,0]=4 2474 B11R1.464 CC1=CC(F)=CC(C)=C1C=O 16359 [0,2,0,0,0,0|2,0,0]=4 2475 B11R1.464 CC1=CC(O)=C(C=O)C(C)=C1 28415 [0,2,0,0,0,0|2,0,0]=4 2476 B11R1.464 CC1=CC(O)=CC(C)=C1C#N 30818 [0,2,0,0,0,0|2,0,0]=4 2477 B11R1.464 CC1=CC(O)=CC(C)=C1C=O 3148 [0,2,0,0,0,0|2,0,0]=4 2478 B11R1.464 COC1=C(Br)C=C(Br)C=C1F 5237 [0,2,0,0,0,0|1,0,0]=3 2479 B11R1.464 COC1=C(Br)C=C(F)C=C1Br 2656 [0,2,0,0,0,0|1,0,0]=3 2480 B11R1.464 COC1=C(Br)C=C(F)C=C1F 2633 [0,2,0,0,0,0|1,0,0]=3 2481 B11R1.464 COC1=C(Br)C=C(N)C=C1F 15255 [0,2,0,0,0,0|1,0,0]=3 2482 B11R1.464 COC1=C(C)C=C(Br)C=C1C 2654 [0,2,0,0,0,0|0,0,0]=2 2483 B11R1.464 COC1=C(C)C=C(C)C=C1C 28391 [0,2,0,0,0,0|0,0,0]=2 2484 B11R1.464 COC1=C(C)C=C(Cl)C=C1C 2657 [0,2,0,0,0,0|0,0,0]=2 2485 B11R1.464 COC1=C(Cl)C=C(Br)C=C1F 8360 [0,2,0,0,0,0|1,0,0]=3 2486 B11R1.464 COC1=C(F)C=C(Br)C=C1F 8361 [0,2,0,0,0,0|1,0,0]=3 2487 B11R1.464 COC1=C(F)C=C(Cl)C=C1F 28361 [0,2,0,0,0,0|1,0,0]=3 2488 B11R1.464 COC1=C(F)C=C(F)C=C1F 7163 [0,2,0,0,0,0|1,0,0]=3 2489 B11R1.464 COC1=C(F)C=C(N)C=C1F 10104 [0,2,0,0,0,0|1,0,0]=3 2490 B11R1.464 COC1=C(N)C=C(Br)C=C1F 34228 [0,2,0,0,0,0|1,0,0]=3 2491 B11R1.464 COC1=C(O)C=C(F)C=C1F 33435 [0,2,0,0,0,0|1,0,0]=3 2492 B11R1.464 COc1c(Br)c[n+]([O-])cc1Br 6614 [0,2,0,0,0,0|2,0,0]=4 2493 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 23873 [0,2,0,0,0,0|2,0,0]=4 2494 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 3214 [0,2,0,0,0,0|2,0,0]=4 2495 B11R1.167 CC(=O)C1=C(Cl)C=CC(Br)=C1 29260 [0,2,0,0,0,0|2,0,0]=4 2496 B11R1.167 CC(=O)C1=C(Cl)C=CC(Cl)=C1 10586 [0,2,0,0,0,0|2,0,0]=4 2497 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 4193 [0,2,0,0,0,0|2,0,0]=4 2498 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=C1 16430 [0,2,0,0,0,0|2,0,0]=4 2499 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 4237 [0,2,0,0,0,0|2,0,0]=4 2500 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 8394 [0,2,0,0,0,0|2,0,0]=4 2501 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 29131 [0,2,0,0,0,0|2,0,0]=4 2502 B11R1.167 CC(=O)C1=C(F)C=CC(O)=C1 29152 [0,2,0,0,0,0|2,0,0]=4 2503 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 15742 [0,2,0,0,0,0|2,0,0]=4 2504 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 15829 [0,2,0,0,0,0|2,0,0]=4 2505 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 26324 [0,2,0,0,0,0|2,0,0]=4 2506 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 33711 [0,2,0,0,0,0|2,0,0]=4 2507 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 3913 [0,2,0,0,0,0|2,0,0]=4 2508 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 16936 [0,2,0,0,0,0|2,0,0]=4 2509 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 3353 [0,2,0,0,0,0|2,0,0]=4 2510 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 3356 [0,2,0,0,0,0|2,0,0]=4 2511 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 17597 [0,2,0,0,0,0|2,0,0]=4 2512 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 3377 [0,2,0,0,0,0|2,0,0]=4 2513 B11R1.167 CC(C)C1=C(O)C=CC(Br)=C1 34492 [0,2,0,0,0,0|2,0,0]=4 2514 B11R1.167 CC(C)C1=C(O)C=CC(Cl)=C1 27613 [0,2,0,0,0,0|2,0,0]=4 2515 B11R1.167 CC(O)C1=C(F)C=CC(Br)=C1 20348 [0,2,0,0,0,0|2,0,0]=4 2516 B11R1.167 CC1=C(B(O)O)C=C(Cl)C=C1 7912 [0,2,0,0,0,0|2,0,0]=4 2517 B11R1.167 CC1=C(B(O)O)C=C(F)C=C1 1853 [0,2,0,0,0,0|2,0,0]=4 2518 B11R1.167 CC1=C(C(=O)Cl)C=C(F)C=C1 31959 [0,2,0,0,0,0|2,0,0]=4 2519 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 4728 [0,2,0,0,0,0|2,0,0]=4 2520 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 4578 [0,2,0,0,0,0|2,0,0]=4 2521 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 1326 [0,2,0,0,0,0|2,0,0]=4 2522 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 4520 [0,2,0,0,0,0|2,0,0]=4 2523 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 4980 [0,2,0,0,0,0|2,0,0]=4 2524 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 25813 [0,2,0,0,0,0|2,0,0]=4 2525 B11R1.167 CC1=C(C(C)C)C=C(Br)C=C1 34618 [0,2,0,0,0,0|1,0,0]=3 2526 B11R1.167 CC1=C(C(N)=O)C=C(F)C=C1 26344 [0,2,0,0,0,0|2,0,0]=4 2527 B11R1.167 CC1=C([N+](=O)[O-])C=C(Br)C=C1 10403 [0,2,0,0,0,0|2,0,0]=4 2528 B11R1.167 CC1=C([N+](=O)[O-])C=C(Cl)C=C1 18919 [0,2,0,0,0,0|2,0,0]=4 2529 B11R1.167 CC1=C([N+](=O)[O-])C=C(F)C=C1 1596 [0,2,0,0,0,0|2,0,0]=4 2530 B11R1.167 CC1=C([N+](=O)[O-])C=C(I)C=C1 15938 [0,2,0,0,0,0|2,0,0]=4 2531 B11R1.167 CC1=C([N+](=O)[O-])C=C(N)C=C1 14491 [0,2,0,0,0,0|2,0,0]=4 2532 B11R1.167 CC1=C([N+](=O)[O-])C=C(O)C=C1 1480 [0,2,0,0,0,0|2,0,0]=4 2533 B11R1.167 CC1=CC(B(O)O)=C(C)C=C1 1831 [0,2,0,0,0,0|2,0,0]=4 2534 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 28638 [0,2,0,0,0,0|2,0,0]=4 2535 B11R1.167 CC1=CC([N+](=O)[O-])=C(C)C=C1 25914 [0,2,0,0,0,0|2,0,0]=4 2536 B11R1.280 CCC1=C(Cl)C=CC(OC)=C1 5282 [0,2,0,0,0,0|2,0,0]=4 2537 B11R1.280 CCC1=C(F)C=CC(C#N)=C1 28744 [0,2,0,0,0,0|2,0,0]=4 2538 B11R1.280 CCC1=C(N)C=CC(C#N)=C1 16098 [0,2,0,0,0,0|2,0,0]=4 2539 B11R1.280 CCC1=C(N)C=CC(C#N)=C1 21039 [0,2,0,0,0,0|2,0,0]=4 2540 B11R1.280 CCC1=C(O)C=CC(C=O)=C1 28101 [0,2,0,0,0,0|2,0,0]=4 2541 B11R1.280 CCC1=CC(OC)=C(Cl)C=C1 5280 [0,2,0,0,0,0|1,0,0]=3 2542 B11R1.280 COC1=C(Br)C=CC(C#N)=C1 28722 [0,2,0,0,0,0|1,0,0]=3 2543 B11R1.280 COC1=C(Br)C=CC(C=O)=C1 30968 [0,2,0,0,0,0|1,0,0]=3 2544 B11R1.280 COC1=C(Br)C=CC(CO)=C1 31324 [0,2,0,0,0,0|1,0,0]=3 2545 B11R1.280 COC1=C(C)C=CC(C#N)=C1 28758 [0,2,0,0,0,0|0,0,0]=2 2546 B11R1.280 COC1=C(C)C=CC(C=O)=C1 2646 [0,2,0,0,0,0|0,0,0]=2 2547 B11R1.280 COC1=C(Cl)C=CC(C#N)=C1 18681 [0,2,0,0,0,0|1,0,0]=3 2548 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 30916 [0,2,0,0,0,0|1,0,0]=3 2549 B11R1.280 COC1=C(F)C=CC(C#N)=C1 3501 [0,2,0,0,0,0|1,0,0]=3 2550 B11R1.280 COC1=C(F)C=CC(C=O)=C1 1449 [0,2,0,0,0,0|1,0,0]=3 2551 B11R1.280 COC1=C(F)C=CC(CBr)=C1 27471 [0,2,0,0,0,0|1,0,0]=3 2552 B11R1.280 COC1=C(F)C=CC(CN)=C1 27537 [0,2,0,0,0,0|1,0,0]=3 2553 B11R1.280 COC1=C(F)C=CC(CO)=C1 7734 [0,2,0,0,0,0|1,0,0]=3 2554 B11R1.280 COC1=C(O)C=CC(C#N)=C1 13112 [0,2,0,0,0,0|1,0,0]=3 2555 B11R1.280 COC1=C(O)C=CC(C=O)=C1 25440 [0,2,0,0,0,0|1,0,0]=3 2556 B11R1.280 COC1=C(O)C=CC(CN)=C1 7385 [0,2,0,0,0,0|1,0,0]=3 2557 B11R1.280 COC1=CC(C=O)=C(C)C=C1 28421 [0,2,0,0,0,0|2,0,0]=4 2558 B11R1.280 COC1=CC(OC)=C(Br)C=C1 3036 [0,2,0,0,0,0|1,0,0]=3 2559 B11R1.280 COC1=CC(OC)=C(Cl)C=C1 3041 [0,2,0,0,0,0|1,0,0]=3 2560 B11R1.280 COC1=CC(OC)=C(F)C=C1 28466 [0,2,0,0,0,0|1,0,0]=3 2561 B11R1.280 COC1=CC(OC)=C(I)C=C1 3053 [0,2,0,0,0,0|1,0,0]=3 2562 B11R1.280 COC1=CC(OC)=C(N)C=C1 16639 [0,2,0,0,0,0|1,0,0]=3 2563 B11R1.280 COC1=CC(OC)=C(S)C=C1 6882 [0,2,0,0,0,0|1,0,0]=3 2564 B11R1.87 CC(C)(C)C1=C(N)C=CC=C1 20188 [0,2,0,0,0,0|2,0,0]=4 2565 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 18555 [0,2,0,0,0,0|2,0,0]=4 2566 B11R1.87 CC1=C(C(C)(C)C)C=CC=C1 27429 [0,2,0,0,0,0|1,0,0]=3 2567 B11R1.87 CC1=C(C(F)(F)F)C=CC=C1 1657 [0,2,0,0,0,0|2,0,0]=4 2568 B11R1.87 CC1=C(S(N)(=O)=O)C=CC=C1 10087 [0,2,0,0,0,0|1,1,0]=4 2569 B11R1.87 CC1=C([B-](F)(F)F)C=CC=C1 11432 [0,2,0,0,0,0|2,0,0]=4 2570 B11R1.87 CC1=CC=CN=C1S(C)(=O)=O 6577 [0,2,0,0,0,0|1,1,0]=4 2571 B11R1.87 CS(=O)(=O)C1=C(Br)C=CC=C1 16799 [0,2,0,0,0,0|1,1,0]=4 2572 B11R1.87 CS(=O)(=O)C1=C(Cl)C=CC=C1 10825 [0,2,0,0,0,0|1,1,0]=4 2573 B11R1.87 CS(=O)(=O)C1=C(F)C=CC=C1 10824 [0,2,0,0,0,0|1,1,0]=4 2574 B11R1.156 CC(=O)C1=C(Br)C=CC=C1Cl 31211 [0,2,0,0,0,0|2,0,0]=4 2575 B11R1.156 CC(=O)C1=C(Br)C=CC=C1F 31193 [0,2,0,0,0,0|2,0,0]=4 2576 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O 24613 [0,2,0,0,0,0|2,0,0]=4 2577 B11R1.156 CC(=O)C1=C(C)C=CC=C1C 31230 [0,2,0,0,0,0|1,0,0]=3 2578 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1Cl 12362 [0,2,0,0,0,0|2,0,0]=4 2579 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1F 7110 [0,2,0,0,0,0|2,0,0]=4 2580 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1O 31212 [0,2,0,0,0,0|2,0,0]=4 2581 B11R1.156 CC(=O)C1=C(F)C=CC=C1C 31223 [0,2,0,0,0,0|1,0,0]=3 2582 B11R1.156 CC(=O)C1=C(F)C=CC=C1F 4218 [0,2,0,0,0,0|2,0,0]=4 2583 B11R1.156 CC(=O)C1=C(O)C=CC=C1C 31224 [0,2,0,0,0,0|1,0,0]=3 2584 B11R1.156 CC(=O)C1=C(O)C=CC=C1O 3378 [0,2,0,0,0,0|2,0,0]=4 2585 B11R1.156 CC(=O)c1c(O)cccc1F 28251 [0,2,0,0,0,0|2,0,0]=4 2586 B11R1.156 CC(C)C1=C(O)C=CC=C1N 27651 [0,2,0,0,0,0|2,0,0]=4 2587 B11R1.156 CC1=C([N+](=O)[O-])C(Br)=CC=C1 15574 [0,2,0,0,0,0|2,0,0]=4 2588 B11R1.156 CC1=C([N+](=O)[O-])C(Cl)=CC=C1 2090 [0,2,0,0,0,0|2,0,0]=4 2589 B11R1.156 CC1=C([N+](=O)[O-])C(F)=CC=C1 18581 [0,2,0,0,0,0|2,0,0]=4 2590 B11R1.156 CC1=CC=CC(Br)=C1C(=O)O 4715 [0,2,0,0,0,0|2,0,0]=4 2591 B11R1.156 CC1=CC=CC(C)=C1B(O)O 16357 [0,2,0,0,0,0|2,0,0]=4 2592 B11R1.156 CC1=CC=CC(C)=C1C(=O)O 4951 [0,2,0,0,0,0|2,0,0]=4 2593 B11R1.156 CC1=CC=CC(Cl)=C1C(=O)O 4568 [0,2,0,0,0,0|2,0,0]=4 2594 B11R1.156 CC1=CC=CC(F)=C1B(O)O 34153 [0,2,0,0,0,0|2,0,0]=4 2595 B11R1.156 CC1=CC=CC(F)=C1C(=O)Cl 28655 [0,2,0,0,0,0|2,0,0]=4 2596 B11R1.156 CC1=CC=CC(F)=C1C(=O)O 1331 [0,2,0,0,0,0|2,0,0]=4 2597 B11R1.156 CC1=CC=CC(F)=C1C(N)=O 31753 [0,2,0,0,0,0|2,0,0]=4 2598 B11R1.156 CC1=CC=CC(N)=C1C(=O)O 4957 [0,2,0,0,0,0|2,0,0]=4 2599 B11R1.156 CC1=CC=CC(N)=C1[N+](=O)[O-] 19692 [0,2,0,0,0,0|2,0,0]=4 2600 B11R1.156 CC1=CC=CC(O)=C1C(=O)O 19633 [0,2,0,0,0,0|2,0,0]=4 2601 B11R1.156 CC1=CC=CC(O)=C1[N+](=O)[O-] 11255 [0,2,0,0,0,0|2,0,0]=4 2602 B9R1.11 COC(=O)C1=CC=CN1 9141 [0,0,1,1,0,0|2,0,0]=4 2603 B9R1.11 COC(=O)C1=CC=CO1 7090 [0,0,1,1,0,0|2,0,0]=4 2604 B9R1.11 COC(=O)C1=CC=CS1 19955 [0,0,1,1,0,0|2,0,0]=4 2605 B9R2.50 C1=CC=C2CCC2=C1 18889 [1,0,0,1,0,0|1,0,0]=3 2606 B11R2.106 BrC1=C2CCCC2=CC=C1 26432 [0,1,0,1,0,0|1,0,0]=3 2607 B11R2.106 BrC1=C2CCNC2=CC=C1 27757 [0,1,0,1,0,0|1,0,0]=3 2608 B11R2.106 BrC1=C2CNCC2=CC=C1 14849 [0,1,0,1,0,0|2,0,0]=4 2609 B11R2.106 BrC1=C2CNCC2=CC=C1 34251 [0,1,0,1,0,0|2,0,0]=4 2610 B11R2.106 BrC1=CC=CC2=C1C=CO2 32457 [0,1,0,1,0,0|0,0,2]=4 2611 B11R2.106 BrC1=CC=CC2=C1OC=C2 27867 [0,1,0,1,0,0|0,0,2]=4 2612 B11R2.106 BrC1=CC=CC2=C1OCC2 34424 [0,1,0,1,0,0|0,0,0]=2 2613 B11R2.106 BrC1=CC=CC2=C1OCO2 32045 [0,1,0,1,0,0|1,0,0]=3 2614 B11R2.106 CC1=C2C=CNC2=CC=C1 7233 [0,1,0,1,0,0|1,0,1]=4 2615 B11R2.106 CC1=C2NC=CC2=CC=C1 7243 [0,1,0,1,0,0|1,0,1]=4 2616 B11R2.106 CC1=C2NCCC2=CC=C1 8319 [0,1,0,1,0,0|1,0,0]=3 2617 B11R2.106 CC1=CC=CC2=C1C=CS2 27877 [0,1,0,1,0,0|1,0,1]=4 2618 B11R2.106 CC1=CC=CC2=C1OC=C2 28017 [0,1,0,1,0,0|0,0,1]=3 2619 B11R2.106 CC1=CC=CC2=C1SC=C2 32444 [0,1,0,1,0,0|0,1,1]=4 2620 B11R2.106 ClC1=C2CC=CC2=CC=C1 5384 [0,1,0,1,0,0|1,0,1]=4 2621 B11R2.106 ClC1=C2CCCC2=NC=C1 26170 [0,1,0,1,0,0|2,0,0]=4 2622 B11R2.106 ClC1=C2CCNC2=CC=C1 7324 [0,1,0,1,0,0|1,0,0]=3 2623 B11R2.106 ClC1=C2CNCC2=CC=C1 18080 [0,1,0,1,0,0|2,0,0]=4 2624 B11R2.106 ClC1=C2CNCC2=CC=C1 18082 [0,1,0,1,0,0|2,0,0]=4 2625 B11R2.106 ClC1=CC=CC2=C1C=CO2 10451 [0,1,0,1,0,0|0,0,2]=4 2626 B11R2.106 ClC1=CC=CC2=C1OC=C2 28022 [0,1,0,1,0,0|0,0,2]=4 2627 B11R2.106 ClC1=NC=CC2=C1CCN2 15464 [0,1,0,1,0,0|2,0,0]=4 2628 B11R2.106 FC1=C2CCNC2=CC=C1 16911 [0,1,0,1,0,0|1,0,0]=3 2629 B11R2.106 FC1=CC=CC2=C1C=CO2 15663 [0,1,0,1,0,0|0,0,2]=4 2630 B11R2.106 FC1=CC=CC2=C1OC=C2 28023 [0,1,0,1,0,0|0,0,2]=4 2631 B11R2.106 Fc1cccc2c1CNC2 17379 [0,1,0,1,0,0|2,0,0]=4 2632 B11R2.106 NC1=C2N=COC2=CC=C1 27744 [0,1,0,1,0,0|1,0,1]=4 2633 B11R2.106 NC1=C2OCOC2=CC=C1 35364 [0,1,0,1,0,0|1,0,0]=3 2634 B11R2.106 NC1=CC=CC2=C1CCN2 25090 [0,1,0,1,0,0|1,0,0]=3 2635 B11R2.106 NC1=CC=CC2=C1CNC2 18061 [0,1,0,1,0,0|2,0,0]=4 2636 B11R2.106 NC1=CC=CC2=C1CNC2 22063 [0,1,0,1,0,0|2,0,0]=4 2637 B11R2.106 NC1=CC=CC2=C1CNC2 33256 [0,1,0,1,0,0|2,0,0]=4 2638 B11R2.106 OC1=C2N=COC2=CC=C1 34840 [0,1,0,1,0,0|1,0,1]=4 2639 B11R2.106 OC1=CC=CC2=C1C=CO2 28011 [0,1,0,1,0,0|0,0,2]=4 2640 B11R2.106 OC1=CC=CC2=C1CCC2 24129 [0,1,0,1,0,0|1,0,0]=3 2641 B11R2.106 OC1=CC=CC2=C1CCN2 25096 [0,1,0,1,0,0|1,0,0]=3 2642 B11R2.106 OC1=CC=CC2=C1CNC2 17684 [0,1,0,1,0,0|2,0,0]=4 2643 B11R2.106 OC1=CC=CC2=C1CNC2 24314 [0,1,0,1,0,0|2,0,0]=4 2644 B11R2.106 OC1=CC=CC2=C1OC=C2 32455 [0,1,0,1,0,0|0,0,2]=4 2645 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 13460 [0,1,0,1,0,0|0,0,2]=4 2646 B11R2.10 BrC1=CC2=CC=CC=C2C1 9657 [0,1,0,1,0,0|1,0,1]=4 2647 B11R2.10 BrC1=NC2=C(C=CC=C2)O1 33485 [0,1,0,1,0,0|1,0,1]=4 2648 B11R2.10 CC1=CC2=CC=CC=C2C1 5381 [0,1,0,1,0,0|1,0,0]=3 2649 B11R2.10 CC1=CC2=CC=CC=C2N1 7504 [0,1,0,1,0,0|1,0,1]=4 2650 B11R2.10 CC1=NC2=C(C=CC=C2)N1 7540 [0,1,0,1,0,0|2,0,0]=4 2651 B11R2.10 CC1=NC2=C(C=CC=C2)O1 8631 [0,1,0,1,0,0|1,0,0]=3 2652 B11R2.10 CC1=NC2=C(C=CC=C2)S1 10877 [0,1,0,1,0,0|1,1,0]=4 2653 B11R2.10 CC1CC2=CC=CC=C2N1 7439 [0,1,0,1,0,0|1,0,0]=3 2654 B11R2.10 CN1C=C2C=CC=CC2=N1 15667 [0,1,0,1,0,0|1,0,1]=4 2655 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 21885 [0,1,0,1,0,0|1,0,1]=4 2656 B11R2.10 NC1=NC2=C(C=CC=C2)O1 17695 [0,1,0,1,0,0|1,0,1]=4 2657 B11R2.10 NC1CC2=CC=CC=C2C1 12929 [0,1,0,1,0,0|1,0,0]=3 2658 B11R2.10 NN1CC2=CC=CC=C2C1 27745 [0,1,0,1,0,0|2,0,0]=4 2659 B11R2.10 O=C1CC2=C(C=CC=C2)O1 22170 [0,1,0,1,0,0|0,0,1]=3 2660 B11R2.10 O=C1CC2=CC=CC=C2C1 9653 [0,1,0,1,0,0|1,0,1]=4 2661 B11R2.10 O=C1CC2=CC=CC=C2N1 7177 [0,1,0,1,0,0|1,0,1]=4 2662 B11R2.10 O=C1NC2=C(C=CC=C2)O1 8633 [0,1,0,1,0,0|1,0,1]=4 2663 B11R2.10 OC1CC2=CC=CC=C2C1 9652 [0,1,0,1,0,0|1,0,0]=3 2664 B11R2.10 SC1=NC2=C(C=CC=C2)O1 8630 [0,1,0,1,0,0|1,0,1]=4 2665 B11R2.20 C1=CC2=C(C=C1)COCC2 20553 [0,1,0,1,0,0|0,0,0]=2 2666 B11R2.20 C1=CC2=C(C=C1)OCCN2 22677 [0,1,0,1,0,0|0,0,0]=2 2667 B11R2.20 C1=CC2=C(C=C1)OCCO2 9750 [0,1,0,1,0,0|0,0,0]=2 2668 B11R2.20 C1=CC2=C(CCCC2)N=C1 5891 [0,1,0,1,0,0|2,0,0]=4 2669 B11R2.20 C1=CC2=C(CCNC2)N=C1 15462 [0,1,0,1,0,0|2,0,0]=4 2670 B11R2.20 C1=CC2=C(N=C1)NCCO2 18891 [0,1,0,1,0,0|1,0,0]=3 2671 B11R2.20 C1=CC=C2CNCCC2=C1 7253 [0,1,0,1,0,0|1,0,0]=3 2672 B11R2.20 C1=CC=C2NCCCC2=C1 7513 [0,1,0,1,0,0|1,0,0]=3 2673 B11R2.20 C1=CN=C2CCCOC2=C1 27198 [0,1,0,1,0,0|1,0,0]=3 2674 B11R2.20 C1=CN=C2OCCOC2=C1 27263 [0,1,0,1,0,0|1,0,0]=3 2675 B11R2.20 C1=NC=C2CCCNC2=C1 27821 [0,1,0,1,0,0|2,0,0]=4 2676 B11R2.1 BrC1=COC2=C1C=CC=C2 28021 [0,1,0,1,0,0|0,0,2]=4 2677 B11R2.1 CC1=CCC2=CC=CC=C12 15081 [0,1,0,1,0,0|1,0,0]=3 2678 B11R2.1 CC1=CNC2=CC=CC=C12 7505 [0,1,0,1,0,0|1,0,1]=4 2679 B11R2.1 CC1=CSC2=C1C=CC=C2 13547 [0,1,0,1,0,0|0,1,1]=4 2680 B11R2.1 CC1=NNC2=CC=CC=C21 7820 [0,1,0,1,0,0|2,0,0]=4 2681 B11R2.1 CC1C=CC2=CC=CC=C21 15080 [0,1,0,1,0,0|1,0,1]=4 2682 B11R2.1 CC1CNC2=CC=CC=C21 15858 [0,1,0,1,0,0|1,0,0]=3 2683 B11R2.1 CN1C=CC2=CC=CC=C21 7436 [0,1,0,1,0,0|1,0,1]=4 2684 B11R2.1 CN1C=NC2=C1C=CC=C2 7613 [0,1,0,1,0,0|1,0,1]=4 2685 B11R2.1 CN1N=NC2=C1C=CC=C2 28190 [0,1,0,1,0,0|2,0,0]=4 2686 B11R2.1 ClC1=NOC2=C1C=CC=C2 8716 [0,1,0,1,0,0|1,0,1]=4 2687 B11R2.1 NC1=NCc2ccccc21 31698 [0,1,0,1,0,0|2,0,0]=4 2688 B11R2.1 NC1=NOC2=C1C=CC=C2 14511 [0,1,0,1,0,0|1,0,1]=4 2689 B11R2.1 NC1CCC2=CC=CC=C21 10981 [0,1,0,1,0,0|1,0,0]=3 2690 B11R2.1 NC1COC2=NC=CC=C21 34572 [0,1,0,1,0,0|1,0,0]=3 2691 B11R2.1 N[C@@H]1CCC2=CC=CC=C21 21741 [0,1,0,1,0,0|1,0,0]=3 2692 B11R2.1 N[C@H]1CCc2ccccc21 12577 [0,1,0,1,0,0|1,0,0]=3 2693 B11R2.1 N[C@H]1CCc2ccccc21 23853 [0,1,0,1,0,0|1,0,0]=3 2694 B11R2.1 O=C1CCC2=CC=CC=C12 5339 [0,1,0,1,0,0|1,0,0]=3 2695 B11R2.1 O=C1CCc2ncccc21 26187 [0,1,0,1,0,0|2,0,0]=4 2696 B11R2.1 O=C1COC2=C1C=CC=C2 7023 [0,1,0,1,0,0|0,0,1]=3 2697 B11R2.1 O=C1COC2=C1C=NC=C2 24176 [0,1,0,1,0,0|1,0,1]=4 2698 B11R2.1 O=C1COC2=CN=CC=C12 24154 [0,1,0,1,0,0|1,0,1]=4 2699 B11R2.1 O=C1COC2=NC=CC=C12 24153 [0,1,0,1,0,0|1,0,1]=4 2700 B11R2.1 O=C1CSC2=C1C=CC=C2 23797 [0,1,0,1,0,0|0,1,1]=4 2701 B11R2.1 O=C1NCC2=CC=CC=C12 25108 [0,1,0,1,0,0|2,0,0]=4 2702 B11R2.1 O=C1OCC2=CC=CC=C12 22169 [0,1,0,1,0,0|2,0,0]=4 2703 B11R2.1 OC1=NOC2=C1C=CC=C2 27626 [0,1,0,1,0,0|1,0,1]=4 2704 B11R2.36 BrC1=CC2=C(C=C1)CCO2 28031 [0,1,0,1,0,0|0,0,0]=2 2705 B11R2.36 BrC1=CC2=C(C=C1)N=CO2 34235 [0,1,0,1,0,0|1,0,1]=4 2706 B11R2.36 BrC1=CC2=C(C=C1)OC=C2 22017 [0,1,0,1,0,0|0,0,2]=4 2707 B11R2.36 BrC1=CC2=C(C=C1)OC=N2 17145 [0,1,0,1,0,0|1,0,1]=4 2708 B11R2.36 BrC1=CC2=C(C=C1)OCC2 7055 [0,1,0,1,0,0|0,0,0]=2 2709 B11R2.36 BrC1=CC2=C(C=C1)OCO2 3738 [0,1,0,1,0,0|1,0,0]=3 2710 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 28003 [0,1,0,1,0,0|0,0,2]=4 2711 B11R2.36 BrC1=CC=C2CCCC2=C1 34435 [0,1,0,1,0,0|1,0,0]=3 2712 B11R2.36 BrC1=CC=C2CCNC2=C1 22223 [0,1,0,1,0,0|1,0,0]=3 2713 B11R2.36 BrC1=CC=C2CCNC2=C1 8320 [0,1,0,1,0,0|1,0,0]=3 2714 B11R2.36 BrC1=CC=C2CNCC2=C1 12928 [0,1,0,1,0,0|2,0,0]=4 2715 B11R2.36 BrC1=CC=C2CNCC2=C1 18079 [0,1,0,1,0,0|2,0,0]=4 2716 B11R2.36 BrC1=CC=C2NCCC2=C1 7319 [0,1,0,1,0,0|1,0,0]=3 2717 B11R2.36 BrC1=CN=C2NCCC2=C1 15516 [0,1,0,1,0,0|2,0,0]=4 2718 B11R2.36 CC1=CC2=C(C=C1)OC=C2 28016 [0,1,0,1,0,0|0,0,2]=4 2719 B11R2.36 CC1=CC2=C(C=C1)OC=N2 8638 [0,1,0,1,0,0|1,0,1]=4 2720 B11R2.36 CC1=CC=C2CNCC2=C1 33793 [0,1,0,1,0,0|2,0,0]=4 2721 B11R2.36 ClC1=CC2=C(C=C1)OC=C2 28012 [0,1,0,1,0,0|0,0,2]=4 2722 B11R2.36 ClC1=CC2=C(C=C1)OC=N2 8712 [0,1,0,1,0,0|1,0,1]=4 2723 B11R2.36 ClC1=CC2=C(C=C1)OCO2 3620 [0,1,0,1,0,0|1,0,0]=3 2724 B11R2.36 ClC1=CC2=C(C=CO2)C=C1 32456 [0,1,0,1,0,0|0,0,2]=4 2725 B11R2.36 ClC1=CC=C2CNCC2=C1 18083 [0,1,0,1,0,0|2,0,0]=4 2726 B11R2.36 ClC1=CC=C2CNCC2=C1 18084 [0,1,0,1,0,0|2,0,0]=4 2727 B11R2.36 ClC1=CC=C2NCCC2=C1 2112 [0,1,0,1,0,0|1,0,0]=3 2728 B11R2.36 FC1=CC2=C(C=C1)OC=C2 16047 [0,1,0,1,0,0|0,0,2]=4 2729 B11R2.36 FC1=CC2=C(C=C1)OC=N2 21888 [0,1,0,1,0,0|1,0,1]=4 2730 B11R2.36 FC1=CC2=C(C=C1)OCC2 24189 [0,1,0,1,0,0|0,0,0]=2 2731 B11R2.36 FC1=CC=C2CCNC2=C1 34355 [0,1,0,1,0,0|1,0,0]=3 2732 B11R2.36 FC1=CC=C2CNCC2=C1 18062 [0,1,0,1,0,0|2,0,0]=4 2733 B11R2.36 IC1=CC2=C(C=C1)OCC2 27760 [0,1,0,1,0,0|0,0,0]=2 2734 B11R2.36 IC1=CC2=C(C=C1)OCO2 33795 [0,1,0,1,0,0|1,0,0]=3 2735 B11R2.36 NC1=CC2=C(C=C1)C=NO2 24258 [0,1,0,1,0,0|1,0,1]=4 2736 B11R2.36 NC1=CC2=C(C=C1)N=CO2 17704 [0,1,0,1,0,0|1,0,1]=4 2737 B11R2.36 NC1=CC2=C(C=C1)OC=N2 34838 [0,1,0,1,0,0|1,0,1]=4 2738 B11R2.36 NC1=CC2=C(C=C1)OCC2 16462 [0,1,0,1,0,0|0,0,0]=2 2739 B11R2.36 NC1=CC2=C(C=C1)OCC2 20541 [0,1,0,1,0,0|0,0,0]=2 2740 B11R2.36 NC1=CC2=C(C=C1)OCO2 22150 [0,1,0,1,0,0|1,0,0]=3 2741 B11R2.36 NC1=CC=C2CNCC2=C1 18060 [0,1,0,1,0,0|2,0,0]=4 2742 B11R2.36 NC1=CC=C2CNCC2=C1 26253 [0,1,0,1,0,0|2,0,0]=4 2743 B11R2.36 OC1=CC2=C(C=C1)CCO2 32303 [0,1,0,1,0,0|0,0,0]=2 2744 B11R2.36 OC1=CC2=C(C=C1)OC=C2 34267 [0,1,0,1,0,0|0,0,2]=4 2745 B11R2.36 OC1=CC2=C(C=C1)OCO2 15359 [0,1,0,1,0,0|1,0,0]=3 2746 B11R2.36 OC1=CC2=C(C=CO2)C=C1 28025 [0,1,0,1,0,0|0,0,2]=4 2747 B11R2.36 OC1=CC=C2CNCC2=C1 17682 [0,1,0,1,0,0|2,0,0]=4 2748 B11R2.36 SC1=CC2=C(C=C1)OCO2 15612 [0,1,0,1,0,0|1,0,0]=3 2749 B7R1.1 CCC1=CC=CS1 5536 [1,0,0,0,1,0|2,0,0]=4 2750 B7R1.1 CCN1C=CC=C1 35829 [1,0,0,0,1,0|2,0,0]=4 2751 B7R1.1 COC1=CC=CO1 19998 [1,0,0,0,1,0|1,0,0]=3 2752 B7R1.1 COC1=CC=CS1 12545 [1,0,0,0,1,0|1,0,0]=3 2753 B7R1.1 COC1=CSC=C1 8863 [1,0,0,0,1,0|1,0,0]=3 2754 B7R1.4 CC1=C(Br)SC=C1 5191 [1,0,0,0,1,0|2,0,0]=4 2755 B7R1.4 CC1=C(C)NC=N1 18123 [1,0,0,0,1,0|2,0,0]=4 2756 B7R1.4 CC1=C(C)NC=N1 8044 [1,0,0,0,1,0|2,0,0]=4 2757 B7R1.4 CC1=C(C)SC=C1 7751 [1,0,0,0,1,0|1,0,0]=3 2758 B7R1.4 CC1=C(C)SC=N1 9938 [1,0,0,0,1,0|2,0,0]=4 2759 B7R1.4 CC1=C(Cl)SC=C1 5164 [1,0,0,0,1,0|2,0,0]=4 2760 B7R1.4 CC1=C(S)C=CO1 7060 [1,0,0,0,1,0|1,1,0]=4 2761 B7R1.4 CC1=C(S)C=CO1 9968 [1,0,0,0,1,0|1,1,0]=4 2762 B7R1.4 CC1=CC=NN1C 9121 [1,0,0,0,1,0|2,0,0]=4 2763 B7R1.4 CC1=CNN=C1C 36259 [1,0,0,0,1,0|2,0,0]=4 2764 B7R1.4 CC1=COC=C1C 15014 [1,0,0,0,1,0|1,0,0]=3 2765 B7R1.4 CC1=CSC=C1Br 21832 [1,0,0,0,1,0|2,0,0]=4 2766 B7R1.4 CC1=NC=CN1C 15975 [1,0,0,0,1,0|2,0,0]=4 2767 B7R1.4 OC1=C(O)OC=C1 22257 [1,0,0,0,1,0|2,0,0]=4