0 B9R1.1 BrCC1=CC=C(Br)C=C1 7460 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.1 BrCC1=CC=C(I)C=C1 3557 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.1 C#CC1=CC=C(C)C=C1 10922 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.1 C#CC1=CC=C(F)C=C1 16719 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.1 C#CC1=CC=C(I)C=C1 34237 [0,0,0,0,0,0|2,0,1]=3 5 B9R1.1 C#CC1=CC=C(N)C=C1 26130 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.1 C#CC1=NC=C(Br)C=C1 1294 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.1 C=CC1=CC=C(Cl)C=C1 12659 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.1 C=CC1=CC=C(N)C=C1 12625 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.1 C=CC1=CC=C(N)C=N1 26083 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.1 C=CC1=CN=C(Br)C=C1 27635 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.1 C=CC1=CN=C(C)C=C1 15153 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.1 CC1=CC=C(C#N)C=C1 8168 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.1 CC1=CC=C(C=O)C=C1 15497 [0,0,0,0,0,0|1,0,2]=3 14 B9R1.1 CC1=CC=C(CN)C=C1 10199 [0,0,0,0,0,0|2,0,0]=2 15 B9R1.1 CC1=CC=C(CO)C=N1 27403 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.1 CC1=CC=C(NN)C=C1 4500 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.1 CC1=CN=C(C#N)C=C1 12978 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.1 CC1=CN=C(C=O)C=C1 17169 [0,0,0,0,0,0|2,0,2]=4 19 B9R1.1 CC1=NC=C(C#N)C=C1 6695 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.1 CC1=NC=C(C=O)C=C1 19463 [0,0,0,0,0,0|2,0,2]=4 21 B9R1.1 CC1=NC=C(CN)C=N1 24665 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.1 CC1=NC=C(NN)C=C1 19456 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.1 CC1=NC=C(NN)C=C1 26049 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.1 CCC1=CC=C(Br)C=C1 3772 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.1 CCC1=CC=C(C)C=C1 21843 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.1 CCC1=CC=C(I)C=C1 3877 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.1 CCC1=CC=C(N)C=C1 26342 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.1 CCC1=CC=C(O)C=C1 3874 [0,0,0,0,0,0|1,0,0]=1 29 B9R1.1 CCC1=CC=C(S)C=C1 6813 [0,0,0,0,0,0|1,1,0]=2 30 B9R1.1 CCC1=CN=C(Br)C=N1 34496 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.1 CCC1=CN=C(C)C=C1 10482 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.1 CCC1=CN=C(C)C=C1 18256 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.1 CCC1=CN=C(Cl)N=C1 7032 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.1 CCC1=NC=C(Br)C=C1 16886 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.1 CCC1=NC=C(Br)C=N1 27970 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.1 CCC1=NC=C(N)C=C1 25855 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.1 CCc1ccc(F)cc1 22752 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.1 CNC1=CC=C(Cl)C=C1 23344 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.1 CNC1=CC=C(I)C=C1 28328 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.1 CNC1=NC=C(Br)C=C1 22084 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.1 COC1=CC=C(Br)C=C1 3726 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.1 COC1=CC=C(C)N=C1 6640 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.1 COC1=CC=C(Cl)C=C1 3616 [0,0,0,0,0,0|3,0,0]=3 44 B9R1.1 COC1=CC=C(F)C=C1 3475 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.1 COC1=CC=C(I)C=C1 3911 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.1 COC1=CC=C(N)C=C1 21392 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.1 COC1=CC=C(N)C=C1 36098 [0,0,0,0,0,0|3,0,0]=3 48 B9R1.1 COC1=CC=C(O)C=C1 14584 [0,0,0,0,0,0|2,0,0]=2 49 B9R1.1 COC1=CC=C(O)C=C1 2276 [0,0,0,0,0,0|2,0,0]=2 50 B9R1.1 COC1=CC=C(S)C=C1 6822 [0,0,0,0,0,0|2,1,0]=3 51 B9R1.1 COC1=CC=[N+]([O-])C=C1 2587 [0,0,0,0,0,0|3,0,1]=4 52 B9R1.1 COC1=CN=C(Br)C=C1 15210 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.1 COC1=CN=C(Cl)C=C1 6222 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.1 COC1=CN=C(F)C=C1 33665 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.1 COC1=CN=C(N)C=C1 23280 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.1 COC1=NC=C(Br)C=C1 2408 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.1 COC1=NC=C(C)C=C1 6609 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.1 COC1=NC=C(Cl)C=C1 6602 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.1 COC1=NC=C(F)C=C1 11248 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.1 COC1=NC=C(I)C=C1 6606 [0,0,0,0,0,0|4,0,0]=4 61 B9R1.1 COC1=NC=C(N)C=C1 1270 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.1 COC1=NC=C(O)C=C1 16171 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.1 CSC1=CC=C(Br)C=C1 10650 [0,0,0,0,0,0|3,0,0]=3 64 B9R1.1 CSC1=CC=C(C)C=C1 10672 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.1 CSC1=CC=C(Cl)C=C1 10645 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.1 CSC1=CC=C(F)C=C1 10641 [0,0,0,0,0,0|3,0,0]=3 67 B9R1.1 CSC1=CC=C(I)C=C1 10670 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.1 CSC1=CC=C(N)C=C1 10636 [0,0,0,0,0,0|3,0,0]=3 69 B9R1.1 CSC1=CC=C(O)C=C1 15277 [0,0,0,0,0,0|2,0,0]=2 70 B9R1.1 CSC1=CC=C(S)C=C1 6825 [0,0,0,0,0,0|2,1,0]=3 71 B9R1.1 ClC1=CC=C(CBr)C=C1 36109 [0,0,0,0,0,0|2,0,0]=2 72 B9R1.1 ClC1=CC=C([Mg]Br)C=C1 24069 [0,0,0,0,0,0|3,0,0]=3 73 B9R1.1 ClCC1=CC=C(Br)C=C1 2478 [0,0,0,0,0,0|2,0,0]=2 74 B9R1.1 ClCC1=CC=C(Cl)C=C1 5797 [0,0,0,0,0,0|2,0,0]=2 75 B9R1.1 ClCC1=CC=C(Cl)N=N1 32248 [0,0,0,0,0,0|4,0,0]=4 76 B9R1.1 ClCC1=CN=C(Cl)C=C1 9210 [0,0,0,0,0,0|3,0,0]=3 77 B9R1.1 ClCC1=CN=C(Cl)N=C1 34908 [0,0,0,0,0,0|4,0,0]=4 78 B9R1.1 ClCC1=NC=C(Br)C=N1 23535 [0,0,0,0,0,0|4,0,0]=4 79 B9R1.1 ClCC1=NC=C(Cl)C=C1 24106 [0,0,0,0,0,0|3,0,0]=3 80 B9R1.1 FC1=CC=C(CBr)C=C1 7354 [0,0,0,0,0,0|2,0,0]=2 81 B9R1.1 FC1=CC=C(CCl)C=C1 8864 [0,0,0,0,0,0|2,0,0]=2 82 B9R1.1 FC1=CC=C(CS)C=C1 6855 [0,0,0,0,0,0|1,1,0]=2 83 B9R1.1 N#CC1=CC=C(Br)C=C1 3745 [0,0,0,0,0,0|2,0,1]=3 84 B9R1.1 N#CC1=CC=C(Cl)C=C1 20405 [0,0,0,0,0,0|2,0,1]=3 85 B9R1.1 N#CC1=CC=C(F)C=C1 1585 [0,0,0,0,0,0|2,0,1]=3 86 B9R1.1 N#CC1=CC=C(I)C=C1 3936 [0,0,0,0,0,0|2,0,1]=3 87 B9R1.1 N#CC1=CC=C(N)C=C1 15683 [0,0,0,0,0,0|2,0,1]=3 88 B9R1.1 N#CC1=CC=[N+]([O-])C=C1 12408 [0,0,0,0,0,0|2,0,2]=4 89 B9R1.1 N#CC1=CN=C(Br)C=C1 5963 [0,0,0,0,0,0|3,0,1]=4 90 B9R1.1 N#CC1=CN=C(Cl)C=C1 1224 [0,0,0,0,0,0|3,0,1]=4 91 B9R1.1 N#CC1=CN=C(F)C=C1 19505 [0,0,0,0,0,0|3,0,1]=4 92 B9R1.1 N#CC1=CN=C(N)C=C1 31629 [0,0,0,0,0,0|3,0,1]=4 93 B9R1.1 N#CC1=CN=C(N)C=C1 5752 [0,0,0,0,0,0|3,0,1]=4 94 B9R1.1 N#CC1=CN=C(O)C=C1 18529 [0,0,0,0,0,0|2,0,1]=3 95 B9R1.1 N#CC1=NC=C(Br)C=C1 2108 [0,0,0,0,0,0|3,0,1]=4 96 B9R1.1 N#CC1=NC=C(Cl)C=C1 2107 [0,0,0,0,0,0|3,0,1]=4 97 B9R1.1 N#CC1=NC=C(F)C=C1 16479 [0,0,0,0,0,0|3,0,1]=4 98 B9R1.1 N#CC1=NC=C(N)C=C1 6228 [0,0,0,0,0,0|3,0,1]=4 99 B9R1.1 N#CC1=NC=C(O)C=C1 17605 [0,0,0,0,0,0|2,0,1]=3 100 B9R1.1 NC1=CC=C(C=O)C=C1 7795 [0,0,0,0,0,0|1,0,2]=3 101 B9R1.1 NC1=CC=C(CBr)C=C1 26393 [0,0,0,0,0,0|2,0,0]=2 102 B9R1.1 NC1=CC=C(CO)C=C1 7480 [0,0,0,0,0,0|1,0,0]=1 103 B9R1.1 NC1=CC=C(CO)C=N1 18913 [0,0,0,0,0,0|2,0,0]=2 104 B9R1.1 NCC1=CC=C(Br)C=C1 23806 [0,0,0,0,0,0|2,0,0]=2 105 B9R1.1 NCC1=CC=C(Br)C=C1 3751 [0,0,0,0,0,0|2,0,0]=2 106 B9R1.1 NCC1=CC=C(Cl)C=C1 9028 [0,0,0,0,0,0|2,0,0]=2 107 B9R1.1 NCC1=CC=C(Cl)N=C1 24215 [0,0,0,0,0,0|3,0,0]=3 108 B9R1.1 NCC1=CC=C(F)C=C1 3408 [0,0,0,0,0,0|2,0,0]=2 109 B9R1.1 NCC1=CC=C(F)C=C1 4420 [0,0,0,0,0,0|2,0,0]=2 110 B9R1.1 NCC1=CC=C(I)C=C1 3304 [0,0,0,0,0,0|2,0,0]=2 111 B9R1.1 NCC1=CC=C(N)C=C1 5803 [0,0,0,0,0,0|2,0,0]=2 112 B9R1.1 NCC1=CC=C(O)C=C1 26036 [0,0,0,0,0,0|1,0,0]=1 113 B9R1.1 NCC1=CN=C(Cl)C=C1 1255 [0,0,0,0,0,0|3,0,0]=3 114 B9R1.1 NCC1=CN=C(Cl)C=C1 15212 [0,0,0,0,0,0|3,0,0]=3 115 B9R1.1 NCC1=CN=C(Cl)N=C1 22776 [0,0,0,0,0,0|4,0,0]=4 116 B9R1.1 NCC1=CNC(=O)C=C1 19427 [0,0,0,0,0,0|2,0,1]=3 117 B9R1.1 NCC1=NC=C(Br)C=C1 29009 [0,0,0,0,0,0|3,0,0]=3 118 B9R1.1 NNC1=CC=C(Br)C=C1 21916 [0,0,0,0,0,0|3,0,0]=3 119 B9R1.1 NNC1=CC=C(Br)C=C1 6409 [0,0,0,0,0,0|3,0,0]=3 120 B9R1.1 NNC1=CC=C(Cl)C=C1 23899 [0,0,0,0,0,0|3,0,0]=3 121 B9R1.1 NNC1=CC=C(Cl)C=C1 4483 [0,0,0,0,0,0|3,0,0]=3 122 B9R1.1 NNC1=CC=C(F)C=C1 15913 [0,0,0,0,0,0|3,0,0]=3 123 B9R1.1 NNC1=CC=C(F)C=C1 3330 [0,0,0,0,0,0|3,0,0]=3 124 B9R1.1 NNC1=CC=C(I)C=C1 15797 [0,0,0,0,0,0|3,0,0]=3 125 B9R1.1 NNC1=CN=C(Cl)C=C1 16449 [0,0,0,0,0,0|4,0,0]=4 126 B9R1.1 NNC1=CN=C(Cl)C=C1 20865 [0,0,0,0,0,0|4,0,0]=4 127 B9R1.1 NNC1=NC=C(Br)C=C1 18793 [0,0,0,0,0,0|4,0,0]=4 128 B9R1.1 O=CC1=CC=C(Br)C=C1 8053 [0,0,0,0,0,0|1,0,2]=3 129 B9R1.1 O=CC1=CC=C(Cl)C=C1 8078 [0,0,0,0,0,0|1,0,2]=3 130 B9R1.1 O=CC1=CC=C(Cl)N=C1 23354 [0,0,0,0,0,0|2,0,2]=4 131 B9R1.1 O=CC1=CC=C(F)C=C1 3478 [0,0,0,0,0,0|1,0,2]=3 132 B9R1.1 O=CC1=CC=C(I)C=C1 5349 [0,0,0,0,0,0|1,0,2]=3 133 B9R1.1 O=CC1=CC=C(O)C=C1 10188 [0,0,0,0,0,0|0,0,2]=2 134 B9R1.1 O=CC1=CN=C(Br)C=C1 1181 [0,0,0,0,0,0|2,0,2]=4 135 B9R1.1 O=CC1=CN=C(Cl)C=C1 9221 [0,0,0,0,0,0|2,0,2]=4 136 B9R1.1 O=CC1=CN=C(F)C=C1 5150 [0,0,0,0,0,0|2,0,2]=4 137 B9R1.1 O=CC1=CN=C(O)C=C1 17127 [0,0,0,0,0,0|1,0,2]=3 138 B9R1.1 O=CC1=NC=C(Br)C=C1 5059 [0,0,0,0,0,0|2,0,2]=4 139 B9R1.1 O=CC1=NC=C(Cl)C=C1 17153 [0,0,0,0,0,0|2,0,2]=4 140 B9R1.1 O=CC1=NC=C(F)C=C1 5149 [0,0,0,0,0,0|2,0,2]=4 141 B9R1.1 O=CC1=NC=C(O)C=C1 33708 [0,0,0,0,0,0|1,0,2]=3 142 B9R1.1 OCC1=CC=C(Br)C=C1 3748 [0,0,0,0,0,0|1,0,0]=1 143 B9R1.1 OCC1=CC=C(Cl)C=C1 3627 [0,0,0,0,0,0|1,0,0]=1 144 B9R1.1 OCC1=CC=C(F)C=C1 3487 [0,0,0,0,0,0|1,0,0]=1 145 B9R1.1 OCC1=CC=C(F)N=C1 17062 [0,0,0,0,0,0|2,0,0]=2 146 B9R1.1 OCC1=CC=C(I)C=C1 4081 [0,0,0,0,0,0|1,0,0]=1 147 B9R1.1 OCC1=CC=C(O)C=C1 29320 [0,0,0,0,0,0|0,0,0]=0 148 B9R1.1 OCC1=CC=C(S)C=C1 6879 [0,0,0,0,0,0|0,1,0]=1 149 B9R1.1 OCC1=CN=C(Cl)C=C1 12920 [0,0,0,0,0,0|2,0,0]=2 150 B9R1.1 OCC1=NC=C(Br)C=C1 12387 [0,0,0,0,0,0|2,0,0]=2 151 B9R1.1 OCC1=NC=C(Br)C=C1 14780 [0,0,0,0,0,0|2,0,0]=2 152 B9R1.1 OCC1=NC=C(Br)C=C1 7710 [0,0,0,0,0,0|2,0,0]=2 153 B9R1.1 OCC1=NC=C(Cl)N=C1 23492 [0,0,0,0,0,0|3,0,0]=3 154 B9R1.1 SCC1=CC=C(Br)C=C1 6868 [0,0,0,0,0,0|1,1,0]=2 155 B9R1.1 SCC1=CC=C(Cl)C=C1 6838 [0,0,0,0,0,0|1,1,0]=2 156 B8R1.2 BrCC1=CC=CC=C1 13143 [1,0,0,0,0,0|1,0,0]=2 157 B8R1.2 BrCC1=CC=CN=C1 17664 [1,0,0,0,0,0|2,0,0]=3 158 B8R1.2 BrCC1=NC=NC=C1 23940 [1,0,0,0,0,0|3,0,0]=4 159 B8R1.2 C#CC1=CC=CC=C1 15340 [1,0,0,0,0,0|1,0,1]=3 160 B8R1.2 C#CC1=CC=CN=C1 16106 [1,0,0,0,0,0|2,0,1]=4 161 B8R1.2 C#CC1=CC=NC=C1 19527 [1,0,0,0,0,0|2,0,1]=4 162 B8R1.2 C=CC1=NC=CC=C1 23910 [1,0,0,0,0,0|2,0,1]=4 163 B8R1.2 CCC1=NC=NC=C1 23618 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.2 CNC1=CC=CN=C1 14983 [1,0,0,0,0,0|3,0,0]=4 165 B8R1.2 CNC1=CC=NC=C1 12915 [1,0,0,0,0,0|3,0,0]=4 166 B8R1.2 COC1=CC=CC=C1 12830 [1,0,0,0,0,0|2,0,0]=3 167 B8R1.2 COC1=CC=CC=C1 17272 [1,0,0,0,0,0|2,0,0]=3 168 B8R1.2 COC1=CC=CN=C1 15370 [1,0,0,0,0,0|3,0,0]=4 169 B8R1.2 COC1=CC=NC=C1 2585 [1,0,0,0,0,0|3,0,0]=4 170 B8R1.2 COC1=NC=CC=C1 13201 [1,0,0,0,0,0|3,0,0]=4 171 B8R1.2 CSC1=CC=CC=C1 10578 [1,0,0,0,0,0|2,0,0]=3 172 B8R1.2 CSC1=NC=CC=C1 35938 [1,0,0,0,0,0|3,0,0]=4 173 B8R1.2 ClCC1=CC=CN=C1 9217 [1,0,0,0,0,0|2,0,0]=3 174 B8R1.2 ClCC1=CC=NC=C1 15905 [1,0,0,0,0,0|2,0,0]=3 175 B8R1.2 ClCC1=NC=CC=C1 16732 [1,0,0,0,0,0|2,0,0]=3 176 B8R1.2 ClCC1=NC=CC=C1 36036 [1,0,0,0,0,0|2,0,0]=3 177 B8R1.2 ClCC1=NC=CC=N1 21458 [1,0,0,0,0,0|3,0,0]=4 178 B8R1.2 ClCC1=NC=CC=N1 24800 [1,0,0,0,0,0|3,0,0]=4 179 B8R1.2 ClCC1=NC=CN=C1 32160 [1,0,0,0,0,0|3,0,0]=4 180 B8R1.2 N#CC1=CC=CN=C1 11233 [1,0,0,0,0,0|2,0,1]=4 181 B8R1.2 N#CC1=CC=NC=C1 11155 [1,0,0,0,0,0|2,0,1]=4 182 B8R1.2 N#CC1=NC=CC=C1 6007 [1,0,0,0,0,0|2,0,1]=4 183 B8R1.2 N#Cc1ccccc1 25507 [1,0,0,0,0,0|1,0,1]=3 184 B8R1.2 NCC1=CC=CC=C1 25530 [1,0,0,0,0,0|1,0,0]=2 185 B8R1.2 NCC1=CC=CN=C1 11140 [1,0,0,0,0,0|2,0,0]=3 186 B8R1.2 NCC1=CC=NC=C1 12407 [1,0,0,0,0,0|2,0,0]=3 187 B8R1.2 NCC1=NC=CC=C1 11142 [1,0,0,0,0,0|2,0,0]=3 188 B8R1.2 NCC1=NC=CC=N1 26329 [1,0,0,0,0,0|3,0,0]=4 189 B8R1.2 NCC1=NC=CN=C1 17822 [1,0,0,0,0,0|3,0,0]=4 190 B8R1.2 NNC1=CC=CC=C1 22925 [1,0,0,0,0,0|2,0,0]=3 191 B8R1.2 NNC1=CC=NC=C1 16313 [1,0,0,0,0,0|3,0,0]=4 192 B8R1.2 NNC1=NC=CC=C1 22630 [1,0,0,0,0,0|3,0,0]=4 193 B8R1.2 O=CC1=CC=CN=C1 1124 [1,0,0,0,0,0|1,0,2]=4 194 B8R1.2 O=CC1=CC=NC=C1 11745 [1,0,0,0,0,0|1,0,2]=4 195 B8R1.2 O=CC1=NC=CC=C1 11741 [1,0,0,0,0,0|1,0,2]=4 196 B8R1.2 OCC1=CC=CN=C1 11736 [1,0,0,0,0,0|1,0,0]=2 197 B8R1.2 OCC1=CC=NC=C1 11738 [1,0,0,0,0,0|1,0,0]=2 198 B8R1.2 OCC1=CN=CN=C1 9758 [1,0,0,0,0,0|2,0,0]=3 199 B8R1.2 OCC1=NC=CC=C1 9301 [1,0,0,0,0,0|1,0,0]=2 200 B8R1.2 OCC1=NC=CC=N1 9757 [1,0,0,0,0,0|2,0,0]=3 201 B8R1.2 OCC1=NC=CN=C1 32128 [1,0,0,0,0,0|2,0,0]=3 202 B8R1.2 OCC1=NC=NC=C1 9756 [1,0,0,0,0,0|2,0,0]=3 203 B8R1.2 SCC1=CC=CC=C1 6835 [1,0,0,0,0,0|0,1,0]=2 204 B8R1.2 SCC1=CC=CN=C1 25049 [1,0,0,0,0,0|1,1,0]=3 205 B8R1.2 SCC1=CC=NC=C1 25053 [1,0,0,0,0,0|1,1,0]=3 206 B8R1.2 SCC1=NC=CC=C1 25013 [1,0,0,0,0,0|1,1,0]=3 207 B8R1.2 SCC1=NC=CN=C1 32116 [1,0,0,0,0,0|2,1,0]=4 208 B8R1.3 BrC1=CC=C(Br)C=C1 10875 [1,0,0,0,0,0|2,0,0]=3 209 B8R1.3 BrC1=CC=C(I)C=C1 27467 [1,0,0,0,0,0|2,0,0]=3 210 B8R1.3 BrC1=CC=C(I)C=C1 3786 [1,0,0,0,0,0|2,0,0]=3 211 B8R1.3 BrC1=CN=C(Br)C=C1 1111 [1,0,0,0,0,0|3,0,0]=4 212 B8R1.3 BrC1=CN=C(I)C=C1 2409 [1,0,0,0,0,0|3,0,0]=4 213 B8R1.3 BrC1=NC=C(I)C=C1 5969 [1,0,0,0,0,0|3,0,0]=4 214 B8R1.3 CC1=CC=C(Br)C=C1 21011 [1,0,0,0,0,0|1,0,0]=2 215 B8R1.3 CC1=CC=C(Br)N=N1 28224 [1,0,0,0,0,0|3,0,0]=4 216 B8R1.3 CC1=CC=C(C)N=N1 20402 [1,0,0,0,0,0|3,0,0]=4 217 B8R1.3 CC1=CC=C(Cl)C=C1 19750 [1,0,0,0,0,0|1,0,0]=2 218 B8R1.3 CC1=CC=C(Cl)N=N1 10467 [1,0,0,0,0,0|3,0,0]=4 219 B8R1.3 CC1=CC=C(F)C=C1 12887 [1,0,0,0,0,0|1,0,0]=2 220 B8R1.3 CC1=CC=C(I)C=C1 4548 [1,0,0,0,0,0|1,0,0]=2 221 B8R1.3 CC1=CC=C(O)C=C1 23326 [1,0,0,0,0,0|0,0,0]=1 222 B8R1.3 CC1=CC=C(S)C=C1 6809 [1,0,0,0,0,0|0,1,0]=2 223 B8R1.3 CC1=CN=C(Br)C=C1 1185 [1,0,0,0,0,0|2,0,0]=3 224 B8R1.3 CC1=CN=C(Br)C=N1 18038 [1,0,0,0,0,0|3,0,0]=4 225 B8R1.3 CC1=CN=C(Br)N=C1 34383 [1,0,0,0,0,0|3,0,0]=4 226 B8R1.3 CC1=CN=C(C)C=C1 20994 [1,0,0,0,0,0|2,0,0]=3 227 B8R1.3 CC1=CN=C(C)C=N1 8608 [1,0,0,0,0,0|3,0,0]=4 228 B8R1.3 CC1=CN=C(Cl)C=C1 1193 [1,0,0,0,0,0|2,0,0]=3 229 B8R1.3 CC1=CN=C(Cl)N=C1 11095 [1,0,0,0,0,0|3,0,0]=4 230 B8R1.3 CC1=CN=C(F)C=C1 4059 [1,0,0,0,0,0|2,0,0]=3 231 B8R1.3 CC1=CN=C(I)N=C1 34875 [1,0,0,0,0,0|3,0,0]=4 232 B8R1.3 CC1=CN=C(N)C=C1 1159 [1,0,0,0,0,0|2,0,0]=3 233 B8R1.3 CC1=CN=C(N)C=N1 15710 [1,0,0,0,0,0|3,0,0]=4 234 B8R1.3 CC1=CN=C(O)C=C1 14321 [1,0,0,0,0,0|1,0,0]=2 235 B8R1.3 CC1=CN=C(O)C=C1 27251 [1,0,0,0,0,0|1,0,0]=2 236 B8R1.3 CC1=NC=C(Br)C=C1 4058 [1,0,0,0,0,0|2,0,0]=3 237 B8R1.3 CC1=NC=C(Br)C=N1 15231 [1,0,0,0,0,0|3,0,0]=4 238 B8R1.3 CC1=NC=C(Cl)C=C1 6694 [1,0,0,0,0,0|2,0,0]=3 239 B8R1.3 CC1=NC=C(F)C=C1 2224 [1,0,0,0,0,0|2,0,0]=3 240 B8R1.3 CC1=NC=C(I)C=C1 6698 [1,0,0,0,0,0|2,0,0]=3 241 B8R1.3 CC1=NC=C(N)C=C1 1280 [1,0,0,0,0,0|2,0,0]=3 242 B8R1.3 CC1=NC=C(N)C=N1 22766 [1,0,0,0,0,0|3,0,0]=4 243 B8R1.3 CC1=NC=C(O)C=C1 6696 [1,0,0,0,0,0|1,0,0]=2 244 B8R1.3 CC1=NC=C(O)C=N1 21855 [1,0,0,0,0,0|2,0,0]=3 245 B8R1.3 CC1=NNC(=O)C=C1 28171 [1,0,0,0,0,0|2,0,1]=4 246 B8R1.3 ClC1=CC=C(Br)C=C1 10226 [1,0,0,0,0,0|2,0,0]=3 247 B8R1.3 ClC1=CC=C(I)C=C1 3648 [1,0,0,0,0,0|2,0,0]=3 248 B8R1.3 ClC1=CN=C(Br)C=C1 1169 [1,0,0,0,0,0|3,0,0]=4 249 B8R1.3 ClC1=CN=C(Cl)C=C1 1199 [1,0,0,0,0,0|3,0,0]=4 250 B8R1.3 ClC1=CN=C(I)C=C1 6574 [1,0,0,0,0,0|3,0,0]=4 251 B8R1.3 ClC1=NC=C(Br)C=C1 1168 [1,0,0,0,0,0|3,0,0]=4 252 B8R1.3 ClC1=NC=C(I)C=C1 2078 [1,0,0,0,0,0|3,0,0]=4 253 B8R1.3 FC1=CC=C(Br)C=C1 2251 [1,0,0,0,0,0|2,0,0]=3 254 B8R1.3 FC1=CC=C(Cl)C=C1 3420 [1,0,0,0,0,0|2,0,0]=3 255 B8R1.3 FC1=CC=C(F)C=C1 2309 [1,0,0,0,0,0|2,0,0]=3 256 B8R1.3 FC1=CC=C(I)C=C1 2103 [1,0,0,0,0,0|2,0,0]=3 257 B8R1.3 FC1=CC=C(S)C=C1 5431 [1,0,0,0,0,0|1,1,0]=3 258 B8R1.3 FC1=CN=C(Br)C=C1 1099 [1,0,0,0,0,0|3,0,0]=4 259 B8R1.3 FC1=CN=C(Cl)C=C1 1097 [1,0,0,0,0,0|3,0,0]=4 260 B8R1.3 FC1=CN=C(F)C=C1 14398 [1,0,0,0,0,0|3,0,0]=4 261 B8R1.3 FC1=NC=C(Br)C=C1 3550 [1,0,0,0,0,0|3,0,0]=4 262 B8R1.3 FC1=NC=C(Cl)C=C1 1186 [1,0,0,0,0,0|3,0,0]=4 263 B8R1.3 FC1=NC=C(I)C=C1 6324 [1,0,0,0,0,0|3,0,0]=4 264 B8R1.3 IC1=CC=C(I)C=C1 3837 [1,0,0,0,0,0|2,0,0]=3 265 B8R1.3 IC1=CN=C(I)C=C1 5524 [1,0,0,0,0,0|3,0,0]=4 266 B8R1.3 NC1=CC=C(Br)C=C1 3724 [1,0,0,0,0,0|2,0,0]=3 267 B8R1.3 NC1=CC=C(Cl)C=C1 16666 [1,0,0,0,0,0|2,0,0]=3 268 B8R1.3 NC1=CC=C(F)C=C1 10782 [1,0,0,0,0,0|2,0,0]=3 269 B8R1.3 NC1=CC=C(F)C=C1 5246 [1,0,0,0,0,0|2,0,0]=3 270 B8R1.3 NC1=CC=C(I)C=C1 10572 [1,0,0,0,0,0|2,0,0]=3 271 B8R1.3 NC1=CC=C(N)C=C1 22180 [1,0,0,0,0,0|2,0,0]=3 272 B8R1.3 NC1=CC=C(O)C=C1 22199 [1,0,0,0,0,0|1,0,0]=2 273 B8R1.3 NC1=CC=C(S)C=C1 2471 [1,0,0,0,0,0|1,1,0]=3 274 B8R1.3 NC1=CN=C(Br)C=C1 1100 [1,0,0,0,0,0|3,0,0]=4 275 B8R1.3 NC1=CN=C(Cl)C=C1 2406 [1,0,0,0,0,0|3,0,0]=4 276 B8R1.3 NC1=CN=C(F)C=C1 1155 [1,0,0,0,0,0|3,0,0]=4 277 B8R1.3 NC1=CN=C(I)C=C1 6572 [1,0,0,0,0,0|3,0,0]=4 278 B8R1.3 NC1=CN=C(N)C=C1 13202 [1,0,0,0,0,0|3,0,0]=4 279 B8R1.3 NC1=CN=C(N)C=C1 5497 [1,0,0,0,0,0|3,0,0]=4 280 B8R1.3 NC1=CN=C(O)C=C1 14125 [1,0,0,0,0,0|2,0,0]=3 281 B8R1.3 NC1=CN=C(O)C=C1 6563 [1,0,0,0,0,0|2,0,0]=3 282 B8R1.3 NC1=NC=C(Br)C=C1 1107 [1,0,0,0,0,0|3,0,0]=4 283 B8R1.3 NC1=NC=C(Cl)C=C1 1153 [1,0,0,0,0,0|3,0,0]=4 284 B8R1.3 NC1=NC=C(F)C=C1 1109 [1,0,0,0,0,0|3,0,0]=4 285 B8R1.3 NC1=NC=C(I)C=C1 2407 [1,0,0,0,0,0|3,0,0]=4 286 B8R1.3 NC1=NC=C(O)C=C1 5754 [1,0,0,0,0,0|2,0,0]=3 287 B8R1.3 NC1=NC=C(O)C=N1 21503 [1,0,0,0,0,0|3,0,0]=4 288 B8R1.3 NC1=NC=C(O)N=C1 35940 [1,0,0,0,0,0|3,0,0]=4 289 B8R1.3 O=C1C=CC(=O)C=C1 14592 [1,0,0,0,0,0|0,0,2]=3 290 B8R1.3 OC1=CC=C(Br)C=C1 19708 [1,0,0,0,0,0|1,0,0]=2 291 B8R1.3 OC1=CC=C(Br)N=C1 24844 [1,0,0,0,0,0|2,0,0]=3 292 B8R1.3 OC1=CC=C(Cl)C=C1 22009 [1,0,0,0,0,0|1,0,0]=2 293 B8R1.3 OC1=CC=C(Cl)N=N1 26471 [1,0,0,0,0,0|3,0,0]=4 294 B8R1.3 OC1=CC=C(F)C=C1 2314 [1,0,0,0,0,0|1,0,0]=2 295 B8R1.3 OC1=CC=C(I)C=C1 3199 [1,0,0,0,0,0|1,0,0]=2 296 B8R1.3 OC1=CC=C(O)C=C1 9139 [1,0,0,0,0,0|0,0,0]=1 297 B8R1.3 OC1=CC=C(O)N=N1 15702 [1,0,0,0,0,0|2,0,0]=3 298 B8R1.3 OC1=CC=C(S)C=C1 2464 [1,0,0,0,0,0|0,1,0]=2 299 B8R1.3 OC1=CN=C(Br)C=C1 5967 [1,0,0,0,0,0|2,0,0]=3 300 B8R1.3 OC1=CN=C(Br)C=N1 7870 [1,0,0,0,0,0|3,0,0]=4 301 B8R1.3 OC1=CN=C(Cl)C=C1 2410 [1,0,0,0,0,0|2,0,0]=3 302 B8R1.3 OC1=CN=C(Cl)N=C1 10664 [1,0,0,0,0,0|3,0,0]=4 303 B8R1.3 OC1=CN=C(F)C=C1 6321 [1,0,0,0,0,0|2,0,0]=3 304 B8R1.3 OC1=CN=C(O)C=C1 5522 [1,0,0,0,0,0|1,0,0]=2 305 B8R1.3 OC1=NC=C(Br)C=C1 1178 [1,0,0,0,0,0|2,0,0]=3 306 B8R1.3 OC1=NC=C(Br)C=N1 24602 [1,0,0,0,0,0|3,0,0]=4 307 B8R1.3 OC1=NC=C(Cl)C=C1 1187 [1,0,0,0,0,0|2,0,0]=3 308 B8R1.3 OC1=NC=C(Cl)C=N1 7009 [1,0,0,0,0,0|3,0,0]=4 309 B8R1.3 OC1=NC=C(Cl)N=C1 23585 [1,0,0,0,0,0|3,0,0]=4 310 B8R1.3 OC1=NC=C(F)C=C1 6566 [1,0,0,0,0,0|2,0,0]=3 311 B8R1.3 OC1=NC=C(I)C=C1 6567 [1,0,0,0,0,0|2,0,0]=3 312 B8R1.3 SC1=CC=C(Br)C=C1 4043 [1,0,0,0,0,0|1,1,0]=3 313 B8R1.3 SC1=CC=C(Cl)C=C1 6790 [1,0,0,0,0,0|1,1,0]=3 314 B8R1.3 SC1=CC=C(S)C=C1 6866 [1,0,0,0,0,0|0,2,0]=3 315 B8R1.3 SC1=NC=C(Cl)C=C1 19566 [1,0,0,0,0,0|2,1,0]=4 316 B8R1.3 [O-][N+]1=CC=C(Cl)C=C1 19817 [1,0,0,0,0,0|2,0,1]=4 317 B10R1.1 BrCCC1=CC=C(Br)C=C1 16698 [0,1,0,0,0,0|2,0,0]=3 318 B10R1.1 CC1=CC=C(CC#N)C=C1 28873 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.1 CCCC1=CC=C(Br)C=C1 10762 [0,1,0,0,0,0|2,0,0]=3 320 B10R1.1 CCCC1=CC=C(N)C=N1 26082 [0,1,0,0,0,0|3,0,0]=4 321 B10R1.1 CCNC1=NC=C(Br)C=C1 22083 [0,1,0,0,0,0|3,0,0]=4 322 B10R1.1 CCOC1=CC=C(Br)C=C1 3138 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.1 CCOC1=CC=C(C)C=C1 3181 [0,1,0,0,0,0|2,0,0]=3 324 B10R1.1 CCOC1=CC=C(Cl)C=C1 3165 [0,1,0,0,0,0|2,0,0]=3 325 B10R1.1 CCOC1=CC=C(F)C=C1 3175 [0,1,0,0,0,0|2,0,0]=3 326 B10R1.1 CCOC1=CC=C(I)C=C1 3177 [0,1,0,0,0,0|2,0,0]=3 327 B10R1.1 CCOC1=CC=C(N)C=C1 9511 [0,1,0,0,0,0|2,0,0]=3 328 B10R1.1 CCOC1=CC=C(O)C=C1 9512 [0,1,0,0,0,0|1,0,0]=2 329 B10R1.1 CCOC1=CN=C(Br)C=C1 5964 [0,1,0,0,0,0|3,0,0]=4 330 B10R1.1 CCOC1=CN=C(Cl)C=C1 6218 [0,1,0,0,0,0|3,0,0]=4 331 B10R1.1 CCOC1=NC=C(Br)C=C1 6235 [0,1,0,0,0,0|3,0,0]=4 332 B10R1.1 CCOC1=NC=C(N)C=C1 6234 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.1 CNCC1=CC=C(C)C=C1 10497 [0,1,0,0,0,0|2,0,0]=3 334 B10R1.1 CNCC1=CC=C(F)C=C1 31250 [0,1,0,0,0,0|2,0,0]=3 335 B10R1.1 ClC1=CC=C(CCBr)C=C1 28821 [0,1,0,0,0,0|2,0,0]=3 336 B10R1.1 ClCCC1=CC=C(Cl)C=C1 28820 [0,1,0,0,0,0|2,0,0]=3 337 B10R1.1 FC1=CC=C(CCBr)C=C1 25674 [0,1,0,0,0,0|2,0,0]=3 338 B10R1.1 FC1=CC=C(CCBr)C=C1 28825 [0,1,0,0,0,0|2,0,0]=3 339 B10R1.1 FC1=CC=C(N=C=S)C=C1 5008 [0,1,0,0,0,0|1,1,1]=4 340 B10R1.1 N#CCC1=CC=C(Br)C=C1 4242 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.1 N#CCC1=CC=C(Cl)C=C1 16502 [0,1,0,0,0,0|2,0,0]=3 342 B10R1.1 N#CCC1=CC=C(F)C=C1 4169 [0,1,0,0,0,0|2,0,0]=3 343 B10R1.1 N#CCC1=CC=C(I)C=C1 19992 [0,1,0,0,0,0|2,0,0]=3 344 B10R1.1 N#CCC1=CC=C(N)C=C1 4233 [0,1,0,0,0,0|2,0,0]=3 345 B10R1.1 N#CCC1=CC=C(O)C=C1 18614 [0,1,0,0,0,0|1,0,0]=2 346 B10R1.1 N#CCC1=CN=C(Cl)C=C1 2353 [0,1,0,0,0,0|3,0,0]=4 347 B10R1.1 N#CCC1=NC=C(Br)C=C1 31886 [0,1,0,0,0,0|3,0,0]=4 348 B10R1.1 NC1=CC=C(CCO)C=C1 4580 [0,1,0,0,0,0|1,0,0]=2 349 B10R1.1 NCCC1=CC=C(Br)C=C1 27051 [0,1,0,0,0,0|2,0,0]=3 350 B10R1.1 NCCC1=CC=C(Cl)C=C1 36132 [0,1,0,0,0,0|2,0,0]=3 351 B10R1.1 NCCC1=CC=C(F)C=C1 16712 [0,1,0,0,0,0|2,0,0]=3 352 B10R1.1 NCCC1=CC=C(F)C=C1 29725 [0,1,0,0,0,0|2,0,0]=3 353 B10R1.1 NCCC1=CC=C(N)C=C1 19815 [0,1,0,0,0,0|2,0,0]=3 354 B10R1.1 NCCC1=CC=C(N)C=C1 25418 [0,1,0,0,0,0|2,0,0]=3 355 B10R1.1 NCCC1=CC=C(O)C=C1 16668 [0,1,0,0,0,0|1,0,0]=2 356 B10R1.1 O=C=NC1=CC=C(Br)C=C1 23279 [0,1,0,0,0,0|1,0,2]=4 357 B10R1.1 O=C=NC1=CC=C(F)C=C1 4996 [0,1,0,0,0,0|1,0,2]=4 358 B10R1.1 O=CCC1=CC=C(Cl)C=C1 26501 [0,1,0,0,0,0|1,0,1]=3 359 B10R1.1 OC1=CC=C(CCBr)C=C1 2349 [0,1,0,0,0,0|1,0,0]=2 360 B10R1.1 OCCC1=CC=C(Cl)C=C1 3093 [0,1,0,0,0,0|1,0,0]=2 361 B10R1.1 OCCC1=CC=C(F)C=C1 4585 [0,1,0,0,0,0|1,0,0]=2 362 B10R1.1 OCCC1=CC=C(O)C=C1 9418 [0,1,0,0,0,0|0,0,0]=1 363 B10R1.1 O\N=C\C1=CC=C(F)C=C1 24097 [0,1,0,0,0,0|1,0,1]=3 364 B10R1.1 O\N=C\C1=CC=C(F)C=C1 3479 [0,1,0,0,0,0|1,0,1]=3 365 B10R1.1 O\N=C\C1=CN=C(Br)C=C1 20293 [0,1,0,0,0,0|2,0,1]=4 366 B10R1.1 S=C=NC1=CC=C(Cl)C=C1 16481 [0,1,0,0,0,0|1,1,1]=4 367 B10R1.3 BrCC1=CC=C(CBr)C=C1 10202 [0,1,0,0,0,0|2,0,0]=3 368 B10R1.3 C#CC1=CC=C(C#C)C=C1 25869 [0,1,0,0,0,0|2,0,1]=4 369 B10R1.3 C#CC1=CC=C(CC)C=C1 10925 [0,1,0,0,0,0|2,0,0]=3 370 B10R1.3 C=CC1=CC=C(CCl)C=C1 25812 [0,1,0,0,0,0|2,0,0]=3 371 B10R1.3 C=CC1=NC=C(CC)C=C1 19454 [0,1,0,0,0,0|3,0,0]=4 372 B10R1.3 CCC1=CC=C(C=O)C=C1 3072 [0,1,0,0,0,0|1,0,1]=3 373 B10R1.3 CCC1=CC=C(CCl)C=C1 4921 [0,1,0,0,0,0|2,0,0]=3 374 B10R1.3 CCC1=CC=C(OC)C=C1 25322 [0,1,0,0,0,0|1,0,0]=2 375 B10R1.3 CCc1ccc(CCl)cc1 36258 [0,1,0,0,0,0|2,0,0]=3 376 B10R1.3 CNC1=CC=C(C#N)C=C1 4815 [0,1,0,0,0,0|2,0,1]=4 377 B10R1.3 CNC1=CC=C(OC)C=C1 25931 [0,1,0,0,0,0|2,0,0]=3 378 B10R1.3 COC1=CC=C(C#N)C=C1 8162 [0,1,0,0,0,0|1,0,1]=3 379 B10R1.3 COC1=CC=C(C=O)C=C1 22535 [0,1,0,0,0,0|0,0,2]=3 380 B10R1.3 COC1=CC=C(C=O)C=N1 5152 [0,1,0,0,0,0|1,0,2]=4 381 B10R1.3 COC1=CC=C(CBr)C=C1 15882 [0,1,0,0,0,0|1,0,0]=2 382 B10R1.3 COC1=CC=C(CCl)C=C1 18654 [0,1,0,0,0,0|1,0,0]=2 383 B10R1.3 COC1=CC=C(CN)C=C1 4428 [0,1,0,0,0,0|1,0,0]=2 384 B10R1.3 COC1=CC=C(CN)C=N1 33703 [0,1,0,0,0,0|2,0,0]=3 385 B10R1.3 COC1=CC=C(CO)C=C1 19100 [0,1,0,0,0,0|0,0,0]=1 386 B10R1.3 COC1=CC=C(CS)C=C1 6839 [0,1,0,0,0,0|0,1,0]=2 387 B10R1.3 COC1=CC=C(NN)C=C1 4498 [0,1,0,0,0,0|2,0,0]=3 388 B10R1.3 COC1=CC=C(SC)C=C1 10655 [0,1,0,0,0,0|2,0,0]=3 389 B10R1.3 COC1=CN=C(C=O)C=C1 24092 [0,1,0,0,0,0|1,0,2]=4 390 B10R1.3 COC1=CN=C(CO)C=C1 34570 [0,1,0,0,0,0|1,0,0]=2 391 B10R1.3 COC1=NC=C(C#N)C=C1 15154 [0,1,0,0,0,0|2,0,1]=4 392 B10R1.3 CSC1=CC=C(C#N)C=C1 10528 [0,1,0,0,0,0|1,1,1]=4 393 B10R1.3 CSC1=CC=C(C=O)C=C1 10796 [0,1,0,0,0,0|0,1,2]=4 394 B10R1.3 CSC1=CC=C(CCl)C=C1 10530 [0,1,0,0,0,0|1,1,0]=3 395 B10R1.3 CSC1=CC=C(CN)C=C1 27539 [0,1,0,0,0,0|1,1,0]=3 396 B10R1.3 CSC1=CC=C(CO)C=C1 7470 [0,1,0,0,0,0|0,1,0]=2 397 B10R1.3 ClCC1=CC=C(CCl)C=C1 10211 [0,1,0,0,0,0|2,0,0]=3 398 B10R1.3 N#CC1=CC=C(C=O)C=C1 3118 [0,1,0,0,0,0|1,0,2]=4 399 B10R1.3 N#CC1=CC=C(CBr)C=C1 7495 [0,1,0,0,0,0|2,0,0]=3 400 B10R1.3 N#CC1=CC=C(CCl)C=C1 7377 [0,1,0,0,0,0|2,0,0]=3 401 B10R1.3 N#CC1=CC=C(CN)C=C1 2057 [0,1,0,0,0,0|2,0,0]=3 402 B10R1.3 N#CC1=CC=C(CN)C=C1 9986 [0,1,0,0,0,0|2,0,0]=3 403 B10R1.3 N#CC1=CC=C(NN)C=C1 13684 [0,1,0,0,0,0|2,0,1]=4 404 B10R1.3 N#CC1=NC=C(CBr)C=C1 11368 [0,1,0,0,0,0|3,0,0]=4 405 B10R1.3 N#Cc1ccc(CO)cc1 31292 [0,1,0,0,0,0|1,0,0]=2 406 B10R1.3 O=CC1=CC=C(C=O)C=C1 35665 [0,1,0,0,0,0|0,0,3]=4 407 B10R1.3 O=CC1=CC=C(CBr)C=C1 19839 [0,1,0,0,0,0|1,0,1]=3 408 B10R1.3 O=CC1=CC=C(CCl)C=C1 30942 [0,1,0,0,0,0|1,0,1]=3 409 B10R1.3 OCC1=CC=C(CBr)C=C1 27440 [0,1,0,0,0,0|1,0,0]=2 410 B10R1.3 SCc1ccc(CS)cc1 6840 [0,1,0,0,0,0|0,2,0]=3 411 B10R1.13 C=C(C)C1=CC=C(O)C=C1 27834 [0,1,0,0,0,0|1,0,1]=3 412 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 3294 [0,1,0,0,0,0|1,0,2]=4 413 B10R1.13 CC(=O)C1=CC=C(C)C=C1 3326 [0,1,0,0,0,0|1,0,2]=4 414 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 3297 [0,1,0,0,0,0|1,0,2]=4 415 B10R1.13 CC(=O)C1=CC=C(F)C=C1 10587 [0,1,0,0,0,0|1,0,2]=4 416 B10R1.13 CC(=O)C1=CC=C(I)C=C1 3323 [0,1,0,0,0,0|1,0,2]=4 417 B10R1.13 CC(=O)C1=CC=C(N)C=C1 3288 [0,1,0,0,0,0|1,0,2]=4 418 B10R1.13 CC(=O)C1=CC=C(O)C=C1 3311 [0,1,0,0,0,0|0,0,2]=3 419 B10R1.13 CC(=O)C1=CN=C(O)C=C1 29236 [0,1,0,0,0,0|1,0,2]=4 420 B10R1.13 CC(C)C1=CC=C(Br)C=C1 18676 [0,1,0,0,0,0|2,0,0]=3 421 B10R1.13 CC(C)C1=CC=C(I)C=C1 3975 [0,1,0,0,0,0|2,0,0]=3 422 B10R1.13 CC(C)C1=CC=C(N)C=N1 19458 [0,1,0,0,0,0|3,0,0]=4 423 B10R1.13 CC(C)C1=CC=C(S)C=C1 6814 [0,1,0,0,0,0|1,1,0]=3 424 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 27544 [0,1,0,0,0,0|2,0,0]=3 425 B10R1.13 CC(N)C1=CC=C(F)C=C1 3425 [0,1,0,0,0,0|2,0,0]=3 426 B10R1.13 CC(O)C1=CC=C(Br)C=C1 12552 [0,1,0,0,0,0|1,0,0]=2 427 B10R1.13 CC1=CC=C(B(O)O)C=C1 1873 [0,1,0,0,0,0|2,0,0]=3 428 B10R1.13 CC1=CC=C(B(O)O)C=C1 27335 [0,1,0,0,0,0|2,0,0]=3 429 B10R1.13 CC1=CC=C(B(O)O)C=N1 17081 [0,1,0,0,0,0|3,0,0]=4 430 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 15455 [0,1,0,0,0,0|1,0,2]=4 431 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15433 [0,1,0,0,0,0|1,0,1]=3 432 B10R1.13 CC1=CC=C(C(N)=O)C=C1 27569 [0,1,0,0,0,0|1,0,2]=4 433 B10R1.13 CC1=CC=C(C(O)=S)C=C1 10665 [0,1,0,0,0,0|1,0,1]=3 434 B10R1.13 CC1=CC=C(N(C)C)C=C1 21347 [0,1,0,0,0,0|3,0,0]=4 435 B10R1.13 CC1=CC=C(S(=O)O)C=C1 35986 [0,1,0,0,0,0|2,0,0]=3 436 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 35988 [0,1,0,0,0,0|2,0,1]=4 437 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 15589 [0,1,0,0,0,0|1,0,0]=2 438 B10R1.13 CC1=CN=C(B(O)O)C=C1 6938 [0,1,0,0,0,0|3,0,0]=4 439 B10R1.13 CC1=CN=C(C(=O)O)C=C1 22648 [0,1,0,0,0,0|2,0,1]=4 440 B10R1.13 CC1=NC=C(C(=O)O)C=C1 1218 [0,1,0,0,0,0|2,0,1]=4 441 B10R1.13 CN(C)C1=CC=C(Br)C=C1 2230 [0,1,0,0,0,0|3,0,0]=4 442 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 5271 [0,1,0,0,0,0|3,0,0]=4 443 B10R1.13 CN(C)C1=CC=C(F)C=C1 3365 [0,1,0,0,0,0|3,0,0]=4 444 B10R1.13 CN(C)C1=CC=C(O)C=C1 27800 [0,1,0,0,0,0|2,0,0]=3 445 B10R1.13 CN(C)c1ccc(N)cc1 21651 [0,1,0,0,0,0|3,0,0]=4 446 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 15222 [0,1,0,0,0,0|2,0,0]=3 447 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 15219 [0,1,0,0,0,0|2,0,0]=3 448 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 2454 [0,1,0,0,0,0|1,0,0]=2 449 B10R1.13 C[C@@H](N)c1ccc(Br)cc1 14234 [0,1,0,0,0,0|2,0,0]=3 450 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 14252 [0,1,0,0,0,0|1,0,0]=2 451 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 14249 [0,1,0,0,0,0|1,0,0]=2 452 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 14245 [0,1,0,0,0,0|1,0,0]=2 453 B10R1.13 C[C@H](N)C1=CC=C(Cl)C=C1 15221 [0,1,0,0,0,0|2,0,0]=3 454 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 15218 [0,1,0,0,0,0|2,0,0]=3 455 B10R1.13 C[C@H](N)c1ccc(Br)cc1 5736 [0,1,0,0,0,0|2,0,0]=3 456 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 14253 [0,1,0,0,0,0|1,0,0]=2 457 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 14251 [0,1,0,0,0,0|1,0,0]=2 458 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 14247 [0,1,0,0,0,0|1,0,0]=2 459 B10R1.13 Cc1ccc(C(Cl)Cl)cc1 10212 [0,1,0,0,0,0|2,0,0]=3 460 B10R1.13 Cc1ccc([C@@H](C)N)cc1 8021 [0,1,0,0,0,0|2,0,0]=3 461 B10R1.13 Cc1ccc([S@@](N)=O)cc1 9914 [0,1,0,0,0,0|2,0,1]=4 462 B10R1.13 Cc1ccc([S@](N)=O)cc1 9913 [0,1,0,0,0,0|2,0,1]=4 463 B10R1.13 FC(F)C1=CC=C(Br)C=C1 23296 [0,1,0,0,0,0|2,0,0]=3 464 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 25824 [0,1,0,0,0,0|2,0,1]=4 465 B10R1.13 N=C(N)C1=CC=C(N)C=C1 13445 [0,1,0,0,0,0|2,0,1]=4 466 B10R1.13 N=C(N)C1=CC=C(O)C=C1 18174 [0,1,0,0,0,0|1,0,1]=3 467 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 3737 [0,1,0,0,0,0|1,0,2]=4 468 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 3619 [0,1,0,0,0,0|1,0,2]=4 469 B10R1.13 NC(=O)C1=CC=C(F)C=C1 3407 [0,1,0,0,0,0|1,0,2]=4 470 B10R1.13 NC(=O)C1=CC=C(N)C=C1 35461 [0,1,0,0,0,0|1,0,2]=4 471 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 10912 [0,1,0,0,0,0|1,1,1]=4 472 B10R1.13 NC(=S)C1=CC=C(N)C=C1 13560 [0,1,0,0,0,0|1,1,1]=4 473 B10R1.13 NC(=S)C1=CC=C(O)C=C1 13555 [0,1,0,0,0,0|0,1,1]=3 474 B10R1.13 NC1=CC=C(B(O)O)C=C1 17155 [0,1,0,0,0,0|2,0,0]=3 475 B10R1.13 NC1=CC=C(B(O)O)C=C1 1747 [0,1,0,0,0,0|2,0,0]=3 476 B10R1.13 NC1=CC=C(B(O)O)C=C1 6329 [0,1,0,0,0,0|2,0,0]=3 477 B10R1.13 NC1=CC=C(B(O)O)C=N1 25619 [0,1,0,0,0,0|3,0,0]=4 478 B10R1.13 NC1=CC=C(C(=O)O)C=C1 13422 [0,1,0,0,0,0|1,0,1]=3 479 B10R1.13 NC1=CC=C(C(F)F)C=C1 23828 [0,1,0,0,0,0|2,0,0]=3 480 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 2098 [0,1,0,0,0,0|2,0,1]=4 481 B10R1.13 NC1=CN=C(C(=O)O)C=C1 15896 [0,1,0,0,0,0|2,0,1]=4 482 B10R1.13 NC1=CN=C(C(=O)O)C=C1 17661 [0,1,0,0,0,0|2,0,1]=4 483 B10R1.13 NC1=NC=C(C(=O)O)C=C1 2417 [0,1,0,0,0,0|2,0,1]=4 484 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 16513 [0,1,0,0,0,0|1,0,2]=4 485 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 14145 [0,1,0,0,0,0|1,0,2]=4 486 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 19744 [0,1,0,0,0,0|1,0,2]=4 487 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 27236 [0,1,0,0,0,0|1,0,2]=4 488 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 3741 [0,1,0,0,0,0|1,0,1]=3 489 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 8985 [0,1,0,0,0,0|1,0,1]=3 490 B10R1.13 O=C(O)C1=CC=C(F)C=C1 8221 [0,1,0,0,0,0|1,0,1]=3 491 B10R1.13 O=C(O)C1=CC=C(I)C=C1 3928 [0,1,0,0,0,0|1,0,1]=3 492 B10R1.13 O=C(O)C1=CC=C(O)C=C1 16819 [0,1,0,0,0,0|0,0,1]=2 493 B10R1.13 O=C(O)C1=CC=C(O)N=N1 16854 [0,1,0,0,0,0|2,0,1]=4 494 B10R1.13 O=C(O)C1=CC=C(S)C=C1 6842 [0,1,0,0,0,0|0,1,1]=3 495 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 1122 [0,1,0,0,0,0|2,0,1]=4 496 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 2600 [0,1,0,0,0,0|2,0,1]=4 497 B10R1.13 O=C(O)C1=CN=C(F)C=C1 1121 [0,1,0,0,0,0|2,0,1]=4 498 B10R1.13 O=C(O)C1=CN=C(O)C=C1 15641 [0,1,0,0,0,0|1,0,1]=3 499 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 9212 [0,1,0,0,0,0|2,0,1]=4 500 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 10379 [0,1,0,0,0,0|2,0,1]=4 501 B10R1.13 O=C(O)C1=NC=C(F)C=C1 14387 [0,1,0,0,0,0|2,0,1]=4 502 B10R1.13 O=C(O)C1=NC=C(I)C=C1 27836 [0,1,0,0,0,0|2,0,1]=4 503 B10R1.13 O=C(O)C1=NC=C(O)C=C1 10094 [0,1,0,0,0,0|1,0,1]=3 504 B10R1.13 O=C(O)C1=NC=C(O)N=C1 24014 [0,1,0,0,0,0|2,0,1]=4 505 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 24616 [0,1,0,0,0,0|2,0,1]=4 506 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 2286 [0,1,0,0,0,0|2,0,1]=4 507 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 4436 [0,1,0,0,0,0|2,0,1]=4 508 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 19727 [0,1,0,0,0,0|1,0,1]=3 509 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=N1 27826 [0,1,0,0,0,0|2,0,1]=4 510 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 5422 [0,1,0,0,0,0|1,1,1]=4 511 B10R1.13 O=[N+]([O-])C1=CN=C(O)C=C1 1205 [0,1,0,0,0,0|2,0,1]=4 512 B10R1.13 O=[N+]([O-])c1ccc(Br)cc1 27491 [0,1,0,0,0,0|2,0,1]=4 513 B10R1.13 OB(O)C1=CC=C(Br)C=C1 1763 [0,1,0,0,0,0|2,0,0]=3 514 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 1798 [0,1,0,0,0,0|2,0,0]=3 515 B10R1.13 OB(O)C1=CC=C(F)C=C1 1858 [0,1,0,0,0,0|2,0,0]=3 516 B10R1.13 OB(O)C1=CC=C(I)C=C1 6160 [0,1,0,0,0,0|2,0,0]=3 517 B10R1.13 OB(O)C1=CC=C(O)C=C1 1729 [0,1,0,0,0,0|1,0,0]=2 518 B10R1.13 OB(O)C1=CC=C(S)C=C1 1862 [0,1,0,0,0,0|1,1,0]=3 519 B10R1.13 OB(O)C1=CN=C(Br)C=C1 5082 [0,1,0,0,0,0|3,0,0]=4 520 B10R1.13 OB(O)C1=CN=C(Cl)C=C1 7918 [0,1,0,0,0,0|3,0,0]=4 521 B10R1.13 OB(O)C1=CN=C(F)C=C1 7963 [0,1,0,0,0,0|3,0,0]=4 522 B10R1.13 OB(O)C1=NC=C(Cl)C=C1 13568 [0,1,0,0,0,0|3,0,0]=4 523 B10R1.13 OB(O)C1=NC=C(F)C=C1 14730 [0,1,0,0,0,0|3,0,0]=4 524 B10R1.13 OC1=CC=C(C(F)F)C=C1 19704 [0,1,0,0,0,0|1,0,0]=2 525 B10R1.25 CC1=C(C#N)C=CC(Br)=C1 4721 [0,1,0,0,0,0|2,0,1]=4 526 B10R1.25 CC1=C(C#N)C=CC(Cl)=C1 12503 [0,1,0,0,0,0|2,0,1]=4 527 B10R1.25 CC1=C(C#N)C=CC(F)=C1 1554 [0,1,0,0,0,0|2,0,1]=4 528 B10R1.25 CC1=C(C#N)C=CC(N)=C1 25751 [0,1,0,0,0,0|2,0,1]=4 529 B10R1.25 CC1=C(C#N)C=CC(O)=C1 27578 [0,1,0,0,0,0|1,0,1]=3 530 B10R1.25 CC1=C(C=O)C=CC(Br)=C1 25414 [0,1,0,0,0,0|1,0,2]=4 531 B10R1.25 CC1=C(C=O)C=CC(Cl)=C1 23457 [0,1,0,0,0,0|1,0,2]=4 532 B10R1.25 CC1=C(C=O)C=CC(F)=C1 1456 [0,1,0,0,0,0|1,0,2]=4 533 B10R1.25 CC1=C(C=O)C=CC(O)=C1 3910 [0,1,0,0,0,0|0,0,2]=3 534 B10R1.25 CC1=C(CN)C=CC(Br)=C1 19930 [0,1,0,0,0,0|2,0,0]=3 535 B10R1.25 CC1=C(CN)C=CC(O)=C1 27617 [0,1,0,0,0,0|1,0,0]=2 536 B10R1.25 CC1=C(CO)C=CC(Br)=C1 27441 [0,1,0,0,0,0|1,0,0]=2 537 B10R1.25 CC1=CC(C)=C(C=O)C=C1 3070 [0,1,0,0,0,0|1,0,2]=4 538 B10R1.25 CC1=CC(C)=C(CO)C=C1 35348 [0,1,0,0,0,0|1,0,0]=2 539 B10R1.25 CC1=CC(C)=C(NN)C=C1 6399 [0,1,0,0,0,0|3,0,0]=4 540 B10R1.25 CC1=CC(Cl)=C(C#N)C=C1 4732 [0,1,0,0,0,0|2,0,1]=4 541 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 17007 [0,1,0,0,0,0|1,0,2]=4 542 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 28906 [0,1,0,0,0,0|3,0,0]=4 543 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 35435 [0,1,0,0,0,0|3,0,0]=4 544 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 4481 [0,1,0,0,0,0|3,0,0]=4 545 B10R1.25 CC1=CC(F)=C(C#N)C=C1 1555 [0,1,0,0,0,0|2,0,1]=4 546 B10R1.25 CC1=CC(F)=C(C=O)C=C1 1451 [0,1,0,0,0,0|1,0,2]=4 547 B10R1.25 CC1=CC(N)=C(C#N)C=C1 4661 [0,1,0,0,0,0|2,0,1]=4 548 B10R1.25 CC1=CC(O)=C(C#N)C=C1 30774 [0,1,0,0,0,0|2,0,1]=4 549 B10R1.25 CC1=CC(O)=CN=C1C#N 17625 [0,1,0,0,0,0|2,0,1]=4 550 B10R1.25 CC1=CC=C(C=O)C(O)=C1 8154 [0,1,0,0,0,0|1,0,2]=4 551 B10R1.25 CC1=NC(F)=CC=C1CO 17215 [0,1,0,0,0,0|2,0,0]=3 552 B10R1.25 CCC1=C(Br)C=C(N)C=C1 27787 [0,1,0,0,0,0|2,0,0]=3 553 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 27794 [0,1,0,0,0,0|2,0,0]=3 554 B10R1.25 CNC1=C(F)C=C(F)C=C1 10041 [0,1,0,0,0,0|3,0,0]=4 555 B10R1.25 CNC1=CC=C(Br)C=C1N 34299 [0,1,0,0,0,0|3,0,0]=4 556 B10R1.25 COC1=C(Br)C=C(Br)C=C1 3847 [0,1,0,0,0,0|3,0,0]=4 557 B10R1.25 COC1=C(Br)C=C(C)C=C1 3797 [0,1,0,0,0,0|3,0,0]=4 558 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 2629 [0,1,0,0,0,0|3,0,0]=4 559 B10R1.25 COC1=C(Br)C=C(F)C=C1 1972 [0,1,0,0,0,0|3,0,0]=4 560 B10R1.25 COC1=C(Br)C=C(N)C=C1 16856 [0,1,0,0,0,0|3,0,0]=4 561 B10R1.25 COC1=C(Br)C=C(O)C=C1 31091 [0,1,0,0,0,0|2,0,0]=3 562 B10R1.25 COC1=C(Br)C=C(O)C=N1 34282 [0,1,0,0,0,0|3,0,0]=4 563 B10R1.25 COC1=C(C)C=C(Br)C=C1 3798 [0,1,0,0,0,0|3,0,0]=4 564 B10R1.25 COC1=C(C)C=C(C)C=C1 5359 [0,1,0,0,0,0|3,0,0]=4 565 B10R1.25 COC1=C(C)C=C(Cl)C=C1 2665 [0,1,0,0,0,0|3,0,0]=4 566 B10R1.25 COC1=C(C)C=C(F)C=C1 2622 [0,1,0,0,0,0|3,0,0]=4 567 B10R1.25 COC1=C(C)C=C(N)C=C1 15790 [0,1,0,0,0,0|3,0,0]=4 568 B10R1.25 COC1=C(C)C=C(O)C=C1 33186 [0,1,0,0,0,0|2,0,0]=3 569 B10R1.25 COC1=C(Cl)C=C(Br)C=C1 2630 [0,1,0,0,0,0|3,0,0]=4 570 B10R1.25 COC1=C(Cl)C=C(C)C=C1 27687 [0,1,0,0,0,0|3,0,0]=4 571 B10R1.25 COC1=C(Cl)C=C(F)C=C1 2658 [0,1,0,0,0,0|3,0,0]=4 572 B10R1.25 COC1=C(Cl)C=C(N)C=C1 17270 [0,1,0,0,0,0|3,0,0]=4 573 B10R1.25 COC1=C(Cl)C=C(O)C=C1 33443 [0,1,0,0,0,0|2,0,0]=3 574 B10R1.25 COC1=C(F)C=C(Br)C=C1 1971 [0,1,0,0,0,0|3,0,0]=4 575 B10R1.25 COC1=C(F)C=C(C)C=C1 24850 [0,1,0,0,0,0|3,0,0]=4 576 B10R1.25 COC1=C(F)C=C(Cl)C=C1 2662 [0,1,0,0,0,0|3,0,0]=4 577 B10R1.25 COC1=C(F)C=C(F)C=C1 3455 [0,1,0,0,0,0|3,0,0]=4 578 B10R1.25 COC1=C(F)C=C(N)C=C1 2125 [0,1,0,0,0,0|3,0,0]=4 579 B10R1.25 COC1=C(F)C=C(O)C=C1 2369 [0,1,0,0,0,0|2,0,0]=3 580 B10R1.25 COC1=C(F)C=C(S)C=C1 6875 [0,1,0,0,0,0|2,1,0]=4 581 B10R1.25 COC1=C(I)C=C(Cl)C=C1 14310 [0,1,0,0,0,0|3,0,0]=4 582 B10R1.25 COC1=C(I)C=C(N)C=C1 3307 [0,1,0,0,0,0|3,0,0]=4 583 B10R1.25 COC1=C(I)C=C(N)C=C1 3310 [0,1,0,0,0,0|3,0,0]=4 584 B10R1.25 COC1=C(N)C=C(F)C=C1 2256 [0,1,0,0,0,0|3,0,0]=4 585 B10R1.25 COC1=C(N)C=C(I)C=C1 28345 [0,1,0,0,0,0|3,0,0]=4 586 B10R1.25 COC1=C(N)C=C(N)C=C1 1905 [0,1,0,0,0,0|3,0,0]=4 587 B10R1.25 COC1=C(N)C=C(N)C=C1 24784 [0,1,0,0,0,0|3,0,0]=4 588 B10R1.25 COC1=C(N)C=C(N)C=C1 4107 [0,1,0,0,0,0|3,0,0]=4 589 B10R1.25 COC1=C(O)C=C(Br)C=C1 26431 [0,1,0,0,0,0|3,0,0]=4 590 B10R1.25 COC1=C(O)C=C(C)C=C1 31088 [0,1,0,0,0,0|3,0,0]=4 591 B10R1.25 COC1=C(O)C=C(F)C=C1 3882 [0,1,0,0,0,0|3,0,0]=4 592 B10R1.25 COC1=C(O)C=C(N)C=C1 3112 [0,1,0,0,0,0|3,0,0]=4 593 B10R1.25 COc1ccc(Cl)cc1O 31127 [0,1,0,0,0,0|3,0,0]=4 594 B10R1.25 CSC1=C(C)C=C(O)C=C1 10656 [0,1,0,0,0,0|2,0,0]=3 595 B10R1.25 CSC1=C(F)C=C(F)C=C1 10719 [0,1,0,0,0,0|3,0,0]=4 596 B10R1.25 ClC1=C(CBr)C=CC(Br)=C1 31300 [0,1,0,0,0,0|2,0,0]=3 597 B10R1.25 ClC1=CC(Cl)=C(CBr)C=C1 27460 [0,1,0,0,0,0|2,0,0]=3 598 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 16507 [0,1,0,0,0,0|2,0,0]=3 599 B10R1.25 ClCc1ccc(Cl)nc1Cl 20811 [0,1,0,0,0,0|3,0,0]=4 600 B10R1.25 FC1=C(CBr)C=CC(Br)=C1 4887 [0,1,0,0,0,0|2,0,0]=3 601 B10R1.25 FC1=C(CBr)C=CC(Cl)=C1 4897 [0,1,0,0,0,0|2,0,0]=3 602 B10R1.25 FC1=CC(Br)=C(CBr)C=C1 4883 [0,1,0,0,0,0|2,0,0]=3 603 B10R1.25 FC1=CC(Cl)=C(CBr)C=C1 4893 [0,1,0,0,0,0|2,0,0]=3 604 B10R1.25 FC1=CC(Cl)=C(CCl)C=C1 36215 [0,1,0,0,0,0|2,0,0]=3 605 B10R1.25 FC1=CC(F)=C(CBr)C=C1 4911 [0,1,0,0,0,0|2,0,0]=3 606 B10R1.25 FC1=CC(F)=C(CCl)C=C1 4912 [0,1,0,0,0,0|2,0,0]=3 607 B10R1.25 N#CC1=C(Br)C=C(Cl)C=C1 27222 [0,1,0,0,0,0|2,0,1]=4 608 B10R1.25 N#CC1=C(Br)C=C(F)C=C1 3217 [0,1,0,0,0,0|2,0,1]=4 609 B10R1.25 N#CC1=C(Br)C=C(I)C=C1 25241 [0,1,0,0,0,0|2,0,1]=4 610 B10R1.25 N#CC1=C(Br)C=C(N)C=C1 30789 [0,1,0,0,0,0|2,0,1]=4 611 B10R1.25 N#CC1=C(Cl)C=C(Br)C=C1 12801 [0,1,0,0,0,0|2,0,1]=4 612 B10R1.25 N#CC1=C(Cl)C=C(F)C=C1 3422 [0,1,0,0,0,0|2,0,1]=4 613 B10R1.25 N#CC1=C(Cl)C=C(N)C=C1 4620 [0,1,0,0,0,0|2,0,1]=4 614 B10R1.25 N#CC1=C(Cl)C=C(O)C=C1 4727 [0,1,0,0,0,0|1,0,1]=3 615 B10R1.25 N#CC1=C(F)C=C(Br)C=C1 3221 [0,1,0,0,0,0|2,0,1]=4 616 B10R1.25 N#CC1=C(F)C=C(Cl)C=C1 3424 [0,1,0,0,0,0|2,0,1]=4 617 B10R1.25 N#CC1=C(F)C=C(F)C=C1 1563 [0,1,0,0,0,0|2,0,1]=4 618 B10R1.25 N#CC1=C(F)C=C(I)C=C1 4778 [0,1,0,0,0,0|2,0,1]=4 619 B10R1.25 N#CC1=C(F)C=C(N)C=C1 4646 [0,1,0,0,0,0|2,0,1]=4 620 B10R1.25 N#CC1=C(F)C=C(O)C=C1 2866 [0,1,0,0,0,0|1,0,1]=3 621 B10R1.25 N#CC1=C(F)C=C(O)C=C1 3495 [0,1,0,0,0,0|1,0,1]=3 622 B10R1.25 N#CC1=C(I)C=C(Cl)C=C1 30845 [0,1,0,0,0,0|2,0,1]=4 623 B10R1.25 N#CC1=C(I)C=C(F)C=C1 25394 [0,1,0,0,0,0|2,0,1]=4 624 B10R1.25 N#CC1=C(I)C=C(N)C=C1 18486 [0,1,0,0,0,0|2,0,1]=4 625 B10R1.25 N#CC1=C(N)C=C(Br)C=C1 12350 [0,1,0,0,0,0|2,0,1]=4 626 B10R1.25 N#CC1=C(N)C=C(Cl)C=C1 20756 [0,1,0,0,0,0|2,0,1]=4 627 B10R1.25 N#CC1=C(N)C=C(F)C=C1 18459 [0,1,0,0,0,0|2,0,1]=4 628 B10R1.25 N#CC1=C(O)C=C(Br)C=C1 3781 [0,1,0,0,0,0|2,0,1]=4 629 B10R1.25 N#CC1=C(O)C=C(Cl)C=C1 28727 [0,1,0,0,0,0|2,0,1]=4 630 B10R1.25 N#CC1=C(O)C=C(F)C=C1 26276 [0,1,0,0,0,0|2,0,1]=4 631 B10R1.25 N#CC1=C(O)C=C(N)C=C1 27615 [0,1,0,0,0,0|2,0,1]=4 632 B10R1.25 N#CC1=C(O)C=C(O)C=C1 13114 [0,1,0,0,0,0|1,0,1]=3 633 B10R1.25 NC1=C(C=O)C=CC(F)=C1 27192 [0,1,0,0,0,0|1,0,2]=4 634 B10R1.25 NC1=C(CO)C=CC(Br)=C1 31328 [0,1,0,0,0,0|1,0,0]=2 635 B10R1.25 NC1=CC(I)=C(C=O)C=C1 16530 [0,1,0,0,0,0|1,0,2]=4 636 B10R1.25 NC1=NC=C(CO)C(N)=N1 21449 [0,1,0,0,0,0|3,0,0]=4 637 B10R1.25 NCC1=C(Cl)C=C(F)C=C1 25411 [0,1,0,0,0,0|2,0,0]=3 638 B10R1.25 NCC1=C(F)C=C(Br)C=C1 12660 [0,1,0,0,0,0|2,0,0]=3 639 B10R1.25 NCC1=C(F)C=C(Br)C=C1 4709 [0,1,0,0,0,0|2,0,0]=3 640 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 27456 [0,1,0,0,0,0|2,0,0]=3 641 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 3428 [0,1,0,0,0,0|2,0,0]=3 642 B10R1.25 NCC1=C(F)C=C(F)C=C1 4399 [0,1,0,0,0,0|2,0,0]=3 643 B10R1.25 NNC1=C(Cl)C=C(Cl)C=C1 4486 [0,1,0,0,0,0|3,0,0]=4 644 B10R1.25 NNC1=C(Cl)C=C(Cl)C=C1 7524 [0,1,0,0,0,0|3,0,0]=4 645 B10R1.25 NNC1=C(Cl)C=C(F)C=C1 4469 [0,1,0,0,0,0|3,0,0]=4 646 B10R1.25 NNC1=C(F)C=C(Br)C=C1 4467 [0,1,0,0,0,0|3,0,0]=4 647 B10R1.25 NNC1=C(F)C=C(F)C=C1 3498 [0,1,0,0,0,0|3,0,0]=4 648 B10R1.25 NNC1=C(F)C=C(I)C=C1 3359 [0,1,0,0,0,0|3,0,0]=4 649 B10R1.25 O=CC1=C(Br)C=C(Br)C=C1 28404 [0,1,0,0,0,0|1,0,2]=4 650 B10R1.25 O=CC1=C(Br)C=C(Cl)C=C1 16872 [0,1,0,0,0,0|1,0,2]=4 651 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 2877 [0,1,0,0,0,0|1,0,2]=4 652 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 30961 [0,1,0,0,0,0|1,0,2]=4 653 B10R1.25 O=CC1=C(Br)C=C(O)C=C1 28099 [0,1,0,0,0,0|0,0,2]=3 654 B10R1.25 O=CC1=C(Cl)C=C(Br)C=C1 24612 [0,1,0,0,0,0|1,0,2]=4 655 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 1433 [0,1,0,0,0,0|1,0,2]=4 656 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 7366 [0,1,0,0,0,0|0,0,2]=3 657 B10R1.25 O=CC1=C(F)C=C(Br)C=C1 1421 [0,1,0,0,0,0|1,0,2]=4 658 B10R1.25 O=CC1=C(F)C=C(Cl)C=C1 1435 [0,1,0,0,0,0|1,0,2]=4 659 B10R1.25 O=CC1=C(F)C=C(F)C=C1 2903 [0,1,0,0,0,0|1,0,2]=4 660 B10R1.25 O=CC1=C(F)C=C(I)C=C1 4219 [0,1,0,0,0,0|1,0,2]=4 661 B10R1.25 O=CC1=C(F)C=C(O)C=C1 1442 [0,1,0,0,0,0|0,0,2]=3 662 B10R1.25 O=CC1=C(I)C=C(Cl)C=C1 22996 [0,1,0,0,0,0|1,0,2]=4 663 B10R1.25 O=CC1=C(I)C=C(F)C=C1 22995 [0,1,0,0,0,0|1,0,2]=4 664 B10R1.25 O=CC1=C(I)C=C(O)C=C1 28098 [0,1,0,0,0,0|0,0,2]=3 665 B10R1.25 O=CC1=C(O)C=C(Br)C=C1 16944 [0,1,0,0,0,0|1,0,2]=4 666 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 22142 [0,1,0,0,0,0|1,0,2]=4 667 B10R1.25 O=CC1=C(O)C=C(F)C=C1 8483 [0,1,0,0,0,0|1,0,2]=4 668 B10R1.25 O=CC1=C(O)C=C(O)C=C1 8218 [0,1,0,0,0,0|0,0,2]=3 669 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 9781 [0,1,0,0,0,0|1,0,0]=2 670 B10R1.25 OCC1=C(Br)C=C(F)C=C1 3222 [0,1,0,0,0,0|1,0,0]=2 671 B10R1.25 OCC1=C(Br)C=C(I)C=C1 31340 [0,1,0,0,0,0|1,0,0]=2 672 B10R1.25 OCC1=C(Cl)C=C(Cl)C=C1 9993 [0,1,0,0,0,0|1,0,0]=2 673 B10R1.25 OCC1=C(Cl)C=C(F)C=C1 3426 [0,1,0,0,0,0|1,0,0]=2 674 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 31313 [0,1,0,0,0,0|0,0,0]=1 675 B10R1.25 OCC1=C(F)C=C(Br)C=C1 3223 [0,1,0,0,0,0|1,0,0]=2 676 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 26669 [0,1,0,0,0,0|1,0,0]=2 677 B10R1.25 OCC1=C(F)C=C(F)C=C1 4910 [0,1,0,0,0,0|1,0,0]=2 678 B10R1.25 OCC1=C(I)C=C(F)C=C1 31350 [0,1,0,0,0,0|1,0,0]=2 679 B10R1.25 OCC1=C(O)C=C(Br)C=C1 15237 [0,1,0,0,0,0|1,0,0]=2 680 B10R1.176 C=CC1=CC(O)=C(O)C=C1 35519 [0,1,0,0,0,0|1,0,1]=3 681 B10R1.176 CC1=C(Br)C=C(C#N)C=C1 11163 [0,1,0,0,0,0|2,0,1]=4 682 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 24757 [0,1,0,0,0,0|1,0,2]=4 683 B10R1.176 CC1=C(Br)C=CC(C#N)=C1 3808 [0,1,0,0,0,0|2,0,1]=4 684 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 30935 [0,1,0,0,0,0|1,0,2]=4 685 B10R1.176 CC1=C(Br)C=CC(CBr)=C1 24290 [0,1,0,0,0,0|2,0,0]=3 686 B10R1.176 CC1=C(C)C=C(C#N)C=C1 14892 [0,1,0,0,0,0|2,0,1]=4 687 B10R1.176 CC1=C(C)C=C(C=O)C=C1 2535 [0,1,0,0,0,0|1,0,2]=4 688 B10R1.176 CC1=C(C)C=C(CCl)C=C1 14890 [0,1,0,0,0,0|2,0,0]=3 689 B10R1.176 CC1=C(C)C=C(CN)C=C1 4412 [0,1,0,0,0,0|2,0,0]=3 690 B10R1.176 CC1=C(C)C=C(CO)C=C1 2161 [0,1,0,0,0,0|1,0,0]=2 691 B10R1.176 CC1=C(C)C=C(NN)C=C1 19865 [0,1,0,0,0,0|3,0,0]=4 692 B10R1.176 CC1=C(C)C=C(NN)C=C1 21448 [0,1,0,0,0,0|3,0,0]=4 693 B10R1.176 CC1=C(C)C=C(NN)C=C1 7555 [0,1,0,0,0,0|3,0,0]=4 694 B10R1.176 CC1=C(Cl)C=C(C#N)C=C1 4733 [0,1,0,0,0,0|2,0,1]=4 695 B10R1.176 CC1=C(Cl)C=C(C=O)C=C1 4183 [0,1,0,0,0,0|1,0,2]=4 696 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 27458 [0,1,0,0,0,0|2,0,0]=3 697 B10R1.176 CC1=C(Cl)C=C(CO)C=N1 17092 [0,1,0,0,0,0|2,0,0]=3 698 B10R1.176 CC1=C(Cl)C=CC(C#N)=C1 8005 [0,1,0,0,0,0|2,0,1]=4 699 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 28400 [0,1,0,0,0,0|1,0,2]=4 700 B10R1.176 CC1=C(F)C=C(C#N)C=C1 1557 [0,1,0,0,0,0|2,0,1]=4 701 B10R1.176 CC1=C(F)C=C(C=O)C=C1 1454 [0,1,0,0,0,0|1,0,2]=4 702 B10R1.176 CC1=C(F)C=C(CN)C=C1 16749 [0,1,0,0,0,0|2,0,0]=3 703 B10R1.176 CC1=C(F)C=C(NN)C=C1 3343 [0,1,0,0,0,0|3,0,0]=4 704 B10R1.176 CC1=C(F)C=C(NN)C=C1 4493 [0,1,0,0,0,0|3,0,0]=4 705 B10R1.176 CC1=C(F)C=CC(C#N)=C1 1553 [0,1,0,0,0,0|2,0,1]=4 706 B10R1.176 CC1=C(F)C=CC(C=O)=C1 1457 [0,1,0,0,0,0|1,0,2]=4 707 B10R1.176 CC1=C(F)C=CC(CN)=C1 4495 [0,1,0,0,0,0|2,0,0]=3 708 B10R1.176 CC1=C(I)C=C(C#N)C=C1 23826 [0,1,0,0,0,0|2,0,1]=4 709 B10R1.176 CC1=C(N)C=C(C#N)C=C1 4665 [0,1,0,0,0,0|2,0,1]=4 710 B10R1.176 CC1=C(N)C=CC(C#N)=C1 4667 [0,1,0,0,0,0|2,0,1]=4 711 B10R1.176 CC1=C(O)C=C(C#N)C=C1 19802 [0,1,0,0,0,0|2,0,1]=4 712 B10R1.176 CC1=C(O)C=CC(C=O)=C1 8134 [0,1,0,0,0,0|0,0,2]=3 713 B10R1.176 CC1=CC(C=O)=CN=C1O 27644 [0,1,0,0,0,0|1,0,2]=4 714 B10R1.176 CCC1=CC(Br)=C(N)C=C1 5314 [0,1,0,0,0,0|2,0,0]=3 715 B10R1.176 CCC1=CC(N)=C(O)C=C1 27789 [0,1,0,0,0,0|1,0,0]=2 716 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 3644 [0,1,0,0,0,0|2,0,0]=3 717 B10R1.176 CCC1=CC=C(N)C(N)=C1 31890 [0,1,0,0,0,0|2,0,0]=3 718 B10R1.176 CCC1=CC=C(O)C(O)=C1 28104 [0,1,0,0,0,0|1,0,0]=2 719 B10R1.176 CNC1=CC(Cl)=C(Cl)C=C1 28299 [0,1,0,0,0,0|3,0,0]=4 720 B10R1.176 COC1=CC(Br)=C(Br)C=C1 4110 [0,1,0,0,0,0|3,0,0]=4 721 B10R1.176 COC1=CC(Br)=C(C)C=C1 24319 [0,1,0,0,0,0|3,0,0]=4 722 B10R1.176 COC1=CC(Br)=C(Cl)C=C1 4555 [0,1,0,0,0,0|3,0,0]=4 723 B10R1.176 COC1=CC(Br)=C(F)C=C1 28354 [0,1,0,0,0,0|3,0,0]=4 724 B10R1.176 COC1=CC(Br)=C(N)C=C1 31003 [0,1,0,0,0,0|3,0,0]=4 725 B10R1.176 COC1=CC(Br)=C(N)C=C1 4332 [0,1,0,0,0,0|3,0,0]=4 726 B10R1.176 COC1=CC(Br)=C(O)C=C1 4135 [0,1,0,0,0,0|2,0,0]=3 727 B10R1.176 COC1=CC(C)=C(Br)C=C1 3796 [0,1,0,0,0,0|3,0,0]=4 728 B10R1.176 COC1=CC(C)=C(C)C=C1 5361 [0,1,0,0,0,0|3,0,0]=4 729 B10R1.176 COC1=CC(C)=C(Cl)C=C1 2666 [0,1,0,0,0,0|3,0,0]=4 730 B10R1.176 COC1=CC(C)=C(F)C=C1 2623 [0,1,0,0,0,0|3,0,0]=4 731 B10R1.176 COC1=CC(C)=C(N)C=C1 28347 [0,1,0,0,0,0|3,0,0]=4 732 B10R1.176 COC1=CC(C)=C(O)C=C1 31104 [0,1,0,0,0,0|2,0,0]=3 733 B10R1.176 COC1=CC(C)=C(S)C=C1 6886 [0,1,0,0,0,0|2,1,0]=4 734 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 2631 [0,1,0,0,0,0|3,0,0]=4 735 B10R1.176 COC1=CC(Cl)=C(C)C=C1 4101 [0,1,0,0,0,0|3,0,0]=4 736 B10R1.176 COC1=CC(Cl)=C(Cl)C=C1 3683 [0,1,0,0,0,0|3,0,0]=4 737 B10R1.176 COC1=CC(Cl)=C(F)C=C1 2660 [0,1,0,0,0,0|3,0,0]=4 738 B10R1.176 COC1=CC(Cl)=C(I)C=C1 27614 [0,1,0,0,0,0|3,0,0]=4 739 B10R1.176 COC1=CC(Cl)=C(N)C=C1 27577 [0,1,0,0,0,0|3,0,0]=4 740 B10R1.176 COC1=CC(Cl)=C(O)C=C1 3663 [0,1,0,0,0,0|2,0,0]=3 741 B10R1.176 COC1=CC(F)=C(Br)C=C1 1970 [0,1,0,0,0,0|3,0,0]=4 742 B10R1.176 COC1=CC(F)=C(Br)C=C1 20025 [0,1,0,0,0,0|3,0,0]=4 743 B10R1.176 COC1=CC(F)=C(C)C=C1 2621 [0,1,0,0,0,0|3,0,0]=4 744 B10R1.176 COC1=CC(F)=C(Cl)C=C1 2663 [0,1,0,0,0,0|3,0,0]=4 745 B10R1.176 COC1=CC(F)=C(F)C=C1 3457 [0,1,0,0,0,0|3,0,0]=4 746 B10R1.176 COC1=CC(F)=C(N)C=C1 15755 [0,1,0,0,0,0|3,0,0]=4 747 B10R1.176 COC1=CC(F)=C(O)C=C1 15011 [0,1,0,0,0,0|2,0,0]=3 748 B10R1.176 COC1=CC(I)=C(Br)C=C1 5347 [0,1,0,0,0,0|3,0,0]=4 749 B10R1.176 COC1=CC(I)=C(Cl)C=C1 5291 [0,1,0,0,0,0|3,0,0]=4 750 B10R1.176 COC1=CC(I)=C(N)C=C1 10738 [0,1,0,0,0,0|3,0,0]=4 751 B10R1.176 COC1=CC(N)=C(Br)C=C1 5335 [0,1,0,0,0,0|3,0,0]=4 752 B10R1.176 COC1=CC(N)=C(Br)C=C1 5367 [0,1,0,0,0,0|3,0,0]=4 753 B10R1.176 COC1=CC(N)=C(C)C=C1 19827 [0,1,0,0,0,0|3,0,0]=4 754 B10R1.176 COC1=CC(N)=C(Cl)C=C1 3658 [0,1,0,0,0,0|3,0,0]=4 755 B10R1.176 COC1=CC(N)=C(Cl)C=C1 3660 [0,1,0,0,0,0|3,0,0]=4 756 B10R1.176 COC1=CC(N)=C(F)C=C1 15806 [0,1,0,0,0,0|3,0,0]=4 757 B10R1.176 COC1=CC(N)=C(I)C=C1 31005 [0,1,0,0,0,0|3,0,0]=4 758 B10R1.176 COC1=CC(N)=C(N)C=C1 28370 [0,1,0,0,0,0|3,0,0]=4 759 B10R1.176 COC1=CC(N)=C(N)C=C1 28371 [0,1,0,0,0,0|3,0,0]=4 760 B10R1.176 COC1=CC(O)=C(Br)C=C1 13262 [0,1,0,0,0,0|3,0,0]=4 761 B10R1.176 COC1=CC(O)=C(C)C=C1 31114 [0,1,0,0,0,0|3,0,0]=4 762 B10R1.176 COC1=CC(O)=C(Cl)C=C1 10217 [0,1,0,0,0,0|3,0,0]=4 763 B10R1.176 COC1=CC(O)=C(F)C=C1 33440 [0,1,0,0,0,0|3,0,0]=4 764 B10R1.176 COC1=CC(S)=C(N)C=C1 21901 [0,1,0,0,0,0|3,0,0]=4 765 B10R1.176 COC1=CC=C(O)C(O)=C1 33439 [0,1,0,0,0,0|2,0,0]=3 766 B10R1.176 COc1ccc(Br)c(N)c1 26521 [0,1,0,0,0,0|3,0,0]=4 767 B10R1.176 Cc1ccc(CO)cc1Cl 23926 [0,1,0,0,0,0|1,0,0]=2 768 B10R1.176 ClCC1=CC(Cl)=C(Cl)C=C1 13717 [0,1,0,0,0,0|2,0,0]=3 769 B10R1.176 FC1=C(Br)C=C(CBr)C=C1 26631 [0,1,0,0,0,0|2,0,0]=3 770 B10R1.176 FC1=C(Br)C=CC(CBr)=C1 24015 [0,1,0,0,0,0|2,0,0]=3 771 B10R1.176 FC1=C(Cl)C=C(CBr)C=C1 2130 [0,1,0,0,0,0|2,0,0]=3 772 B10R1.176 FC1=C(Cl)C=CC(CBr)=C1 4898 [0,1,0,0,0,0|2,0,0]=3 773 B10R1.176 FC1=C(Cl)C=CC(CCl)=C1 10205 [0,1,0,0,0,0|2,0,0]=3 774 B10R1.176 FC1=C(F)C=C(CBr)C=C1 4917 [0,1,0,0,0,0|2,0,0]=3 775 B10R1.176 FC1=C(F)C=C(CCl)C=C1 7357 [0,1,0,0,0,0|2,0,0]=3 776 B10R1.176 FC1=C(I)C=CC(CBr)=C1 31348 [0,1,0,0,0,0|2,0,0]=3 777 B10R1.176 N#CC1=CC(Br)=C(Cl)C=C1 28714 [0,1,0,0,0,0|2,0,1]=4 778 B10R1.176 N#CC1=CC(Br)=C(F)C=C1 1580 [0,1,0,0,0,0|2,0,1]=4 779 B10R1.176 N#CC1=CC(Br)=C(N)C=C1 4609 [0,1,0,0,0,0|2,0,1]=4 780 B10R1.176 N#CC1=CC(Br)=C(O)C=C1 3780 [0,1,0,0,0,0|1,0,1]=3 781 B10R1.176 N#CC1=CC(Cl)=C(Br)C=C1 12803 [0,1,0,0,0,0|2,0,1]=4 782 B10R1.176 N#CC1=CC(Cl)=C(F)C=C1 1561 [0,1,0,0,0,0|2,0,1]=4 783 B10R1.176 N#CC1=CC(Cl)=C(N)C=C1 4625 [0,1,0,0,0,0|2,0,1]=4 784 B10R1.176 N#CC1=CC(Cl)=C(O)C=C1 4726 [0,1,0,0,0,0|1,0,1]=3 785 B10R1.176 N#CC1=CC(F)=C(Br)C=C1 4707 [0,1,0,0,0,0|2,0,1]=4 786 B10R1.176 N#CC1=CC(F)=C(Cl)C=C1 1560 [0,1,0,0,0,0|2,0,1]=4 787 B10R1.176 N#CC1=CC(F)=C(F)C=C1 1562 [0,1,0,0,0,0|2,0,1]=4 788 B10R1.176 N#CC1=CC(F)=C(I)C=C1 4781 [0,1,0,0,0,0|2,0,1]=4 789 B10R1.176 N#CC1=CC(F)=C(N)C=C1 4648 [0,1,0,0,0,0|2,0,1]=4 790 B10R1.176 N#CC1=CC(F)=C(O)C=C1 2610 [0,1,0,0,0,0|1,0,1]=3 791 B10R1.176 N#CC1=CC(I)=C(Cl)C=C1 30792 [0,1,0,0,0,0|2,0,1]=4 792 B10R1.176 N#CC1=CC(I)=C(F)C=C1 33427 [0,1,0,0,0,0|2,0,1]=4 793 B10R1.176 N#CC1=CC(N)=C(Br)C=C1 30835 [0,1,0,0,0,0|2,0,1]=4 794 B10R1.176 N#CC1=CC(N)=C(F)C=C1 4645 [0,1,0,0,0,0|2,0,1]=4 795 B10R1.176 N#CC1=CC(N)=C(I)C=C1 30806 [0,1,0,0,0,0|2,0,1]=4 796 B10R1.176 N#CC1=CC(N)=C(N)C=C1 2547 [0,1,0,0,0,0|2,0,1]=4 797 B10R1.176 N#CC1=CC(O)=C(Br)C=C1 33768 [0,1,0,0,0,0|2,0,1]=4 798 B10R1.176 N#CC1=CC(O)=C(Cl)C=C1 27837 [0,1,0,0,0,0|2,0,1]=4 799 B10R1.176 N#CC1=CC(O)=C(F)C=C1 28107 [0,1,0,0,0,0|2,0,1]=4 800 B10R1.176 N#CC1=CC(O)=C(I)C=C1 28752 [0,1,0,0,0,0|2,0,1]=4 801 B10R1.176 N#CC1=CC(O)=C(O)C=C1 3120 [0,1,0,0,0,0|1,0,1]=3 802 B10R1.176 N#Cc1ccc(Cl)c(Cl)c1 3688 [0,1,0,0,0,0|2,0,1]=4 803 B10R1.176 NCC1=CC(Br)=C(F)C=C1 3226 [0,1,0,0,0,0|2,0,0]=3 804 B10R1.176 NCC1=CC(Cl)=C(Cl)C=C1 11054 [0,1,0,0,0,0|2,0,0]=3 805 B10R1.176 NCC1=CC(Cl)=C(F)C=C1 4375 [0,1,0,0,0,0|2,0,0]=3 806 B10R1.176 NCC1=CC(F)=C(F)C=C1 1918 [0,1,0,0,0,0|2,0,0]=3 807 B10R1.176 NCC1=CC(O)=C(O)C=C1 21986 [0,1,0,0,0,0|1,0,0]=2 808 B10R1.176 NNC1=CC(Cl)=C(Cl)C=C1 20780 [0,1,0,0,0,0|3,0,0]=4 809 B10R1.176 NNC1=CC(Cl)=C(Cl)C=C1 7530 [0,1,0,0,0,0|3,0,0]=4 810 B10R1.176 NNC1=CC(Cl)=C(F)C=C1 3507 [0,1,0,0,0,0|3,0,0]=4 811 B10R1.176 NNC1=CC(F)=C(F)C=C1 1084 [0,1,0,0,0,0|3,0,0]=4 812 B10R1.176 NNC1=CC(F)=C(F)C=C1 16451 [0,1,0,0,0,0|3,0,0]=4 813 B10R1.176 O=CC1=CC(Br)=C(Cl)C=C1 7763 [0,1,0,0,0,0|1,0,2]=4 814 B10R1.176 O=CC1=CC(Br)=C(F)C=C1 2878 [0,1,0,0,0,0|1,0,2]=4 815 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 3778 [0,1,0,0,0,0|0,0,2]=3 816 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 8230 [0,1,0,0,0,0|1,0,2]=4 817 B10R1.176 O=CC1=CC(Cl)=C(F)C=C1 1409 [0,1,0,0,0,0|1,0,2]=4 818 B10R1.176 O=CC1=CC(Cl)=C(O)C=C1 7764 [0,1,0,0,0,0|0,0,2]=3 819 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 4033 [0,1,0,0,0,0|1,0,2]=4 820 B10R1.176 O=CC1=CC(F)=C(Cl)C=C1 1412 [0,1,0,0,0,0|1,0,2]=4 821 B10R1.176 O=CC1=CC(F)=C(F)C=C1 1413 [0,1,0,0,0,0|1,0,2]=4 822 B10R1.176 O=CC1=CC(F)=C(I)C=C1 1440 [0,1,0,0,0,0|1,0,2]=4 823 B10R1.176 O=CC1=CC(F)=C(O)C=C1 1443 [0,1,0,0,0,0|0,0,2]=3 824 B10R1.176 O=CC1=CC(F)=C(O)C=C1 30905 [0,1,0,0,0,0|0,0,2]=3 825 B10R1.176 O=CC1=CC(I)=C(Br)C=C1 28095 [0,1,0,0,0,0|1,0,2]=4 826 B10R1.176 O=CC1=CC(I)=C(Cl)C=C1 28096 [0,1,0,0,0,0|1,0,2]=4 827 B10R1.176 O=CC1=CC(I)=C(F)C=C1 5255 [0,1,0,0,0,0|1,0,2]=4 828 B10R1.176 O=CC1=CC(I)=C(I)C=C1 28094 [0,1,0,0,0,0|1,0,2]=4 829 B10R1.176 O=CC1=CC(O)=C(Br)C=C1 16848 [0,1,0,0,0,0|1,0,2]=4 830 B10R1.176 O=CC1=CC(O)=C(Cl)C=C1 30917 [0,1,0,0,0,0|1,0,2]=4 831 B10R1.176 O=CC1=CC(O)=C(I)C=C1 8597 [0,1,0,0,0,0|1,0,2]=4 832 B10R1.176 O=CC1=CC(O)=C(O)C=C1 8231 [0,1,0,0,0,0|0,0,2]=3 833 B10R1.176 O=CC1=CN=C(O)C(Cl)=C1 17091 [0,1,0,0,0,0|1,0,2]=4 834 B10R1.176 OCC1=CC(Br)=C(F)C=C1 4884 [0,1,0,0,0,0|1,0,0]=2 835 B10R1.176 OCC1=CC(Cl)=C(Cl)C=C1 20761 [0,1,0,0,0,0|1,0,0]=2 836 B10R1.176 OCC1=CC(Cl)=C(Cl)N=C1 17123 [0,1,0,0,0,0|2,0,0]=3 837 B10R1.176 OCC1=CC(F)=C(F)C=C1 4916 [0,1,0,0,0,0|1,0,0]=2 838 B10R1.176 OCC1=CC(F)=C(I)C=C1 31282 [0,1,0,0,0,0|1,0,0]=2 839 B10R1.176 OCC1=CC(O)=C(F)C=C1 35161 [0,1,0,0,0,0|1,0,0]=2 840 B10R1.176 OCC1=CC(O)=C(I)C=C1 28804 [0,1,0,0,0,0|1,0,0]=2 841 B10R1.176 OCC1=CC(O)=C(O)C=C1 3025 [0,1,0,0,0,0|0,0,0]=1 842 B10R1.176 OCC1=NC=C(F)C(Cl)=C1 32243 [0,1,0,0,0,0|2,0,0]=3 843 B8R1.1 CC1=CC(CO)=NO1 8686 [0,0,0,0,1,0|3,0,0]=4 844 B8R1.1 CC1=CC=C(CN)O1 6995 [0,0,0,0,1,0|3,0,0]=4 845 B8R1.1 CC1=CC=C(CO)O1 9804 [0,0,0,0,1,0|2,0,0]=3 846 B8R1.1 CN1C=C(CO)C=N1 13305 [0,0,0,0,1,0|3,0,0]=4 847 B8R1.1 CN1C=CC(CO)=N1 23752 [0,0,0,0,1,0|3,0,0]=4 848 B8R1.1 COC1=CC=C(O)O1 22256 [0,0,0,0,1,0|3,0,0]=4 849 B8R1.1 NC1=NC(CO)=CS1 8902 [0,0,0,0,1,0|3,0,0]=4 850 B8R1.1 NCC1=CC(Br)=CS1 17856 [0,0,0,0,1,0|3,0,0]=4 851 B8R1.1 O=C1C=C[C@@H](CO)O1 7063 [0,0,0,0,1,0|1,0,2]=4 852 B8R1.1 OCC1=COC(Cl)=N1 23957 [0,0,0,0,1,0|3,0,0]=4 853 B7R0.6 O=C(O)\C=C\C(=O)O 21784 [1,0,1,0,0,0|2,0,0]=4 854 B7R1.3 BrC1=CC=CN=C1 2571 [2,0,0,0,0,0|2,0,0]=4 855 B7R1.3 BrC1=CC=NC=C1 15950 [2,0,0,0,0,0|2,0,0]=4 856 B7R1.3 BrC1=CC=NC=C1 2589 [2,0,0,0,0,0|2,0,0]=4 857 B7R1.3 BrC1=NC=CC=C1 2570 [2,0,0,0,0,0|2,0,0]=4 858 B7R1.3 CC1=CC=CN=N1 17696 [2,0,0,0,0,0|2,0,0]=4 859 B7R1.3 CC1=CN=CN=C1 7207 [2,0,0,0,0,0|2,0,0]=4 860 B7R1.3 CC1=NC=CC=C1 15899 [2,0,0,0,0,0|1,0,0]=3 861 B7R1.3 CC1=NC=CC=N1 21974 [2,0,0,0,0,0|2,0,0]=4 862 B7R1.3 CC1=NC=CN=C1 8601 [2,0,0,0,0,0|2,0,0]=4 863 B7R1.3 CC1=NC=NC=C1 20803 [2,0,0,0,0,0|2,0,0]=4 864 B7R1.3 Cc1ccccn1 18185 [2,0,0,0,0,0|1,0,0]=3 865 B7R1.3 ClC1=CC=CN=C1 2576 [2,0,0,0,0,0|2,0,0]=4 866 B7R1.3 ClC1=CC=NC=C1 1195 [2,0,0,0,0,0|2,0,0]=4 867 B7R1.3 ClC1=CC=NC=C1 23503 [2,0,0,0,0,0|2,0,0]=4 868 B7R1.3 ClC1=NC=CC=C1 13200 [2,0,0,0,0,0|2,0,0]=4 869 B7R1.3 FC1=CC=CC=C1 29401 [2,0,0,0,0,0|1,0,0]=3 870 B7R1.3 FC1=CC=CN=C1 1095 [2,0,0,0,0,0|2,0,0]=4 871 B7R1.3 FC1=CC=NC=C1 14322 [2,0,0,0,0,0|2,0,0]=4 872 B7R1.3 FC1=CC=NC=C1 2616 [2,0,0,0,0,0|2,0,0]=4 873 B7R1.3 FC1=NC=CC=C1 1094 [2,0,0,0,0,0|2,0,0]=4 874 B7R1.3 IC1=CC=CC=C1 2143 [2,0,0,0,0,0|1,0,0]=3 875 B7R1.3 IC1=CC=CC=C1 3921 [2,0,0,0,0,0|1,0,0]=3 876 B7R1.3 IC1=CC=CN=C1 6634 [2,0,0,0,0,0|2,0,0]=4 877 B7R1.3 IC1=CC=NC=C1 2584 [2,0,0,0,0,0|2,0,0]=4 878 B7R1.3 IC1=NC=CC=C1 4074 [2,0,0,0,0,0|2,0,0]=4 879 B7R1.3 NC1=CC=CN=C1 2569 [2,0,0,0,0,0|2,0,0]=4 880 B7R1.3 NC1=CC=NC=C1 1281 [2,0,0,0,0,0|2,0,0]=4 881 B7R1.3 NC1=NC=CC=C1 10484 [2,0,0,0,0,0|2,0,0]=4 882 B7R1.3 OC1=CC=CN=C1 2568 [2,0,0,0,0,0|1,0,0]=3 883 B7R1.3 OC1=CC=NC=C1 1116 [2,0,0,0,0,0|1,0,0]=3 884 B7R1.3 OC1=CN=CN=C1 20799 [2,0,0,0,0,0|2,0,0]=4 885 B7R1.3 OC1=C[NH+]=CN=C1 23934 [2,0,0,0,0,0|2,0,0]=4 886 B7R1.3 OC1=NC=CC=C1 2567 [2,0,0,0,0,0|1,0,0]=3 887 B7R1.3 OC1=NC=CC=N1 20310 [2,0,0,0,0,0|2,0,0]=4 888 B7R1.3 OC1=NC=CC=N1 21046 [2,0,0,0,0,0|2,0,0]=4 889 B7R1.3 OC1=NC=CN=C1 8869 [2,0,0,0,0,0|2,0,0]=4 890 B7R1.3 OC1=NC=NC=C1 11012 [2,0,0,0,0,0|2,0,0]=4 891 B7R1.3 OC1=NC=NC=C1 20805 [2,0,0,0,0,0|2,0,0]=4 892 B7R1.3 PC1=CC=CC=C1 25514 [2,0,0,0,0,0|1,0,0]=3 893 B7R1.3 SC1=CC=CC=C1 5421 [2,0,0,0,0,0|0,1,0]=3 894 B7R1.3 SC1=CC=NC=C1 9746 [2,0,0,0,0,0|1,1,0]=4 895 B7R1.3 SC1=NC=CC=C1 10835 [2,0,0,0,0,0|1,1,0]=4 896 B7R1.3 SC1=NC=CC=C1 16329 [2,0,0,0,0,0|1,1,0]=4 897 B7R1.3 [Li]C1=CC=CC=C1 26659 [2,0,0,0,0,0|1,0,0]=3 898 B7R1.3 [O-][N+]1=CC=CC=C1 2586 [2,0,0,0,0,0|1,0,1]=4 899 B7R1.3 [S-]C1=CC=CC=C1 35336 [2,0,0,0,0,0|0,1,0]=3 900 B7R1.3 [SiH3]C1=CC=CC=C1 25896 [2,0,0,0,0,0|0,1,0]=3 901 B9R1.2 BrCC1=CC(Br)=CC=C1 3029 [1,1,0,0,0,0|1,0,0]=3 902 B9R1.2 BrCC1=CC(I)=CC=C1 28805 [1,1,0,0,0,0|1,0,0]=3 903 B9R1.2 C#CC1=CC(F)=CC=C1 12891 [1,1,0,0,0,0|1,0,1]=4 904 B9R1.2 C#CC1=CC(N)=CC=C1 30297 [1,1,0,0,0,0|1,0,1]=4 905 B9R1.2 C#CC1=CC(N)=CC=C1 4052 [1,1,0,0,0,0|1,0,1]=4 906 B9R1.2 C#CC1=CC=CC(Br)=C1 19784 [1,1,0,0,0,0|1,0,1]=4 907 B9R1.2 C#CC1=CC=CC(Cl)=C1 14083 [1,1,0,0,0,0|1,0,1]=4 908 B9R1.2 C=CC1=CC(Br)=CC=C1 23859 [1,1,0,0,0,0|1,0,1]=4 909 B9R1.2 CC1=CC(C=O)=CC=C1 15513 [1,1,0,0,0,0|0,0,2]=4 910 B9R1.2 CC1=CC=CC(CBr)=N1 22577 [1,1,0,0,0,0|2,0,0]=4 911 B9R1.2 CC1=CC=CC(CCl)=N1 22531 [1,1,0,0,0,0|2,0,0]=4 912 B9R1.2 CC1=CC=CC(CCl)=N1 22536 [1,1,0,0,0,0|2,0,0]=4 913 B9R1.2 CC1=CC=CC(CF)=C1 28809 [1,1,0,0,0,0|1,0,0]=3 914 B9R1.2 CC1=CC=CC(CN)=C1 10198 [1,1,0,0,0,0|1,0,0]=3 915 B9R1.2 CC1=CC=CC(CN)=N1 19465 [1,1,0,0,0,0|2,0,0]=4 916 B9R1.2 CC1=CC=CC(CO)=N1 20959 [1,1,0,0,0,0|1,0,0]=3 917 B9R1.2 CC1=CC=CC(NN)=C1 6397 [1,1,0,0,0,0|2,0,0]=4 918 B9R1.2 CC1=CN=CC(CO)=C1 22640 [1,1,0,0,0,0|1,0,0]=3 919 B9R1.2 CC1=NC=CC(CN)=C1 34737 [1,1,0,0,0,0|2,0,0]=4 920 B9R1.2 CCC1=CC(N)=NC=C1 7108 [1,1,0,0,0,0|2,0,0]=4 921 B9R1.2 CCC1=CC=CC(Br)=C1 3771 [1,1,0,0,0,0|1,0,0]=3 922 B9R1.2 CCC1=CC=CC(N)=C1 13534 [1,1,0,0,0,0|1,0,0]=3 923 B9R1.2 CCC1=CC=CC(O)=C1 10772 [1,1,0,0,0,0|1,0,0]=3 924 B9R1.2 CCC1=NC=CC(Br)=C1 22128 [1,1,0,0,0,0|2,0,0]=4 925 B9R1.2 CNC1=CC(Cl)=CC=C1 9202 [1,1,0,0,0,0|2,0,0]=4 926 B9R1.2 CNC1=CC(F)=CC=C1 24835 [1,1,0,0,0,0|2,0,0]=4 927 B9R1.2 CNC1=CC=CC(O)=C1 27611 [1,1,0,0,0,0|2,0,0]=4 928 B9R1.2 COC1=CC(Br)=CC=C1 13575 [1,1,0,0,0,0|2,0,0]=4 929 B9R1.2 COC1=CC(Cl)=CC=C1 3615 [1,1,0,0,0,0|2,0,0]=4 930 B9R1.2 COC1=CC(F)=CC=C1 3474 [1,1,0,0,0,0|2,0,0]=4 931 B9R1.2 COC1=CC(I)=CC=C1 3904 [1,1,0,0,0,0|2,0,0]=4 932 B9R1.2 COC1=CC(O)=CC=C1 13577 [1,1,0,0,0,0|2,0,0]=4 933 B9R1.2 COC1=CC=CC(N)=C1 8374 [1,1,0,0,0,0|2,0,0]=4 934 B9R1.2 COC1=CC=CC(S)=C1 6817 [1,1,0,0,0,0|2,0,0]=4 935 B9R1.2 CSC1=CC(Br)=CC=C1 10649 [1,1,0,0,0,0|2,0,0]=4 936 B9R1.2 CSC1=CC(C)=CC=C1 10793 [1,1,0,0,0,0|2,0,0]=4 937 B9R1.2 CSC1=CC(Cl)=CC=C1 10644 [1,1,0,0,0,0|2,0,0]=4 938 B9R1.2 CSC1=CC(F)=CC=C1 10640 [1,1,0,0,0,0|2,0,0]=4 939 B9R1.2 CSC1=CC(I)=CC=C1 10669 [1,1,0,0,0,0|2,0,0]=4 940 B9R1.2 CSC1=CC(N)=CC=C1 10635 [1,1,0,0,0,0|2,0,0]=4 941 B9R1.2 ClC1=CC=CC(CBr)=C1 10765 [1,1,0,0,0,0|1,0,0]=3 942 B9R1.2 ClCC1=CC(Br)=CC=C1 23319 [1,1,0,0,0,0|1,0,0]=3 943 B9R1.2 ClCC1=CC(Cl)=CC=C1 7520 [1,1,0,0,0,0|1,0,0]=3 944 B9R1.2 ClCC1=CC(I)=CC=C1 31286 [1,1,0,0,0,0|1,0,0]=3 945 B9R1.2 ClCC1=CC(I)=CN=C1 27044 [1,1,0,0,0,0|2,0,0]=4 946 B9R1.2 ClCC1=CN=CC(Br)=C1 26331 [1,1,0,0,0,0|2,0,0]=4 947 B9R1.2 FC1=CC=CC(CBr)=C1 10214 [1,1,0,0,0,0|1,0,0]=3 948 B9R1.2 FC1=CC=CC(CCl)=C1 7516 [1,1,0,0,0,0|1,0,0]=3 949 B9R1.2 N#CC1=CC(Br)=CC=C1 1584 [1,1,0,0,0,0|1,0,1]=4 950 B9R1.2 N#CC1=CC(Cl)=CC=C1 3624 [1,1,0,0,0,0|1,0,1]=4 951 B9R1.2 N#CC1=CC(F)=CC=C1 1579 [1,1,0,0,0,0|1,0,1]=4 952 B9R1.2 N#CC1=CC(I)=CC=C1 3935 [1,1,0,0,0,0|1,0,1]=4 953 B9R1.2 N#CC1=CC(O)=CC=C1 13113 [1,1,0,0,0,0|1,0,1]=4 954 B9R1.2 N#CC1=CC=CC(S)=C1 26190 [1,1,0,0,0,0|1,0,1]=4 955 B9R1.2 NC1=CC=CC(CO)=C1 13383 [1,1,0,0,0,0|0,0,0]=2 956 B9R1.2 NC1=NC=CC(CCl)=C1 22291 [1,1,0,0,0,0|2,0,0]=4 957 B9R1.2 NC1=NC=CC(CO)=C1 7690 [1,1,0,0,0,0|1,0,0]=3 958 B9R1.2 NCC1=CC(Br)=CC=C1 21109 [1,1,0,0,0,0|1,0,0]=3 959 B9R1.2 NCC1=CC(Br)=CC=C1 3750 [1,1,0,0,0,0|1,0,0]=3 960 B9R1.2 NCC1=CC(F)=CC=C1 4417 [1,1,0,0,0,0|1,0,0]=3 961 B9R1.2 NCC1=CC(F)=NC=C1 34830 [1,1,0,0,0,0|2,0,0]=4 962 B9R1.2 NCC1=CC(I)=CC=C1 3302 [1,1,0,0,0,0|1,0,0]=3 963 B9R1.2 NCC1=CC(N)=CC=C1 5802 [1,1,0,0,0,0|1,0,0]=3 964 B9R1.2 NCC1=CC(N)=NC=C1 18667 [1,1,0,0,0,0|2,0,0]=4 965 B9R1.2 NCC1=NC=CC(Br)=C1 35197 [1,1,0,0,0,0|2,0,0]=4 966 B9R1.2 NNC1=CC(Br)=CC=C1 23212 [1,1,0,0,0,0|2,0,0]=4 967 B9R1.2 NNC1=CC(Cl)=CC=C1 7529 [1,1,0,0,0,0|2,0,0]=4 968 B9R1.2 NNC1=CC(F)=CC=C1 3341 [1,1,0,0,0,0|2,0,0]=4 969 B9R1.2 O=CC1=CC(Br)=CC=C1 3728 [1,1,0,0,0,0|0,0,2]=4 970 B9R1.2 O=CC1=CC(Cl)=CC=C1 10800 [1,1,0,0,0,0|0,0,2]=4 971 B9R1.2 O=CC1=CC(F)=CC=C1 3477 [1,1,0,0,0,0|0,0,2]=4 972 B9R1.2 O=CC1=CC(I)=CC=C1 3917 [1,1,0,0,0,0|0,0,2]=4 973 B9R1.2 O=CC1=CC(O)=CC=C1 7767 [1,1,0,0,0,0|0,0,2]=4 974 B9R1.2 OCC1=CC(Br)=CC=C1 3747 [1,1,0,0,0,0|0,0,0]=2 975 B9R1.2 OCC1=CC(Br)=CN=C1 22108 [1,1,0,0,0,0|1,0,0]=3 976 B9R1.2 OCC1=CC(Br)=NC=C1 7708 [1,1,0,0,0,0|1,0,0]=3 977 B9R1.2 OCC1=CC(Cl)=CC=C1 3626 [1,1,0,0,0,0|0,0,0]=2 978 B9R1.2 OCC1=CC(Cl)=CN=C1 12982 [1,1,0,0,0,0|1,0,0]=3 979 B9R1.2 OCC1=CC(Cl)=NC=C1 18605 [1,1,0,0,0,0|1,0,0]=3 980 B9R1.2 OCC1=CC(F)=CC=C1 3486 [1,1,0,0,0,0|0,0,0]=2 981 B9R1.2 OCC1=CC(I)=CC=C1 24776 [1,1,0,0,0,0|0,0,0]=2 982 B9R1.2 OCC1=CC(I)=CN=C1 16706 [1,1,0,0,0,0|1,0,0]=3 983 B9R1.2 OCC1=CC=CC(Br)=N1 7712 [1,1,0,0,0,0|1,0,0]=3 984 B9R1.2 OCC1=NC(Cl)=CC=C1 13322 [1,1,0,0,0,0|1,0,0]=3 985 B9R1.2 OCC1=NC(Cl)=CC=C1 18795 [1,1,0,0,0,0|1,0,0]=3 986 B9R1.2 OCC1=NC(Cl)=CN=C1 32136 [1,1,0,0,0,0|2,0,0]=4 987 B9R1.2 OCC1=NC(I)=CC=C1 26934 [1,1,0,0,0,0|1,0,0]=3 988 B9R1.2 OCC1=NC=CC(Br)=C1 20564 [1,1,0,0,0,0|1,0,0]=3 989 B9R1.2 OCC1=NC=CC(Cl)=C1 9828 [1,1,0,0,0,0|1,0,0]=3 990 B9R1.6 CC(Cl)C1=CC=CC=C1 10204 [1,1,0,0,0,0|1,0,0]=3 991 B9R1.6 CC(N)C1=CC=CC=C1 21079 [1,1,0,0,0,0|1,0,0]=3 992 B9R1.6 CP(C)C1=CC=CC=C1 6420 [1,1,0,0,0,0|2,0,0]=4 993 B9R1.6 C[C@@H](N)c1ccccc1 6026 [1,1,0,0,0,0|1,0,0]=3 994 B9R1.6 C[C@@H](N)c1ccccc1 6060 [1,1,0,0,0,0|1,0,0]=3 995 B9R1.6 C[C@@H](N)c1ccccc1 9918 [1,1,0,0,0,0|1,0,0]=3 996 B9R1.6 C[C@@H](O)C1=CC=CN=C1 27201 [1,1,0,0,0,0|1,0,0]=3 997 B9R1.6 C[C@@H](O)C1=NC=CC=C1 5699 [1,1,0,0,0,0|1,0,0]=3 998 B9R1.6 C[C@@H](O)c1ccccc1 6851 [1,1,0,0,0,0|0,0,0]=2 999 B9R1.6 C[C@H](N)c1ccccc1 6025 [1,1,0,0,0,0|1,0,0]=3 1000 B9R1.6 C[C@H](N)c1ccccc1 6061 [1,1,0,0,0,0|1,0,0]=3 1001 B9R1.6 C[C@H](O)C1=NC=CC=C1 5701 [1,1,0,0,0,0|1,0,0]=3 1002 B9R1.6 C[C@H](O)c1ccccc1 6858 [1,1,0,0,0,0|0,0,0]=2 1003 B9R1.6 ClP(Cl)C1=CC=CC=C1 6469 [1,1,0,0,0,0|2,0,0]=4 1004 B9R1.6 FC(Cl)C1=CC=CC=C1 15923 [1,1,0,0,0,0|1,0,0]=3 1005 B9R1.6 NC(=S)C1=CC=CC=C1 13565 [1,1,0,0,0,0|0,1,1]=4 1006 B9R1.6 NC(=S)C1=CC=CC=C1 18582 [1,1,0,0,0,0|0,1,1]=4 1007 B9R1.6 O=C(Cl)C1=CC=CC=C1 22045 [1,1,0,0,0,0|0,0,2]=4 1008 B9R1.6 O=C(O)C1=CC=NC=C1 2595 [1,1,0,0,0,0|1,0,1]=4 1009 B9R1.6 O=C(O)C1=CN=CC=C1 2594 [1,1,0,0,0,0|1,0,1]=4 1010 B9R1.6 O=C(O)C1=NC=CC=C1 9774 [1,1,0,0,0,0|1,0,1]=4 1011 B9R1.6 OB(O)C1=CC=CC=C1 1753 [1,1,0,0,0,0|1,0,0]=3 1012 B9R1.6 OB(O)C1=CC=CN=C1 2183 [1,1,0,0,0,0|2,0,0]=4 1013 B9R1.6 OB(O)C1=CC=NC=C1 5145 [1,1,0,0,0,0|2,0,0]=4 1014 B9R1.6 OB(O)C1=NC=CC=C1 4076 [1,1,0,0,0,0|2,0,0]=4 1015 B9R1.6 OC(=S)C1=CC=CC=C1 36202 [1,1,0,0,0,0|0,0,1]=3 1016 B9R1.8 BrCCC1=CC=CN=C1 21399 [1,1,0,0,0,0|2,0,0]=4 1017 B9R1.8 BrCCC1=NC=CC=C1 23421 [1,1,0,0,0,0|2,0,0]=4 1018 B9R1.8 Br[Mg]CC1=CC=CC=C1 20182 [1,1,0,0,0,0|1,0,0]=3 1019 B9R1.8 C=CCC1=CC=CC=C1 29358 [1,1,0,0,0,0|1,0,0]=3 1020 B9R1.8 C=CSC1=CC=CC=C1 10778 [1,1,0,0,0,0|1,0,1]=4 1021 B9R1.8 CCCC1=CC=CC=C1 10852 [1,1,0,0,0,0|1,0,0]=3 1022 B9R1.8 CCCC1=CC=NC=C1 15021 [1,1,0,0,0,0|2,0,0]=4 1023 B9R1.8 CCOC1=CC=NC=C1 1125 [1,1,0,0,0,0|2,0,0]=4 1024 B9R1.8 CCOC1=NC=CC=C1 1126 [1,1,0,0,0,0|2,0,0]=4 1025 B9R1.8 CCSC1=CC=CC=C1 10773 [1,1,0,0,0,0|1,0,0]=3 1026 B9R1.8 CNCC1=CC=CC=C1 19910 [1,1,0,0,0,0|1,0,0]=3 1027 B9R1.8 CNCC1=CC=CC=C1 25218 [1,1,0,0,0,0|1,0,0]=3 1028 B9R1.8 CNCC1=CC=CC=C1 5801 [1,1,0,0,0,0|1,0,0]=3 1029 B9R1.8 COCC1=CC=CC=C1 15300 [1,1,0,0,0,0|0,0,0]=2 1030 B9R1.8 ClCCC1=CC=CC=C1 26674 [1,1,0,0,0,0|1,0,0]=3 1031 B9R1.8 ClCCC1=CC=CN=C1 23929 [1,1,0,0,0,0|2,0,0]=4 1032 B9R1.8 ClCSC1=CC=CC=C1 10735 [1,1,0,0,0,0|1,0,0]=3 1033 B9R1.8 N#CCC1=NC=CC=C1 9302 [1,1,0,0,0,0|2,0,0]=4 1034 B9R1.8 NCCC1=CC=CN=C1 13196 [1,1,0,0,0,0|2,0,0]=4 1035 B9R1.8 NCCC1=CC=CN=C1 14084 [1,1,0,0,0,0|2,0,0]=4 1036 B9R1.8 NCCC1=CC=NC=C1 13447 [1,1,0,0,0,0|2,0,0]=4 1037 B9R1.8 NCCC1=NC=CC=C1 2592 [1,1,0,0,0,0|2,0,0]=4 1038 B9R1.8 NCCc1ccccc1 21077 [1,1,0,0,0,0|1,0,0]=3 1039 B9R1.8 NNCC1=CC=CC=C1 29056 [1,1,0,0,0,0|1,0,0]=3 1040 B9R1.8 NOCC1=CC=CC=C1 24804 [1,1,0,0,0,0|0,0,0]=2 1041 B9R1.8 NOCC1=CC=CC=C1 7095 [1,1,0,0,0,0|0,0,0]=2 1042 B9R1.8 OCCC1=NC=CC=C1 2593 [1,1,0,0,0,0|1,0,0]=3 1043 B9R1.8 ONCC1=CC=CC=C1 25520 [1,1,0,0,0,0|0,0,0]=2 1044 B9R1.8 S=C=NC1=CC=CC=C1 18702 [1,1,0,0,0,0|0,1,1]=4 1045 B9R1.8 SCCC1=CC=CN=C1 25052 [1,1,0,0,0,0|1,1,0]=4 1046 B9R1.8 SCCC1=NC=CC=C1 25015 [1,1,0,0,0,0|1,1,0]=4 1047 B9R1.15 BrCC1=C(Br)C=CC=C1 16915 [1,1,0,0,0,0|1,0,0]=3 1048 B9R1.15 BrCC1=C(I)C=CC=C1 14812 [1,1,0,0,0,0|1,0,0]=3 1049 B9R1.15 BrCC1=CC=CN=C1Br 22284 [1,1,0,0,0,0|2,0,0]=4 1050 B9R1.15 C#CC1=C(Cl)C=CC=C1 2550 [1,1,0,0,0,0|1,0,1]=4 1051 B9R1.15 C=CC1=C(Br)C=CC=C1 23975 [1,1,0,0,0,0|1,0,1]=4 1052 B9R1.15 CC1=C(C#N)C=CC=C1 25285 [1,1,0,0,0,0|1,0,1]=4 1053 B9R1.15 CC1=C(CCl)C=CC=C1 7487 [1,1,0,0,0,0|1,0,0]=3 1054 B9R1.15 CC1=C(CN)C=CC=C1 10197 [1,1,0,0,0,0|1,0,0]=3 1055 B9R1.15 CC1=C(CO)C=NC=C1 34710 [1,1,0,0,0,0|1,0,0]=3 1056 B9R1.15 CC1=C(NN)C=CC=C1 22584 [1,1,0,0,0,0|2,0,0]=4 1057 B9R1.15 CC1=C(NN)C=CC=C1 6396 [1,1,0,0,0,0|2,0,0]=4 1058 B9R1.15 CC1=CC=CC=C1C=O 15511 [1,1,0,0,0,0|0,0,2]=4 1059 B9R1.15 CC1=NC=CC=C1CCl 26692 [1,1,0,0,0,0|2,0,0]=4 1060 B9R1.15 CC1=NC=CC=C1CO 26693 [1,1,0,0,0,0|1,0,0]=3 1061 B9R1.15 CCC1=C(Br)C=CC=C1 3770 [1,1,0,0,0,0|1,0,0]=3 1062 B9R1.15 CCC1=C(I)C=CC=C1 3876 [1,1,0,0,0,0|1,0,0]=3 1063 B9R1.15 CCC1=C(N)C=CC=C1 20945 [1,1,0,0,0,0|1,0,0]=3 1064 B9R1.15 CCC1=C(N)C=CC=C1 21080 [1,1,0,0,0,0|1,0,0]=3 1065 B9R1.15 CCC1=C(O)C=CC=C1 3871 [1,1,0,0,0,0|1,0,0]=3 1066 B9R1.15 CCC1=C(S)C=CC=C1 6844 [1,1,0,0,0,0|1,0,0]=3 1067 B9R1.15 CCC1=CC=CN=C1N 35166 [1,1,0,0,0,0|2,0,0]=4 1068 B9R1.15 CCC1=NC=CC=C1Br 27958 [1,1,0,0,0,0|2,0,0]=4 1069 B9R1.15 CC[N+]1=C(Br)C=CC=C1 35190 [1,1,0,0,0,0|2,0,0]=4 1070 B9R1.15 CNC1=C(F)C=CC=C1 15527 [1,1,0,0,0,0|2,0,0]=4 1071 B9R1.15 CNC1=CC=CC=C1N 14987 [1,1,0,0,0,0|2,0,0]=4 1072 B9R1.15 COC1=C(Br)C=CC=C1 3725 [1,1,0,0,0,0|2,0,0]=4 1073 B9R1.15 COC1=C(Cl)C=CC=C1 3614 [1,1,0,0,0,0|2,0,0]=4 1074 B9R1.15 COC1=C(F)C=CC=C1 3473 [1,1,0,0,0,0|2,0,0]=4 1075 B9R1.15 COC1=C(I)C=CC=C1 3898 [1,1,0,0,0,0|2,0,0]=4 1076 B9R1.15 COC1=C(S)C=CC=C1 6816 [1,1,0,0,0,0|2,0,0]=4 1077 B9R1.15 COC1=CC=CC=C1O 26545 [1,1,0,0,0,0|2,0,0]=4 1078 B9R1.15 CSC1=C(Br)C=CC=C1 10648 [1,1,0,0,0,0|2,0,0]=4 1079 B9R1.15 CSC1=C(C)C=CC=C1 10730 [1,1,0,0,0,0|2,0,0]=4 1080 B9R1.15 CSC1=C(Cl)C=CC=C1 10643 [1,1,0,0,0,0|2,0,0]=4 1081 B9R1.15 CSC1=C(F)C=CC=C1 10638 [1,1,0,0,0,0|2,0,0]=4 1082 B9R1.15 CSC1=C(I)C=CC=C1 10668 [1,1,0,0,0,0|2,0,0]=4 1083 B9R1.15 CSC1=C(N)C=CC=C1 10633 [1,1,0,0,0,0|2,0,0]=4 1084 B9R1.15 CSC1=C(O)C=CC=C1 10666 [1,1,0,0,0,0|2,0,0]=4 1085 B9R1.15 ClC1=C(CBr)C=CC=C1 12482 [1,1,0,0,0,0|1,0,0]=3 1086 B9R1.15 ClCC1=C(Cl)C=CC=C1 10203 [1,1,0,0,0,0|1,0,0]=3 1087 B9R1.15 ClCC1=NC=CC=C1Cl 27217 [1,1,0,0,0,0|2,0,0]=4 1088 B9R1.15 FC1=C(CBr)C=CC=C1 10383 [1,1,0,0,0,0|1,0,0]=3 1089 B9R1.15 FC1=C(CCl)C=CC=C1 2094 [1,1,0,0,0,0|1,0,0]=3 1090 B9R1.15 N#CC1=C(Br)C=CC=C1 3744 [1,1,0,0,0,0|1,0,1]=4 1091 B9R1.15 N#CC1=C(F)C=CC=C1 1578 [1,1,0,0,0,0|1,0,1]=4 1092 B9R1.15 N#CC1=C(I)C=CC=C1 3932 [1,1,0,0,0,0|1,0,1]=4 1093 B9R1.15 N#CC1=C(O)C=CC=C1 4803 [1,1,0,0,0,0|1,0,1]=4 1094 B9R1.15 N#CC1=CC=CC=C1N 13630 [1,1,0,0,0,0|1,0,1]=4 1095 B9R1.15 NC1=C(C=O)C=CC=C1 15692 [1,1,0,0,0,0|0,0,2]=4 1096 B9R1.15 NC1=C(CO)C=CC=C1 7478 [1,1,0,0,0,0|0,0,0]=2 1097 B9R1.15 NC1=C(CO)C=CN=C1 7692 [1,1,0,0,0,0|1,0,0]=3 1098 B9R1.15 NC1=C(CO)C=NC=C1 26901 [1,1,0,0,0,0|1,0,0]=3 1099 B9R1.15 NC1=CC=CN=C1CO 35900 [1,1,0,0,0,0|1,0,0]=3 1100 B9R1.15 NC1=NC=CC=C1CO 7688 [1,1,0,0,0,0|1,0,0]=3 1101 B9R1.15 NCC1=C(Br)C=CC=C1 20398 [1,1,0,0,0,0|1,0,0]=3 1102 B9R1.15 NCC1=C(Br)C=CC=C1 3749 [1,1,0,0,0,0|1,0,0]=3 1103 B9R1.15 NCC1=C(Cl)C=CC=C1 5800 [1,1,0,0,0,0|1,0,0]=3 1104 B9R1.15 NCC1=C(Cl)C=CC=C1 6155 [1,1,0,0,0,0|1,0,0]=3 1105 B9R1.15 NCC1=C(F)C=CC=C1 4415 [1,1,0,0,0,0|1,0,0]=3 1106 B9R1.15 NCC1=C(N)C=CC=C1 23363 [1,1,0,0,0,0|1,0,0]=3 1107 B9R1.15 NCC1=C(O)C=CC=C1 7383 [1,1,0,0,0,0|1,0,0]=3 1108 B9R1.15 NCC1=CC=CN=C1Cl 17749 [1,1,0,0,0,0|2,0,0]=4 1109 B9R1.15 NCC1=NC=CC=C1O 34602 [1,1,0,0,0,0|2,0,0]=4 1110 B9R1.15 NNC1=C(Br)C=CC=C1 4463 [1,1,0,0,0,0|2,0,0]=4 1111 B9R1.15 NNC1=C(Cl)C=CC=C1 4482 [1,1,0,0,0,0|2,0,0]=4 1112 B9R1.15 NNC1=C(F)C=CC=C1 3347 [1,1,0,0,0,0|2,0,0]=4 1113 B9R1.15 NNC1=C(F)C=CC=C1 3350 [1,1,0,0,0,0|2,0,0]=4 1114 B9R1.15 O=CC1=C(Br)C=CC=C1 3727 [1,1,0,0,0,0|0,0,2]=4 1115 B9R1.15 O=CC1=C(F)C=CC=C1 3476 [1,1,0,0,0,0|0,0,2]=4 1116 B9R1.15 O=CC1=C(I)C=CC=C1 3914 [1,1,0,0,0,0|0,0,2]=4 1117 B9R1.15 OCC1=C(Br)C=CC=C1 3746 [1,1,0,0,0,0|0,0,0]=2 1118 B9R1.15 OCC1=C(Cl)C=CC=C1 3625 [1,1,0,0,0,0|0,0,0]=2 1119 B9R1.15 OCC1=C(Cl)C=CN=C1 12981 [1,1,0,0,0,0|1,0,0]=3 1120 B9R1.15 OCC1=C(F)C=CC=C1 3485 [1,1,0,0,0,0|0,0,0]=2 1121 B9R1.15 OCC1=C(F)C=NC=C1 23891 [1,1,0,0,0,0|1,0,0]=3 1122 B9R1.15 OCC1=C(O)C=CC=C1 21869 [1,1,0,0,0,0|0,0,0]=2 1123 B9R1.15 OCC1=CC=CN=C1Cl 12984 [1,1,0,0,0,0|1,0,0]=3 1124 B9R1.15 OCC1=CC=CN=C1F 7351 [1,1,0,0,0,0|1,0,0]=3 1125 B9R1.15 OCC1=NC=CC=C1F 15108 [1,1,0,0,0,0|1,0,0]=3 1126 B9R1.15 OCC1=NC=CC=C1O 4075 [1,1,0,0,0,0|1,0,0]=3 1127 B9R1.15 OCC1=NC=CN=C1Cl 32144 [1,1,0,0,0,0|2,0,0]=4 1128 B9R1.15 SCC1=C(Cl)C=CC=C1 6836 [1,1,0,0,0,0|0,1,0]=3 1129 B9R1.15 SCc1ccccc1Br 6847 [1,1,0,0,0,0|0,1,0]=3 1130 B9R1.69 BrC1=C(I)C=CC(I)=C1 25907 [1,1,0,0,0,0|2,0,0]=4 1131 B9R1.69 BrC1=CC(Br)=C(Br)C=C1 28486 [1,1,0,0,0,0|2,0,0]=4 1132 B9R1.69 CC1=C(Br)C=C(Br)C=C1 3915 [1,1,0,0,0,0|1,0,0]=3 1133 B9R1.69 CC1=C(Br)C=C(Cl)C=C1 3599 [1,1,0,0,0,0|1,0,0]=3 1134 B9R1.69 CC1=C(Br)C=C(F)C=C1 1602 [1,1,0,0,0,0|1,0,0]=3 1135 B9R1.69 CC1=C(Br)C=C(N)C=C1 5336 [1,1,0,0,0,0|1,0,0]=3 1136 B9R1.69 CC1=C(Br)C=C(O)C=C1 27670 [1,1,0,0,0,0|0,0,0]=2 1137 B9R1.69 CC1=C(Br)C=CC(Br)=C1 3922 [1,1,0,0,0,0|2,0,0]=4 1138 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 3600 [1,1,0,0,0,0|2,0,0]=4 1139 B9R1.69 CC1=C(Br)C=CC(F)=C1 1603 [1,1,0,0,0,0|2,0,0]=4 1140 B9R1.69 CC1=C(Br)C=CC(I)=C1 3791 [1,1,0,0,0,0|2,0,0]=4 1141 B9R1.69 CC1=C(Br)C=CC(N)=C1 4339 [1,1,0,0,0,0|2,0,0]=4 1142 B9R1.69 CC1=C(Br)C=CC(N)=C1 5368 [1,1,0,0,0,0|2,0,0]=4 1143 B9R1.69 CC1=C(Br)C=CC(O)=C1 2201 [1,1,0,0,0,0|1,0,0]=3 1144 B9R1.69 CC1=C(Br)C=CC(O)=N1 6565 [1,1,0,0,0,0|2,0,0]=4 1145 B9R1.69 CC1=C(C)C=C(Br)C=C1 3764 [1,1,0,0,0,0|1,0,0]=3 1146 B9R1.69 CC1=C(C)C=C(Cl)C=C1 3641 [1,1,0,0,0,0|1,0,0]=3 1147 B9R1.69 CC1=C(C)C=C(F)C=C1 14118 [1,1,0,0,0,0|1,0,0]=3 1148 B9R1.69 CC1=C(C)C=C(I)C=C1 3105 [1,1,0,0,0,0|1,0,0]=3 1149 B9R1.69 CC1=C(C)C=C(O)C=C1 21761 [1,1,0,0,0,0|0,0,0]=2 1150 B9R1.69 CC1=C(C)C=C(S)C=C1 6812 [1,1,0,0,0,0|0,1,0]=3 1151 B9R1.69 CC1=C(C)N=C(N)C=C1 26060 [1,1,0,0,0,0|2,0,0]=4 1152 B9R1.69 CC1=C(C)N=C(O)C=N1 34143 [1,1,0,0,0,0|2,0,0]=4 1153 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 3603 [1,1,0,0,0,0|1,0,0]=3 1154 B9R1.69 CC1=C(Cl)C=C(F)C=C1 1605 [1,1,0,0,0,0|1,0,0]=3 1155 B9R1.69 CC1=C(Cl)C=C(I)C=C1 3652 [1,1,0,0,0,0|1,0,0]=3 1156 B9R1.69 CC1=C(Cl)C=C(N)C=C1 19746 [1,1,0,0,0,0|1,0,0]=3 1157 B9R1.69 CC1=C(Cl)C=C(O)C=C1 3671 [1,1,0,0,0,0|0,0,0]=2 1158 B9R1.69 CC1=C(Cl)C=C(O)C=N1 34283 [1,1,0,0,0,0|1,0,0]=3 1159 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 3604 [1,1,0,0,0,0|2,0,0]=4 1160 B9R1.69 CC1=C(Cl)C=CC(Cl)=C1 3700 [1,1,0,0,0,0|2,0,0]=4 1161 B9R1.69 CC1=C(Cl)C=CC(F)=C1 1606 [1,1,0,0,0,0|2,0,0]=4 1162 B9R1.69 CC1=C(Cl)C=CC(I)=C1 3653 [1,1,0,0,0,0|2,0,0]=4 1163 B9R1.69 CC1=C(Cl)C=CC(N)=C1 3439 [1,1,0,0,0,0|2,0,0]=4 1164 B9R1.69 CC1=C(Cl)N=C(N)C=C1 35154 [1,1,0,0,0,0|2,0,0]=4 1165 B9R1.69 CC1=C(F)C=C(Br)C=C1 1601 [1,1,0,0,0,0|1,0,0]=3 1166 B9R1.69 CC1=C(F)C=C(Cl)C=C1 3437 [1,1,0,0,0,0|1,0,0]=3 1167 B9R1.69 CC1=C(F)C=C(F)C=C1 1612 [1,1,0,0,0,0|1,0,0]=3 1168 B9R1.69 CC1=C(F)C=C(I)C=C1 1618 [1,1,0,0,0,0|1,0,0]=3 1169 B9R1.69 CC1=C(F)C=C(N)C=C1 1509 [1,1,0,0,0,0|1,0,0]=3 1170 B9R1.69 CC1=C(F)C=C(O)C=C1 1499 [1,1,0,0,0,0|0,0,0]=2 1171 B9R1.69 CC1=C(F)C=C(S)C=C1 6872 [1,1,0,0,0,0|0,1,0]=3 1172 B9R1.69 CC1=C(F)C=CC(Br)=C1 1599 [1,1,0,0,0,0|2,0,0]=4 1173 B9R1.69 CC1=C(F)C=CC(Cl)=C1 1609 [1,1,0,0,0,0|2,0,0]=4 1174 B9R1.69 CC1=C(F)C=CC(F)=C1 1613 [1,1,0,0,0,0|2,0,0]=4 1175 B9R1.69 CC1=C(F)C=CC(I)=C1 1619 [1,1,0,0,0,0|2,0,0]=4 1176 B9R1.69 CC1=C(F)C=CC(N)=C1 1513 [1,1,0,0,0,0|2,0,0]=4 1177 B9R1.69 CC1=C(F)C=CC(O)=C1 1501 [1,1,0,0,0,0|1,0,0]=3 1178 B9R1.69 CC1=C(I)C=C(Cl)C=C1 3657 [1,1,0,0,0,0|1,0,0]=3 1179 B9R1.69 CC1=C(I)C=C(F)C=C1 1622 [1,1,0,0,0,0|1,0,0]=3 1180 B9R1.69 CC1=C(I)C=C(N)C=C1 3314 [1,1,0,0,0,0|1,0,0]=3 1181 B9R1.69 CC1=C(I)C=CC(Br)=C1 3793 [1,1,0,0,0,0|2,0,0]=4 1182 B9R1.69 CC1=C(I)C=CC(Cl)=C1 25479 [1,1,0,0,0,0|2,0,0]=4 1183 B9R1.69 CC1=C(I)C=CC(F)=C1 1624 [1,1,0,0,0,0|2,0,0]=4 1184 B9R1.69 CC1=C(I)C=CC(O)=C1 23022 [1,1,0,0,0,0|1,0,0]=3 1185 B9R1.69 CC1=C(N)C=C(Br)C=C1 3801 [1,1,0,0,0,0|1,0,0]=3 1186 B9R1.69 CC1=C(N)C=C(Cl)C=C1 14280 [1,1,0,0,0,0|1,0,0]=3 1187 B9R1.69 CC1=C(N)C=C(Cl)C=C1 35457 [1,1,0,0,0,0|1,0,0]=3 1188 B9R1.69 CC1=C(N)C=C(F)C=C1 1512 [1,1,0,0,0,0|1,0,0]=3 1189 B9R1.69 CC1=C(N)C=C(I)C=C1 31023 [1,1,0,0,0,0|1,0,0]=3 1190 B9R1.69 CC1=C(N)C=C(N)C=C1 21656 [1,1,0,0,0,0|1,0,0]=3 1191 B9R1.69 CC1=C(N)C=C(O)C=C1 4524 [1,1,0,0,0,0|0,0,0]=2 1192 B9R1.69 CC1=C(N)C=CC(Br)=C1 15188 [1,1,0,0,0,0|2,0,0]=4 1193 B9R1.69 CC1=C(N)C=CC(Br)=C1 3800 [1,1,0,0,0,0|2,0,0]=4 1194 B9R1.69 CC1=C(N)C=CC(Br)=C1 3803 [1,1,0,0,0,0|2,0,0]=4 1195 B9R1.69 CC1=C(N)C=CC(Cl)=C1 10759 [1,1,0,0,0,0|2,0,0]=4 1196 B9R1.69 CC1=C(N)C=CC(F)=C1 1508 [1,1,0,0,0,0|2,0,0]=4 1197 B9R1.69 CC1=C(N)C=CC(I)=C1 3318 [1,1,0,0,0,0|2,0,0]=4 1198 B9R1.69 CC1=C(N)C=CC(O)=C1 22012 [1,1,0,0,0,0|1,0,0]=3 1199 B9R1.69 CC1=C(O)C=C(Br)C=C1 4132 [1,1,0,0,0,0|1,0,0]=3 1200 B9R1.69 CC1=C(O)C=C(Cl)C=C1 3674 [1,1,0,0,0,0|1,0,0]=3 1201 B9R1.69 CC1=C(O)C=C(F)C=C1 1502 [1,1,0,0,0,0|1,0,0]=3 1202 B9R1.69 CC1=C(O)C=C(N)C=C1 8207 [1,1,0,0,0,0|1,0,0]=3 1203 B9R1.69 CC1=C(O)C=C(O)C=C1 27666 [1,1,0,0,0,0|0,0,0]=2 1204 B9R1.69 CC1=C(O)C=CC(Br)=C1 7106 [1,1,0,0,0,0|1,0,0]=3 1205 B9R1.69 CC1=C(O)C=CC(Cl)=C1 3673 [1,1,0,0,0,0|1,0,0]=3 1206 B9R1.69 CC1=C(O)C=CC(F)=C1 1500 [1,1,0,0,0,0|1,0,0]=3 1207 B9R1.69 CC1=C(O)C=CC(S)=C1 6863 [1,1,0,0,0,0|0,1,0]=3 1208 B9R1.69 CC1=C(S)C=C(Cl)C=C1 6881 [1,1,0,0,0,0|1,0,0]=3 1209 B9R1.69 CC1=C(S)C=CC(F)=C1 6870 [1,1,0,0,0,0|1,1,0]=4 1210 B9R1.69 CC1=CC(=O)C=CC1=O 14604 [1,1,0,0,0,0|0,0,2]=4 1211 B9R1.69 CC1=CC(Br)=C(Br)C=C1 3930 [1,1,0,0,0,0|1,0,0]=3 1212 B9R1.69 CC1=CC(Br)=C(C)C=C1 3763 [1,1,0,0,0,0|1,0,0]=3 1213 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 3602 [1,1,0,0,0,0|1,0,0]=3 1214 B9R1.69 CC1=CC(Br)=C(F)C=C1 1600 [1,1,0,0,0,0|1,0,0]=3 1215 B9R1.69 CC1=CC(Br)=C(I)C=C1 3792 [1,1,0,0,0,0|1,0,0]=3 1216 B9R1.69 CC1=CC(Br)=C(N)C=C1 3799 [1,1,0,0,0,0|1,0,0]=3 1217 B9R1.69 CC1=CC(Br)=C(N)C=C1 3802 [1,1,0,0,0,0|1,0,0]=3 1218 B9R1.69 CC1=CC(Br)=C(O)C=C1 4096 [1,1,0,0,0,0|0,0,0]=2 1219 B9R1.69 CC1=CC(Br)=C(O)C=N1 30312 [1,1,0,0,0,0|1,0,0]=3 1220 B9R1.69 CC1=CC(Br)=CN=C1O 6562 [1,1,0,0,0,0|2,0,0]=4 1221 B9R1.69 CC1=CC(C)=C(Br)C=C1 3762 [1,1,0,0,0,0|1,0,0]=3 1222 B9R1.69 CC1=CC(C)=C(Cl)C=C1 3639 [1,1,0,0,0,0|1,0,0]=3 1223 B9R1.69 CC1=CC(C)=C(I)C=C1 3869 [1,1,0,0,0,0|1,0,0]=3 1224 B9R1.69 CC1=CC(C)=C(N)C=C1 15152 [1,1,0,0,0,0|1,0,0]=3 1225 B9R1.69 CC1=CC(C)=C(N)C=N1 25045 [1,1,0,0,0,0|2,0,0]=4 1226 B9R1.69 CC1=CC(C)=C(O)C=C1 21747 [1,1,0,0,0,0|0,0,0]=2 1227 B9R1.69 CC1=CC(C)=C(S)C=C1 6810 [1,1,0,0,0,0|0,1,0]=3 1228 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 9504 [1,1,0,0,0,0|1,0,0]=3 1229 B9R1.69 CC1=CC(Cl)=C(C)C=C1 3640 [1,1,0,0,0,0|1,0,0]=3 1230 B9R1.69 CC1=CC(Cl)=C(F)C=C1 3436 [1,1,0,0,0,0|1,0,0]=3 1231 B9R1.69 CC1=CC(Cl)=C(I)C=C1 3656 [1,1,0,0,0,0|1,0,0]=3 1232 B9R1.69 CC1=CC(Cl)=C(N)C=C1 2472 [1,1,0,0,0,0|1,0,0]=3 1233 B9R1.69 CC1=CC(Cl)=C(O)C=C1 3672 [1,1,0,0,0,0|0,0,0]=2 1234 B9R1.69 CC1=CC(Cl)=CN=C1O 9824 [1,1,0,0,0,0|2,0,0]=4 1235 B9R1.69 CC1=CC(F)=C(Br)C=C1 1604 [1,1,0,0,0,0|1,0,0]=3 1236 B9R1.69 CC1=CC(F)=C(C)C=C1 35429 [1,1,0,0,0,0|1,0,0]=3 1237 B9R1.69 CC1=CC(F)=C(Cl)C=C1 1611 [1,1,0,0,0,0|1,0,0]=3 1238 B9R1.69 CC1=CC(F)=C(F)C=C1 1615 [1,1,0,0,0,0|1,0,0]=3 1239 B9R1.69 CC1=CC(F)=C(I)C=C1 1621 [1,1,0,0,0,0|1,0,0]=3 1240 B9R1.69 CC1=CC(F)=C(N)C=C1 1511 [1,1,0,0,0,0|1,0,0]=3 1241 B9R1.69 CC1=CC(I)=C(C)C=C1 3875 [1,1,0,0,0,0|1,0,0]=3 1242 B9R1.69 CC1=CC(I)=C(F)C=C1 1623 [1,1,0,0,0,0|1,0,0]=3 1243 B9R1.69 CC1=CC(I)=C(N)C=C1 5353 [1,1,0,0,0,0|1,0,0]=3 1244 B9R1.69 CC1=CC(N)=C(Br)C=C1 4337 [1,1,0,0,0,0|1,0,0]=3 1245 B9R1.69 CC1=CC(N)=C(Cl)C=C1 18921 [1,1,0,0,0,0|1,0,0]=3 1246 B9R1.69 CC1=CC(N)=C(F)C=C1 1507 [1,1,0,0,0,0|1,0,0]=3 1247 B9R1.69 CC1=CC(N)=C(I)C=C1 20232 [1,1,0,0,0,0|1,0,0]=3 1248 B9R1.69 CC1=CC(N)=C(N)C=C1 19699 [1,1,0,0,0,0|1,0,0]=3 1249 B9R1.69 CC1=CC(N)=C(N)C=N1 17738 [1,1,0,0,0,0|2,0,0]=4 1250 B9R1.69 CC1=CC(N)=C(S)C=C1 24155 [1,1,0,0,0,0|0,1,0]=3 1251 B9R1.69 CC1=CC(O)=C(Br)C=C1 25283 [1,1,0,0,0,0|1,0,0]=3 1252 B9R1.69 CC1=CC(O)=C(C)C=C1 21763 [1,1,0,0,0,0|1,0,0]=3 1253 B9R1.69 CC1=CC(O)=C(Cl)C=C1 3668 [1,1,0,0,0,0|1,0,0]=3 1254 B9R1.69 CC1=CC(O)=C(F)C=C1 1498 [1,1,0,0,0,0|1,0,0]=3 1255 B9R1.69 CC1=CC(O)=C(N)C=C1 11254 [1,1,0,0,0,0|1,0,0]=3 1256 B9R1.69 CC1=CC(O)=CN=C1Br 5966 [1,1,0,0,0,0|2,0,0]=4 1257 B9R1.69 CC1=CC(O)=CN=C1Cl 12478 [1,1,0,0,0,0|2,0,0]=4 1258 B9R1.69 CC1=CC(O)=CN=C1F 6320 [1,1,0,0,0,0|2,0,0]=4 1259 B9R1.69 CC1=CC(O)=NC=C1Br 6564 [1,1,0,0,0,0|2,0,0]=4 1260 B9R1.69 CC1=CC(O)=NC=C1N 6706 [1,1,0,0,0,0|2,0,0]=4 1261 B9R1.69 CC1=CC(S)=C(C)C=C1 6811 [1,1,0,0,0,0|1,0,0]=3 1262 B9R1.69 CC1=CC(S)=C(N)C=C1 18333 [1,1,0,0,0,0|1,0,0]=3 1263 B9R1.69 CC1=CC=C(Br)C(Br)=N1 5401 [1,1,0,0,0,0|2,0,0]=4 1264 B9R1.69 CC1=CC=C(Br)C(C)=N1 13806 [1,1,0,0,0,0|2,0,0]=4 1265 B9R1.69 CC1=CC=C(Br)C(Cl)=N1 1286 [1,1,0,0,0,0|2,0,0]=4 1266 B9R1.69 CC1=CC=C(Br)C(F)=N1 6256 [1,1,0,0,0,0|2,0,0]=4 1267 B9R1.69 CC1=CC=C(Br)C(N)=N1 1235 [1,1,0,0,0,0|2,0,0]=4 1268 B9R1.69 CC1=CC=C(Br)C(O)=N1 6531 [1,1,0,0,0,0|2,0,0]=4 1269 B9R1.69 CC1=CC=C(Br)N=C1N 31947 [1,1,0,0,0,0|2,0,0]=4 1270 B9R1.69 CC1=CC=C(Cl)C(Cl)=N1 5410 [1,1,0,0,0,0|2,0,0]=4 1271 B9R1.69 CC1=CC=C(Cl)N=C1Cl 24157 [1,1,0,0,0,0|2,0,0]=4 1272 B9R1.69 CC1=CC=C(F)C(Br)=N1 3001 [1,1,0,0,0,0|2,0,0]=4 1273 B9R1.69 CC1=CC=C(F)C(Cl)=N1 1137 [1,1,0,0,0,0|2,0,0]=4 1274 B9R1.69 CC1=CC=C(I)C(F)=N1 17063 [1,1,0,0,0,0|2,0,0]=4 1275 B9R1.69 CC1=CC=C(I)C(N)=N1 17046 [1,1,0,0,0,0|2,0,0]=4 1276 B9R1.69 CC1=CC=C(N)C(Br)=N1 1239 [1,1,0,0,0,0|2,0,0]=4 1277 B9R1.69 CC1=CC=C(N)C(Br)=N1 29222 [1,1,0,0,0,0|2,0,0]=4 1278 B9R1.69 CC1=CC=C(N)C(C)=N1 2075 [1,1,0,0,0,0|2,0,0]=4 1279 B9R1.69 CC1=CC=C(N)C(Cl)=N1 1245 [1,1,0,0,0,0|2,0,0]=4 1280 B9R1.69 CC1=CC=C(N)C(F)=N1 1132 [1,1,0,0,0,0|2,0,0]=4 1281 B9R1.69 CC1=CC=C(N)C(N)=N1 5393 [1,1,0,0,0,0|2,0,0]=4 1282 B9R1.69 CC1=CC=C(O)C(Br)=N1 5906 [1,1,0,0,0,0|1,0,0]=3 1283 B9R1.69 CC1=CC=C(O)C(C)=N1 22495 [1,1,0,0,0,0|1,0,0]=3 1284 B9R1.69 CC1=CC=C(O)C(Cl)=N1 6143 [1,1,0,0,0,0|1,0,0]=3 1285 B9R1.69 CC1=CC=C(O)C(F)=N1 6285 [1,1,0,0,0,0|1,0,0]=3 1286 B9R1.69 CC1=CC=C(O)C(I)=N1 6570 [1,1,0,0,0,0|1,0,0]=3 1287 B9R1.69 CC1=CC=C(O)C(N)=N1 5622 [1,1,0,0,0,0|1,0,0]=3 1288 B9R1.69 CC1=CN=C(Br)C(Br)=C1 5399 [1,1,0,0,0,0|2,0,0]=4 1289 B9R1.69 CC1=CN=C(Br)C(C)=C1 16831 [1,1,0,0,0,0|2,0,0]=4 1290 B9R1.69 CC1=CN=C(Br)C(Cl)=C1 5775 [1,1,0,0,0,0|2,0,0]=4 1291 B9R1.69 CC1=CN=C(Br)C(F)=C1 21377 [1,1,0,0,0,0|2,0,0]=4 1292 B9R1.69 CC1=CN=C(Br)C(I)=C1 5912 [1,1,0,0,0,0|2,0,0]=4 1293 B9R1.69 CC1=CN=C(Br)C(N)=C1 5762 [1,1,0,0,0,0|2,0,0]=4 1294 B9R1.69 CC1=CN=C(Br)C(O)=C1 5904 [1,1,0,0,0,0|2,0,0]=4 1295 B9R1.69 CC1=CN=C(C)C(Br)=C1 35361 [1,1,0,0,0,0|2,0,0]=4 1296 B9R1.69 CC1=CN=C(C)C(C)=C1 15901 [1,1,0,0,0,0|2,0,0]=4 1297 B9R1.69 CC1=CN=C(C)C=C1Br 45193 [1,1,0,0,0,0|2,0,0]=4 1298 B9R1.69 CC1=CN=C(Cl)C(Br)=C1 1167 [1,1,0,0,0,0|2,0,0]=4 1299 B9R1.69 CC1=CN=C(Cl)C(Cl)=C1 5409 [1,1,0,0,0,0|2,0,0]=4 1300 B9R1.69 CC1=CN=C(Cl)C(F)=C1 14231 [1,1,0,0,0,0|2,0,0]=4 1301 B9R1.69 CC1=CN=C(Cl)C(I)=C1 6144 [1,1,0,0,0,0|2,0,0]=4 1302 B9R1.69 CC1=CN=C(Cl)C(N)=C1 1152 [1,1,0,0,0,0|2,0,0]=4 1303 B9R1.69 CC1=CN=C(Cl)C(O)=C1 6141 [1,1,0,0,0,0|2,0,0]=4 1304 B9R1.69 CC1=CN=C(Cl)C=C1Cl 5464 [1,1,0,0,0,0|2,0,0]=4 1305 B9R1.69 CC1=CN=C(Cl)C=C1I 27337 [1,1,0,0,0,0|2,0,0]=4 1306 B9R1.69 CC1=CN=C(F)C(Br)=C1 6249 [1,1,0,0,0,0|2,0,0]=4 1307 B9R1.69 CC1=CN=C(F)C(F)=C1 22307 [1,1,0,0,0,0|2,0,0]=4 1308 B9R1.69 CC1=CN=C(F)C(I)=C1 1304 [1,1,0,0,0,0|2,0,0]=4 1309 B9R1.69 CC1=CN=C(F)C=C1Br 36220 [1,1,0,0,0,0|2,0,0]=4 1310 B9R1.69 CC1=CN=C(F)C=C1I 1305 [1,1,0,0,0,0|2,0,0]=4 1311 B9R1.69 CC1=CN=C(N)C(Br)=C1 2240 [1,1,0,0,0,0|2,0,0]=4 1312 B9R1.69 CC1=CN=C(N)C(Cl)=C1 10522 [1,1,0,0,0,0|2,0,0]=4 1313 B9R1.69 CC1=CN=C(N)C(I)=C1 26706 [1,1,0,0,0,0|2,0,0]=4 1314 B9R1.69 CC1=CN=C(N)C(O)=C1 5621 [1,1,0,0,0,0|2,0,0]=4 1315 B9R1.69 CC1=CN=C(O)C(Br)=C1 6529 [1,1,0,0,0,0|1,0,0]=3 1316 B9R1.69 CC1=CN=C(O)C(I)=C1 26967 [1,1,0,0,0,0|1,0,0]=3 1317 B9R1.69 CC1=CN=C(O)C(N)=C1 6518 [1,1,0,0,0,0|1,0,0]=3 1318 B9R1.69 CC1=CN=C(O)N=C1O 9313 [1,1,0,0,0,0|2,0,0]=4 1319 B9R1.69 CC1=NC=C(Br)C(Cl)=C1 6670 [1,1,0,0,0,0|2,0,0]=4 1320 B9R1.69 CC1=NC=C(Br)C=C1Br 16457 [1,1,0,0,0,0|2,0,0]=4 1321 B9R1.69 CC1=NC=C(Br)C=C1Cl 27884 [1,1,0,0,0,0|2,0,0]=4 1322 B9R1.69 CC1=NC=C(Br)C=C1F 27017 [1,1,0,0,0,0|2,0,0]=4 1323 B9R1.69 CC1=NC=C(Br)C=C1N 17523 [1,1,0,0,0,0|2,0,0]=4 1324 B9R1.69 CC1=NC=C(F)C(Cl)=C1 6671 [1,1,0,0,0,0|2,0,0]=4 1325 B9R1.69 CC1=NC=C(O)C=C1Br 6702 [1,1,0,0,0,0|1,0,0]=3 1326 B9R1.69 CN1C=CC(Br)=CC1=O 27776 [1,1,0,0,0,0|2,0,0]=4 1327 B9R1.69 CN1C=CC(I)=CC1=O 27673 [1,1,0,0,0,0|2,0,0]=4 1328 B9R1.69 ClC1=C(Br)C=CC(Br)=C1 3633 [1,1,0,0,0,0|2,0,0]=4 1329 B9R1.69 ClC1=C(Br)C=CC(I)=C1 16805 [1,1,0,0,0,0|2,0,0]=4 1330 B9R1.69 ClC1=C(Cl)C=C(Br)C=C1 3611 [1,1,0,0,0,0|2,0,0]=4 1331 B9R1.69 ClC1=C(Cl)C=C(I)C=C1 3691 [1,1,0,0,0,0|2,0,0]=4 1332 B9R1.69 ClC1=C(I)C=C(Br)C=C1 35933 [1,1,0,0,0,0|2,0,0]=4 1333 B9R1.69 ClC1=C(I)C=CC(Br)=C1 3592 [1,1,0,0,0,0|2,0,0]=4 1334 B9R1.69 ClC1=C(I)C=CC(I)=C1 24307 [1,1,0,0,0,0|2,0,0]=4 1335 B9R1.69 ClC1=CC(Br)=C(Cl)C=C1 3609 [1,1,0,0,0,0|2,0,0]=4 1336 B9R1.69 ClC1=CC(Cl)=C(Br)C=C1 3608 [1,1,0,0,0,0|2,0,0]=4 1337 B9R1.69 ClC1=CC(Cl)=C(I)C=C1 3692 [1,1,0,0,0,0|2,0,0]=4 1338 B9R1.69 ClC1=CC(I)=C(Cl)C=C1 3694 [1,1,0,0,0,0|2,0,0]=4 1339 B9R1.69 Clc1cc(I)ccc1Br 4272 [1,1,0,0,0,0|2,0,0]=4 1340 B9R1.69 Clc1ccc(I)c(Br)c1 27432 [1,1,0,0,0,0|2,0,0]=4 1341 B9R1.69 FC1=C(Br)C=C(Br)C=C1 3446 [1,1,0,0,0,0|2,0,0]=4 1342 B9R1.69 FC1=C(Br)C=C(Cl)C=C1 3210 [1,1,0,0,0,0|2,0,0]=4 1343 B9R1.69 FC1=C(Br)C=C(I)C=C1 13485 [1,1,0,0,0,0|2,0,0]=4 1344 B9R1.69 FC1=C(Br)C=CC(Br)=C1 3448 [1,1,0,0,0,0|2,0,0]=4 1345 B9R1.69 FC1=C(Br)C=CC(Cl)=C1 3209 [1,1,0,0,0,0|2,0,0]=4 1346 B9R1.69 FC1=C(Br)C=CC(I)=C1 3231 [1,1,0,0,0,0|2,0,0]=4 1347 B9R1.69 FC1=C(Cl)C=C(Br)C=C1 2169 [1,1,0,0,0,0|2,0,0]=4 1348 B9R1.69 FC1=C(Cl)C=C(Cl)C=C1 2312 [1,1,0,0,0,0|2,0,0]=4 1349 B9R1.69 FC1=C(Cl)C=C(I)C=C1 3433 [1,1,0,0,0,0|2,0,0]=4 1350 B9R1.69 FC1=C(Cl)C=C(S)C=C1 2857 [1,1,0,0,0,0|1,1,0]=4 1351 B9R1.69 FC1=C(Cl)C=CC(Br)=C1 2255 [1,1,0,0,0,0|2,0,0]=4 1352 B9R1.69 FC1=C(Cl)C=CC(Cl)=C1 3454 [1,1,0,0,0,0|2,0,0]=4 1353 B9R1.69 FC1=C(Cl)C=CC(I)=C1 9517 [1,1,0,0,0,0|2,0,0]=4 1354 B9R1.69 FC1=C(F)C=C(Br)C=C1 2303 [1,1,0,0,0,0|2,0,0]=4 1355 B9R1.69 FC1=C(F)C=C(Cl)C=C1 3417 [1,1,0,0,0,0|2,0,0]=4 1356 B9R1.69 FC1=C(F)C=C(I)C=C1 3461 [1,1,0,0,0,0|2,0,0]=4 1357 B9R1.69 FC1=C(F)C=C(S)C=C1 6772 [1,1,0,0,0,0|1,1,0]=4 1358 B9R1.69 FC1=C(I)C=C(Br)C=C1 4294 [1,1,0,0,0,0|2,0,0]=4 1359 B9R1.69 FC1=C(I)C=C(Cl)C=C1 8538 [1,1,0,0,0,0|2,0,0]=4 1360 B9R1.69 FC1=C(I)C=CC(Br)=C1 3232 [1,1,0,0,0,0|2,0,0]=4 1361 B9R1.69 FC1=C(I)C=CC(I)=C1 4404 [1,1,0,0,0,0|2,0,0]=4 1362 B9R1.69 FC1=C(S)C=CC(Br)=C1 28392 [1,1,0,0,0,0|1,1,0]=4 1363 B9R1.69 FC1=CC(Br)=C(Br)C=C1 3445 [1,1,0,0,0,0|2,0,0]=4 1364 B9R1.69 FC1=CC(Br)=C(F)C=C1 2302 [1,1,0,0,0,0|2,0,0]=4 1365 B9R1.69 FC1=CC(Br)=C(I)C=C1 3234 [1,1,0,0,0,0|2,0,0]=4 1366 B9R1.69 FC1=CC(Cl)=C(Br)C=C1 3755 [1,1,0,0,0,0|2,0,0]=4 1367 B9R1.69 FC1=CC(Cl)=C(Cl)C=C1 3453 [1,1,0,0,0,0|2,0,0]=4 1368 B9R1.69 FC1=CC(Cl)=C(F)C=C1 8529 [1,1,0,0,0,0|2,0,0]=4 1369 B9R1.69 FC1=CC(Cl)=C(I)C=C1 3434 [1,1,0,0,0,0|2,0,0]=4 1370 B9R1.69 FC1=CC(Cl)=C(S)C=C1 2850 [1,1,0,0,0,0|1,1,0]=4 1371 B9R1.69 FC1=CC(F)=C(Br)C=C1 2301 [1,1,0,0,0,0|2,0,0]=4 1372 B9R1.69 FC1=CC(F)=C(Cl)C=C1 3415 [1,1,0,0,0,0|2,0,0]=4 1373 B9R1.69 FC1=CC(F)=C(F)C=C1 1068 [1,1,0,0,0,0|2,0,0]=4 1374 B9R1.69 FC1=CC(F)=C(I)C=C1 3463 [1,1,0,0,0,0|2,0,0]=4 1375 B9R1.69 FC1=CC(F)=C(S)C=C1 2875 [1,1,0,0,0,0|1,1,0]=4 1376 B9R1.69 FC1=CC(I)=C(Br)C=C1 3233 [1,1,0,0,0,0|2,0,0]=4 1377 B9R1.69 FC1=CC(I)=C(Cl)C=C1 3432 [1,1,0,0,0,0|2,0,0]=4 1378 B9R1.69 FC1=CC(I)=C(F)C=C1 4402 [1,1,0,0,0,0|2,0,0]=4 1379 B9R1.69 FC1=CC(S)=C(F)C=C1 6873 [1,1,0,0,0,0|2,0,0]=4 1380 B9R1.69 FC1=CC=C(Cl)C(F)=C1 4271 [1,1,0,0,0,0|2,0,0]=4 1381 B9R1.69 FC1=CC=C(Cl)C=C1F 4274 [1,1,0,0,0,0|2,0,0]=4 1382 B9R1.69 Fc1cc(Cl)ccc1I 3435 [1,1,0,0,0,0|2,0,0]=4 1383 B9R1.69 Fc1ccc(Cl)c(Br)c1 4270 [1,1,0,0,0,0|2,0,0]=4 1384 B9R1.69 NC1=C(Br)C=C(Br)C=C1 3447 [1,1,0,0,0,0|2,0,0]=4 1385 B9R1.69 NC1=C(Br)C=C(Cl)C=C1 3576 [1,1,0,0,0,0|2,0,0]=4 1386 B9R1.69 NC1=C(Br)C=C(F)C=C1 2918 [1,1,0,0,0,0|2,0,0]=4 1387 B9R1.69 NC1=C(Br)C=C(I)C=C1 5331 [1,1,0,0,0,0|2,0,0]=4 1388 B9R1.69 NC1=C(Br)C=CC(Br)=C1 3452 [1,1,0,0,0,0|2,0,0]=4 1389 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 3577 [1,1,0,0,0,0|2,0,0]=4 1390 B9R1.69 NC1=C(Br)C=CC(F)=C1 1524 [1,1,0,0,0,0|2,0,0]=4 1391 B9R1.69 NC1=C(Br)C=CC(O)=C1 32237 [1,1,0,0,0,0|1,0,0]=3 1392 B9R1.69 NC1=C(Cl)C=C(Br)C=C1 3578 [1,1,0,0,0,0|2,0,0]=4 1393 B9R1.69 NC1=C(Cl)C=C(Cl)C=C1 20789 [1,1,0,0,0,0|2,0,0]=4 1394 B9R1.69 NC1=C(Cl)C=C(F)C=C1 2943 [1,1,0,0,0,0|2,0,0]=4 1395 B9R1.69 NC1=C(Cl)C=C(I)C=C1 3811 [1,1,0,0,0,0|2,0,0]=4 1396 B9R1.69 NC1=C(Cl)C=C(O)C=C1 29212 [1,1,0,0,0,0|1,0,0]=3 1397 B9R1.69 NC1=C(Cl)C=C(O)C=C1 4513 [1,1,0,0,0,0|1,0,0]=3 1398 B9R1.69 NC1=C(Cl)C=CC(Cl)=C1 10755 [1,1,0,0,0,0|2,0,0]=4 1399 B9R1.69 NC1=C(Cl)C=CC(F)=C1 1517 [1,1,0,0,0,0|2,0,0]=4 1400 B9R1.69 NC1=C(F)C=C(Br)C=C1 1525 [1,1,0,0,0,0|2,0,0]=4 1401 B9R1.69 NC1=C(F)C=C(Br)C=C1 5316 [1,1,0,0,0,0|2,0,0]=4 1402 B9R1.69 NC1=C(F)C=C(Cl)C=C1 1514 [1,1,0,0,0,0|2,0,0]=4 1403 B9R1.69 NC1=C(F)C=C(F)C=C1 2294 [1,1,0,0,0,0|2,0,0]=4 1404 B9R1.69 NC1=C(F)C=C(I)C=C1 1532 [1,1,0,0,0,0|2,0,0]=4 1405 B9R1.69 NC1=C(F)C=C(O)C=C1 19088 [1,1,0,0,0,0|1,0,0]=3 1406 B9R1.69 NC1=C(F)C=C(O)C=C1 2832 [1,1,0,0,0,0|1,0,0]=3 1407 B9R1.69 NC1=C(F)C=C(S)C=C1 6878 [1,1,0,0,0,0|1,1,0]=4 1408 B9R1.69 NC1=C(F)C=CC(Br)=C1 13482 [1,1,0,0,0,0|2,0,0]=4 1409 B9R1.69 NC1=C(F)C=CC(Br)=C1 5319 [1,1,0,0,0,0|2,0,0]=4 1410 B9R1.69 NC1=C(F)C=CC(Cl)=C1 1515 [1,1,0,0,0,0|2,0,0]=4 1411 B9R1.69 NC1=C(F)C=CC(F)=C1 1531 [1,1,0,0,0,0|2,0,0]=4 1412 B9R1.69 NC1=C(F)C=CC(O)=C1 4776 [1,1,0,0,0,0|1,0,0]=3 1413 B9R1.69 NC1=C(I)C=C(Br)C=C1 3784 [1,1,0,0,0,0|2,0,0]=4 1414 B9R1.69 NC1=C(I)C=C(Cl)C=C1 3645 [1,1,0,0,0,0|2,0,0]=4 1415 B9R1.69 NC1=C(I)C=C(F)C=C1 3413 [1,1,0,0,0,0|2,0,0]=4 1416 B9R1.69 NC1=C(I)C=CC(Br)=C1 5332 [1,1,0,0,0,0|2,0,0]=4 1417 B9R1.69 NC1=C(I)C=CC(Cl)=C1 5286 [1,1,0,0,0,0|2,0,0]=4 1418 B9R1.69 NC1=C(I)C=CC(F)=C1 1535 [1,1,0,0,0,0|2,0,0]=4 1419 B9R1.69 NC1=C(N)C=C(Br)C=C1 4315 [1,1,0,0,0,0|2,0,0]=4 1420 B9R1.69 NC1=C(N)C=C(Cl)C=C1 4350 [1,1,0,0,0,0|2,0,0]=4 1421 B9R1.69 NC1=C(N)C=C(I)C=C1 28451 [1,1,0,0,0,0|2,0,0]=4 1422 B9R1.69 NC1=C(O)C=C(Br)C=C1 10469 [1,1,0,0,0,0|2,0,0]=4 1423 B9R1.69 NC1=C(O)C=C(Cl)C=C1 1478 [1,1,0,0,0,0|2,0,0]=4 1424 B9R1.69 NC1=C(O)C=C(F)C=C1 2828 [1,1,0,0,0,0|2,0,0]=4 1425 B9R1.69 NC1=C(O)C=C(O)C=C1 27733 [1,1,0,0,0,0|1,0,0]=3 1426 B9R1.69 NC1=C(O)C=CC(Br)=C1 4511 [1,1,0,0,0,0|1,0,0]=3 1427 B9R1.69 NC1=C(O)C=CC(F)=C1 2825 [1,1,0,0,0,0|1,0,0]=3 1428 B9R1.69 NC1=C(O)C=NC(Cl)=C1 24434 [1,1,0,0,0,0|2,0,0]=4 1429 B9R1.69 NC1=C(S)C=C(Br)C=C1 21899 [1,1,0,0,0,0|2,0,0]=4 1430 B9R1.69 NC1=C(S)C=C(Cl)C=C1 21806 [1,1,0,0,0,0|2,0,0]=4 1431 B9R1.69 NC1=C(S)C=C(F)C=C1 21900 [1,1,0,0,0,0|2,0,0]=4 1432 B9R1.69 NC1=C(S)C=CC(Cl)=C1 5427 [1,1,0,0,0,0|1,1,0]=4 1433 B9R1.69 NC1=CC(Br)=C(Cl)C=C1 5307 [1,1,0,0,0,0|2,0,0]=4 1434 B9R1.69 NC1=CC(Br)=C(F)C=C1 2924 [1,1,0,0,0,0|2,0,0]=4 1435 B9R1.69 NC1=CC(Br)=C(I)C=C1 5323 [1,1,0,0,0,0|2,0,0]=4 1436 B9R1.69 NC1=CC(Br)=C(N)C=C1 28448 [1,1,0,0,0,0|2,0,0]=4 1437 B9R1.69 NC1=CC(Br)=C(O)C=C1 31097 [1,1,0,0,0,0|1,0,0]=3 1438 B9R1.69 NC1=CC(Br)=CC=C1Cl 3132 [1,1,0,0,0,0|2,0,0]=4 1439 B9R1.69 NC1=CC(Br)=CN=C1O 6513 [1,1,0,0,0,0|2,0,0]=4 1440 B9R1.69 NC1=CC(Cl)=C(Br)C=C1 3579 [1,1,0,0,0,0|2,0,0]=4 1441 B9R1.69 NC1=CC(Cl)=C(Cl)C=C1 2563 [1,1,0,0,0,0|2,0,0]=4 1442 B9R1.69 NC1=CC(Cl)=C(F)C=C1 2951 [1,1,0,0,0,0|2,0,0]=4 1443 B9R1.69 NC1=CC(Cl)=C(I)C=C1 3812 [1,1,0,0,0,0|2,0,0]=4 1444 B9R1.69 NC1=CC(Cl)=C(O)C=C1 18907 [1,1,0,0,0,0|1,0,0]=3 1445 B9R1.69 NC1=CC(Cl)=CN=C1O 6515 [1,1,0,0,0,0|2,0,0]=4 1446 B9R1.69 NC1=CC(F)=C(Br)C=C1 1526 [1,1,0,0,0,0|2,0,0]=4 1447 B9R1.69 NC1=CC(F)=C(Cl)C=C1 1516 [1,1,0,0,0,0|2,0,0]=4 1448 B9R1.69 NC1=CC(F)=C(F)C=C1 2295 [1,1,0,0,0,0|2,0,0]=4 1449 B9R1.69 NC1=CC(F)=C(I)C=C1 1534 [1,1,0,0,0,0|2,0,0]=4 1450 B9R1.69 NC1=CC(F)=C(O)C=C1 2831 [1,1,0,0,0,0|1,0,0]=3 1451 B9R1.69 NC1=CC(I)=C(N)C=C1 13068 [1,1,0,0,0,0|2,0,0]=4 1452 B9R1.69 NC1=CC(N)=C(Br)C=C1 27515 [1,1,0,0,0,0|2,0,0]=4 1453 B9R1.69 NC1=CC(N)=C(F)C=C1 2538 [1,1,0,0,0,0|2,0,0]=4 1454 B9R1.69 NC1=CC(O)=C(Cl)C=C1 21902 [1,1,0,0,0,0|2,0,0]=4 1455 B9R1.69 NC1=CC(O)=CN=C1O 5518 [1,1,0,0,0,0|1,0,0]=3 1456 B9R1.69 NC1=CC=C(F)C=C1N 4357 [1,1,0,0,0,0|2,0,0]=4 1457 B9R1.69 NC1=CN=C(O)C(N)=C1 6446 [1,1,0,0,0,0|2,0,0]=4 1458 B9R1.69 NC1=NC=C(O)C=C1Br 5553 [1,1,0,0,0,0|2,0,0]=4 1459 B9R1.69 NC1=NC=C(O)C=C1Cl 5558 [1,1,0,0,0,0|2,0,0]=4 1460 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 3594 [1,1,0,0,0,0|1,0,0]=3 1461 B9R1.69 OC1=C(Br)C=C(F)C=C1 1485 [1,1,0,0,0,0|1,0,0]=3 1462 B9R1.69 OC1=C(Br)C=C(I)C=C1 27942 [1,1,0,0,0,0|1,0,0]=3 1463 B9R1.69 OC1=C(Br)C=CC(Br)=C1 14527 [1,1,0,0,0,0|2,0,0]=4 1464 B9R1.69 OC1=C(Br)C=CC(Cl)=C1 10956 [1,1,0,0,0,0|2,0,0]=4 1465 B9R1.69 OC1=C(Br)C=CC(F)=C1 1964 [1,1,0,0,0,0|2,0,0]=4 1466 B9R1.69 OC1=C(Cl)C=C(Br)C=C1 3596 [1,1,0,0,0,0|1,0,0]=3 1467 B9R1.69 OC1=C(Cl)C=C(F)C=C1 2372 [1,1,0,0,0,0|1,0,0]=3 1468 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 1476 [1,1,0,0,0,0|2,0,0]=4 1469 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 24852 [1,1,0,0,0,0|2,0,0]=4 1470 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 3697 [1,1,0,0,0,0|2,0,0]=4 1471 B9R1.69 OC1=C(Cl)C=CC(F)=C1 2146 [1,1,0,0,0,0|2,0,0]=4 1472 B9R1.69 OC1=C(Cl)C=CC(I)=C1 3651 [1,1,0,0,0,0|2,0,0]=4 1473 B9R1.69 OC1=C(F)C=C(Br)C=C1 1488 [1,1,0,0,0,0|1,0,0]=3 1474 B9R1.69 OC1=C(F)C=C(Cl)C=C1 2861 [1,1,0,0,0,0|1,0,0]=3 1475 B9R1.69 OC1=C(F)C=C(F)C=C1 2874 [1,1,0,0,0,0|1,0,0]=3 1476 B9R1.69 OC1=C(F)C=C(I)C=C1 26350 [1,1,0,0,0,0|1,0,0]=3 1477 B9R1.69 OC1=C(F)C=CC(Br)=C1 1490 [1,1,0,0,0,0|2,0,0]=4 1478 B9R1.69 OC1=C(F)C=CC(Cl)=C1 1492 [1,1,0,0,0,0|2,0,0]=4 1479 B9R1.69 OC1=C(F)C=CC(F)=C1 3464 [1,1,0,0,0,0|2,0,0]=4 1480 B9R1.69 OC1=C(F)C=CC(I)=C1 18134 [1,1,0,0,0,0|2,0,0]=4 1481 B9R1.69 OC1=C(I)C=C(Br)C=C1 28356 [1,1,0,0,0,0|1,0,0]=3 1482 B9R1.69 OC1=C(I)C=C(Cl)C=C1 28364 [1,1,0,0,0,0|1,0,0]=3 1483 B9R1.69 OC1=C(I)C=C(F)C=C1 28090 [1,1,0,0,0,0|1,0,0]=3 1484 B9R1.69 OC1=C(I)C=CC(Br)=C1 31124 [1,1,0,0,0,0|2,0,0]=4 1485 B9R1.69 OC1=C(I)C=CC(Cl)=C1 9582 [1,1,0,0,0,0|2,0,0]=4 1486 B9R1.69 OC1=C(I)C=CC(F)=C1 28089 [1,1,0,0,0,0|2,0,0]=4 1487 B9R1.69 OC1=C(I)C=CC(I)=C1 28127 [1,1,0,0,0,0|2,0,0]=4 1488 B9R1.69 OC1=CC(Br)=C(Br)C=C1 33264 [1,1,0,0,0,0|1,0,0]=3 1489 B9R1.69 OC1=CC(Br)=C(Cl)C=C1 3595 [1,1,0,0,0,0|1,0,0]=3 1490 B9R1.69 OC1=CC(Br)=C(F)C=C1 1486 [1,1,0,0,0,0|1,0,0]=3 1491 B9R1.69 OC1=CC(Br)=CN=C1O 5415 [1,1,0,0,0,0|2,0,0]=4 1492 B9R1.69 OC1=CC(Cl)=C(Br)C=C1 3597 [1,1,0,0,0,0|1,0,0]=3 1493 B9R1.69 OC1=CC(Cl)=C(Cl)C=C1 3698 [1,1,0,0,0,0|1,0,0]=3 1494 B9R1.69 OC1=CC(Cl)=C(F)C=C1 2856 [1,1,0,0,0,0|1,0,0]=3 1495 B9R1.69 OC1=CC(Cl)=C(I)C=C1 27608 [1,1,0,0,0,0|1,0,0]=3 1496 B9R1.69 OC1=CC(Cl)=CN=C1O 5416 [1,1,0,0,0,0|2,0,0]=4 1497 B9R1.69 OC1=CC(F)=C(Br)C=C1 1489 [1,1,0,0,0,0|1,0,0]=3 1498 B9R1.69 OC1=CC(F)=C(Cl)C=C1 1493 [1,1,0,0,0,0|1,0,0]=3 1499 B9R1.69 OC1=CC(F)=C(F)C=C1 2315 [1,1,0,0,0,0|1,0,0]=3 1500 B9R1.69 OC1=CC(F)=C(I)C=C1 27944 [1,1,0,0,0,0|1,0,0]=3 1501 B9R1.69 OC1=CC(F)=C(O)C=C1 16452 [1,1,0,0,0,0|0,0,0]=2 1502 B9R1.69 OC1=CC(I)=C(Cl)C=C1 28365 [1,1,0,0,0,0|1,0,0]=3 1503 B9R1.69 OC1=CC(I)=C(F)C=C1 33431 [1,1,0,0,0,0|1,0,0]=3 1504 B9R1.69 OC1=CC(O)=C(Br)C=C1 27082 [1,1,0,0,0,0|1,0,0]=3 1505 B9R1.69 OC1=CC(O)=C(Cl)C=C1 44767 [1,1,0,0,0,0|1,0,0]=3 1506 B9R1.69 OC1=CC(O)=C(F)C=C1 22656 [1,1,0,0,0,0|1,0,0]=3 1507 B9R1.69 OC1=CC(O)=NC=C1Cl 19875 [1,1,0,0,0,0|2,0,0]=4 1508 B9R1.69 OC1=CC=C(Cl)C=C1Cl 22008 [1,1,0,0,0,0|1,0,0]=3 1509 B9R1.69 OC1=CC=C(Cl)C=C1O 2215 [1,1,0,0,0,0|1,0,0]=3 1510 B9R1.69 OC1=CC=C(F)C=C1O 4143 [1,1,0,0,0,0|1,0,0]=3 1511 B9R1.69 OC1=CC=C(F)N=C1Br 36086 [1,1,0,0,0,0|2,0,0]=4 1512 B9R1.69 OC1=CC=C(F)N=C1F 22312 [1,1,0,0,0,0|2,0,0]=4 1513 B9R1.69 OC1=CN=C(Br)C(Cl)=C1 5771 [1,1,0,0,0,0|2,0,0]=4 1514 B9R1.69 OC1=CN=C(Cl)C(Br)=C1 6116 [1,1,0,0,0,0|2,0,0]=4 1515 B9R1.69 OC1=CN=C(Cl)C(Cl)=C1 5406 [1,1,0,0,0,0|2,0,0]=4 1516 B9R1.69 OC1=CN=C(Cl)C(F)=C1 6136 [1,1,0,0,0,0|2,0,0]=4 1517 B9R1.69 OC1=CN=C(F)C(Br)=C1 6247 [1,1,0,0,0,0|2,0,0]=4 1518 B9R1.69 OC1=CN=C(F)C(Cl)=C1 6262 [1,1,0,0,0,0|2,0,0]=4 1519 B9R1.69 OC1=CN=C(O)N=C1O 9614 [1,1,0,0,0,0|2,0,0]=4 1520 B9R1.69 OC1=NC=C(Br)C=C1Br 6448 [1,1,0,0,0,0|2,0,0]=4 1521 B9R1.69 OC1=NC=C(Br)C=C1I 26900 [1,1,0,0,0,0|2,0,0]=4 1522 B9R1.69 OC1=NC=C(Cl)C(I)=C1 20389 [1,1,0,0,0,0|2,0,0]=4 1523 B9R1.69 OC1=NC=C(Cl)C=C1Br 6524 [1,1,0,0,0,0|2,0,0]=4 1524 B9R1.69 OC1=NC=C(Cl)C=C1Cl 6510 [1,1,0,0,0,0|2,0,0]=4 1525 B9R1.69 OC1=NC=C(Cl)C=C1F 6542 [1,1,0,0,0,0|2,0,0]=4 1526 B9R1.69 OC1=NC=C(F)C(Br)=C1 6559 [1,1,0,0,0,0|2,0,0]=4 1527 B9R1.69 OC1=NC=C(F)C=C1Br 14287 [1,1,0,0,0,0|2,0,0]=4 1528 B9R1.69 OC1=NC=C(F)C=C1I 23345 [1,1,0,0,0,0|2,0,0]=4 1529 B9R1.69 SC1=C(Cl)C=C(Cl)C=C1 6798 [1,1,0,0,0,0|1,1,0]=4 1530 B9R1.69 SC1=C(Cl)C=CC(Cl)=C1 6801 [1,1,0,0,0,0|2,0,0]=4 1531 B9R1.69 SC1=CC(Cl)=C(Cl)C=C1 6803 [1,1,0,0,0,0|1,1,0]=4 1532 B9R1.21 O=CC1=CC=C(CO)O1 35936 [0,1,0,0,1,0|1,0,1]=4 1533 B9R1.21 OCC1=CC=C(CO)O1 19995 [0,1,0,0,1,0|1,0,0]=3 1534 B11R1.1 C#CCOC1=CC=C(N)C=C1 22969 [0,2,0,0,0,0|2,0,0]=4 1535 B11R1.1 CC1=CC=C(CSC#N)C=C1 31941 [0,2,0,0,0,0|1,1,0]=4 1536 B11R1.1 CCCCC1=CC=C(Br)C=C1 15109 [0,2,0,0,0,0|2,0,0]=4 1537 B11R1.1 CCCCC1=CC=C(I)C=C1 3969 [0,2,0,0,0,0|2,0,0]=4 1538 B11R1.1 CCCCC1=CC=C(N)C=C1 23885 [0,2,0,0,0,0|2,0,0]=4 1539 B11R1.1 CCCOC1=CC=C(O)C=C1 13204 [0,2,0,0,0,0|1,0,0]=3 1540 B11R1.1 CNCCC1=CC=C(O)C=C1 15214 [0,2,0,0,0,0|1,0,0]=3 1541 B11R1.1 COCCc1ccc(O)cc1 27303 [0,2,0,0,0,0|0,0,0]=2 1542 B11R1.1 COCOC1=CC=C(C)C=C1 15106 [0,2,0,0,0,0|1,0,0]=3 1543 B11R1.1 COCOC1=NC=C(Br)C=C1 20344 [0,2,0,0,0,0|2,0,0]=4 1544 B11R1.1 ClC1=CC=C(CCCBr)C=C1 25685 [0,2,0,0,0,0|2,0,0]=4 1545 B11R1.1 ClC1=CC=C(OCCBr)C=C1 17076 [0,2,0,0,0,0|2,0,0]=4 1546 B11R1.1 ClCCCC1=CC=C(Cl)C=C1 23877 [0,2,0,0,0,0|2,0,0]=4 1547 B11R1.1 FC1=CC=C(CN=C=S)C=C1 5031 [0,2,0,0,0,0|1,1,0]=4 1548 B11R1.1 FC1=CC=C(OCCBr)C=C1 15003 [0,2,0,0,0,0|2,0,0]=4 1549 B11R1.1 N#CCCC1=CC=C(Br)C=C1 20432 [0,2,0,0,0,0|2,0,0]=4 1550 B11R1.1 N#CCCC1=CC=C(O)C=C1 13636 [0,2,0,0,0,0|1,0,0]=3 1551 B11R1.1 N#CCOC1=CC=C(Cl)C=C1 15005 [0,2,0,0,0,0|2,0,0]=4 1552 B11R1.1 NC1=CC=C(NCCO)C=C1 20871 [0,2,0,0,0,0|1,0,0]=3 1553 B11R1.1 NCCCC1=CC=C(O)C=C1 35658 [0,2,0,0,0,0|1,0,0]=3 1554 B11R1.1 NCCOC1=CC=C(F)C=C1 13107 [0,2,0,0,0,0|2,0,0]=4 1555 B11R1.1 O=C=NCC1=CC=C(F)C=C1 28902 [0,2,0,0,0,0|1,0,1]=4 1556 B11R1.1 O=CCCC1=CC=C(F)C=C1 31590 [0,2,0,0,0,0|1,0,1]=4 1557 B11R1.1 O=CCCC1=CC=C(O)C=C1 13990 [0,2,0,0,0,0|0,0,1]=3 1558 B11R1.1 OCCCC1=CC=C(Br)C=C1 3984 [0,2,0,0,0,0|1,0,0]=3 1559 B11R1.1 OCCCC1=CC=C(Cl)C=C1 9806 [0,2,0,0,0,0|1,0,0]=3 1560 B11R1.1 OCCCC1=CC=C(O)C=C1 25607 [0,2,0,0,0,0|0,0,0]=2 1561 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 31604 [0,2,0,0,0,0|1,0,1]=4 1562 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 28145 [0,2,0,0,0,0|1,0,1]=4 1563 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 28133 [0,2,0,0,0,0|1,0,1]=4 1564 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 35682 [0,2,0,0,0,0|0,0,1]=3 1565 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 17726 [0,2,0,0,0,0|0,0,2]=4 1566 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 27490 [0,2,0,0,0,0|2,0,0]=4 1567 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 34794 [0,2,0,0,0,0|2,0,0]=4 1568 B11R1.20 CC(C)OC1=CC=C(N)C=C1 28330 [0,2,0,0,0,0|2,0,0]=4 1569 B11R1.20 CC(C)OC1=CC=C(O)C=C1 34515 [0,2,0,0,0,0|1,0,0]=3 1570 B11R1.20 CC(N)CC1=CC=C(F)C=C1 19961 [0,2,0,0,0,0|2,0,0]=4 1571 B11R1.20 CC1=CC=C(CC(O)=S)C=C1 10789 [0,2,0,0,0,0|1,0,0]=3 1572 B11R1.20 FC(F)OC1=CC=C(Br)C=C1 4309 [0,2,0,0,0,0|2,0,0]=4 1573 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 17532 [0,2,0,0,0,0|0,0,1]=3 1574 B11R1.20 NC1=CC=C(CC(=O)O)C=N1 25031 [0,2,0,0,0,0|2,0,0]=4 1575 B11R1.20 NC1=CC=C(OC(F)F)C=C1 8467 [0,2,0,0,0,0|2,0,0]=4 1576 B11R1.20 NC1=CN=C(CC(=O)O)C=C1 32286 [0,2,0,0,0,0|2,0,0]=4 1577 B11R1.20 Nc1ccc(CC(=O)O)cc1 22147 [0,2,0,0,0,0|1,0,0]=3 1578 B11R1.20 O=C(Cl)CC1=CC=C(Cl)C=C1 44721 [0,2,0,0,0,0|1,0,1]=4 1579 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 17517 [0,2,0,0,0,0|1,0,1]=4 1580 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 4246 [0,2,0,0,0,0|1,0,0]=3 1581 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 4250 [0,2,0,0,0,0|1,0,0]=3 1582 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 13909 [0,2,0,0,0,0|2,0,0]=4 1583 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 13432 [0,2,0,0,0,0|1,0,0]=3 1584 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 19614 [0,2,0,0,0,0|1,0,0]=3 1585 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 18835 [0,2,0,0,0,0|1,0,0]=3 1586 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 22193 [0,2,0,0,0,0|0,0,0]=2 1587 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 34915 [0,2,0,0,0,0|0,1,0]=3 1588 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 7423 [0,2,0,0,0,0|2,0,0]=4 1589 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 22351 [0,2,0,0,0,0|2,0,0]=4 1590 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 23893 [0,2,0,0,0,0|2,0,0]=4 1591 B11R1.22 CC1=CC=C([C@H](O)CN)C=C1 19376 [0,2,0,0,0,0|1,0,0]=3 1592 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 12477 [0,2,0,0,0,0|2,0,0]=4 1593 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 20971 [0,2,0,0,0,0|2,0,0]=4 1594 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 36050 [0,2,0,0,0,0|2,0,0]=4 1595 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 12578 [0,2,0,0,0,0|2,0,0]=4 1596 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 35537 [0,2,0,0,0,0|2,0,0]=4 1597 B11R1.22 CC[C@@H](O)C1=CC=C(Br)C=C1 15566 [0,2,0,0,0,0|1,0,0]=3 1598 B11R1.22 CC[C@@H](O)C1=CC=C(Cl)C=C1 15579 [0,2,0,0,0,0|1,0,0]=3 1599 B11R1.22 CC[C@@H](O)C1=CC=C(F)C=C1 15586 [0,2,0,0,0,0|1,0,0]=3 1600 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 3962 [0,2,0,0,0,0|1,0,1]=4 1601 B11R1.22 COC(=O)C1=CC=C(C)C=C1 15479 [0,2,0,0,0,0|1,0,1]=4 1602 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 3708 [0,2,0,0,0,0|1,0,1]=4 1603 B11R1.22 COC(=O)C1=CC=C(F)C=C1 3566 [0,2,0,0,0,0|1,0,1]=4 1604 B11R1.22 COC(=O)C1=CC=C(I)C=C1 20378 [0,2,0,0,0,0|1,0,1]=4 1605 B11R1.22 COC(=O)C1=CC=C(N)C=C1 28506 [0,2,0,0,0,0|1,0,1]=4 1606 B11R1.22 COC(=O)C1=CC=C(O)C=C1 27407 [0,2,0,0,0,0|0,0,1]=3 1607 B11R1.22 COC(=O)C1=CC=C(O)C=C1 35335 [0,2,0,0,0,0|0,0,1]=3 1608 B11R1.22 N#C[C@H](O)C1=CC=C(Br)C=C1 17476 [0,2,0,0,0,0|1,0,0]=3 1609 B11R1.22 N#C[C@H](O)C1=CC=C(Cl)C=C1 17478 [0,2,0,0,0,0|1,0,0]=3 1610 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 29245 [0,2,0,0,0,0|2,0,0]=4 1611 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 16820 [0,2,0,0,0,0|2,0,0]=4 1612 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 16752 [0,2,0,0,0,0|2,0,0]=4 1613 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 22326 [0,2,0,0,0,0|2,0,0]=4 1614 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 19370 [0,2,0,0,0,0|1,0,0]=3 1615 B11R1.22 NCC(O)C1=CC=C(O)C=C1 18242 [0,2,0,0,0,0|0,0,0]=2 1616 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 3885 [0,2,0,0,0,0|0,0,2]=4 1617 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 28432 [0,2,0,0,0,0|1,0,1]=4 1618 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 16821 [0,2,0,0,0,0|2,0,0]=4 1619 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 3260 [0,2,0,0,0,0|2,0,0]=4 1620 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 13415 [0,2,0,0,0,0|2,0,0]=4 1621 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 22524 [0,2,0,0,0,0|2,0,0]=4 1622 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 3320 [0,2,0,0,0,0|1,0,0]=3 1623 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 7424 [0,2,0,0,0,0|2,0,0]=4 1624 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 3372 [0,2,0,0,0,0|2,0,0]=4 1625 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 3269 [0,2,0,0,0,0|2,0,0]=4 1626 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 29269 [0,2,0,0,0,0|1,0,0]=3 1627 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 12125 [0,2,0,0,0,0|0,0,2]=4 1628 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 27665 [0,2,0,0,0,0|1,0,0]=3 1629 B11R1.81 CC1=C(CC#N)C=CC(Br)=C1 31471 [0,2,0,0,0,0|2,0,0]=4 1630 B11R1.81 CC1=C(CC#N)C=CC(F)=C1 31533 [0,2,0,0,0,0|2,0,0]=4 1631 B11R1.81 CC1=CC(F)=C(CC#N)C=C1 4171 [0,2,0,0,0,0|2,0,0]=4 1632 B11R1.81 CCCC1=C(O)C=C(O)C=C1 25562 [0,2,0,0,0,0|1,0,0]=3 1633 B11R1.81 CCOC1=C(Cl)C=C(Cl)C=C1 9513 [0,2,0,0,0,0|2,0,0]=4 1634 B11R1.81 CCOC1=C(Cl)C=C(F)C=C1 3155 [0,2,0,0,0,0|2,0,0]=4 1635 B11R1.81 CCOC1=C(F)C=C(Cl)C=C1 3163 [0,2,0,0,0,0|2,0,0]=4 1636 B11R1.81 CCOC1=C(N)C=C(N)C=C1 3168 [0,2,0,0,0,0|2,0,0]=4 1637 B11R1.81 CNCC1=C(Cl)C=C(Cl)C=C1 22904 [0,2,0,0,0,0|2,0,0]=4 1638 B11R1.81 COCC1=C(N)C=C(Br)C=C1 31052 [0,2,0,0,0,0|1,0,0]=3 1639 B11R1.81 N#CCC1=C(Br)C=C(Br)C=C1 28860 [0,2,0,0,0,0|2,0,0]=4 1640 B11R1.81 N#CCC1=C(Br)C=C(F)C=C1 16802 [0,2,0,0,0,0|2,0,0]=4 1641 B11R1.81 N#CCC1=C(Cl)C=C(Br)C=C1 31548 [0,2,0,0,0,0|2,0,0]=4 1642 B11R1.81 N#CCC1=C(Cl)C=C(Cl)C=C1 9014 [0,2,0,0,0,0|2,0,0]=4 1643 B11R1.81 N#CCC1=C(Cl)C=C(F)C=C1 4251 [0,2,0,0,0,0|2,0,0]=4 1644 B11R1.81 N#CCC1=C(F)C=C(Br)C=C1 10413 [0,2,0,0,0,0|2,0,0]=4 1645 B11R1.81 N#CCC1=C(F)C=C(Cl)C=C1 4296 [0,2,0,0,0,0|2,0,0]=4 1646 B11R1.81 N#CCC1=C(F)C=C(F)C=C1 1586 [0,2,0,0,0,0|2,0,0]=4 1647 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 31586 [0,2,0,0,0,0|1,0,0]=3 1648 B11R1.81 O\N=C\C1=C(F)C=C(F)C=C1 2904 [0,2,0,0,0,0|1,0,1]=4 1649 B11R1.83 C#CC1=CC=C(CCC)C=C1 10973 [0,2,0,0,0,0|2,0,0]=4 1650 B11R1.83 CCC1=CN=C(CCO)C=C1 16511 [0,2,0,0,0,0|2,0,0]=4 1651 B11R1.83 CCOC1=CC=C(C=O)C=C1 13134 [0,2,0,0,0,0|0,0,2]=4 1652 B11R1.83 CCOC1=CC=C(CC)C=C1 3172 [0,2,0,0,0,0|1,0,0]=3 1653 B11R1.83 CCOC1=CC=C(CCl)C=C1 17445 [0,2,0,0,0,0|1,0,0]=3 1654 B11R1.83 CCOC1=CC=C(CO)C=C1 27464 [0,2,0,0,0,0|0,0,0]=2 1655 B11R1.83 CNCC1=CC=C(OC)C=C1 10499 [0,2,0,0,0,0|1,0,0]=3 1656 B11R1.83 COC1=CC=C(CC#N)C=C1 20331 [0,2,0,0,0,0|1,0,0]=3 1657 B11R1.83 COC1=CC=C(CC=O)C=C1 25207 [0,2,0,0,0,0|0,0,1]=3 1658 B11R1.83 COC1=CC=C(CCN)C=C1 4589 [0,2,0,0,0,0|1,0,0]=3 1659 B11R1.83 COC1=CC=C(N=C=O)C=C1 1920 [0,2,0,0,0,0|0,0,2]=4 1660 B11R1.83 COC1=CC=C(OC#N)C=C1 20087 [0,2,0,0,0,0|1,0,1]=4 1661 B11R1.83 CSC1=CC=C(CC#N)C=C1 10715 [0,2,0,0,0,0|1,1,0]=4 1662 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 35689 [0,2,0,0,0,0|1,0,1]=4 1663 B11R1.83 N#CC1=CC=C(CCN)C=C1 31896 [0,2,0,0,0,0|2,0,0]=4 1664 B11R1.83 N#CC1=CC=C(CCN)C=C1 31898 [0,2,0,0,0,0|2,0,0]=4 1665 B11R1.192 CCOC1=CC(C)=C(Br)C=C1 25477 [0,2,0,0,0,0|2,0,0]=4 1666 B11R1.192 CCOC1=CC(C)=C(C)C=C1 3238 [0,2,0,0,0,0|2,0,0]=4 1667 B11R1.192 CCOC1=CC(Cl)=C(Br)C=C1 25405 [0,2,0,0,0,0|2,0,0]=4 1668 B11R1.192 CCOC1=CC(Cl)=C(Cl)C=C1 3242 [0,2,0,0,0,0|2,0,0]=4 1669 B11R1.192 CCOC1=CC(Cl)=C(F)C=C1 3159 [0,2,0,0,0,0|2,0,0]=4 1670 B11R1.192 CCOC1=CC(F)=C(Cl)C=C1 3164 [0,2,0,0,0,0|2,0,0]=4 1671 B11R1.192 CCOC1=CC(F)=C(F)C=C1 2327 [0,2,0,0,0,0|2,0,0]=4 1672 B11R1.192 CCOC1=CC(N)=C(N)C=C1 2153 [0,2,0,0,0,0|2,0,0]=4 1673 B11R1.192 CCOC1=CC=C(N)C(N)=C1 2484 [0,2,0,0,0,0|2,0,0]=4 1674 B11R1.192 COCC1=CC(F)=C(Br)C=C1 27438 [0,2,0,0,0,0|1,0,0]=3 1675 B11R1.192 COCC1=CC(N)=C(Br)C=C1 31047 [0,2,0,0,0,0|1,0,0]=3 1676 B11R1.192 Cc1cc(CC#N)ccc1Br 31491 [0,2,0,0,0,0|2,0,0]=4 1677 B11R1.192 Cc1cc(CC#N)ccc1F 31505 [0,2,0,0,0,0|2,0,0]=4 1678 B11R1.192 FC1=C(Cl)C=C(CCBr)C=C1 31594 [0,2,0,0,0,0|2,0,0]=4 1679 B11R1.192 FC1=C(F)C=C(CCBr)C=C1 31603 [0,2,0,0,0,0|2,0,0]=4 1680 B11R1.192 N#CCC1=CC(Br)=C(F)C=C1 26632 [0,2,0,0,0,0|2,0,0]=4 1681 B11R1.192 N#CCC1=CC(Cl)=C(Cl)C=C1 16506 [0,2,0,0,0,0|2,0,0]=4 1682 B11R1.192 N#CCC1=CC(Cl)=C(F)C=C1 18492 [0,2,0,0,0,0|2,0,0]=4 1683 B11R1.192 N#CCC1=CC(F)=C(Br)C=C1 28849 [0,2,0,0,0,0|2,0,0]=4 1684 B11R1.192 N#CCC1=CC(F)=C(Cl)C=C1 4299 [0,2,0,0,0,0|2,0,0]=4 1685 B11R1.192 N#CCC1=CC(F)=C(F)C=C1 4157 [0,2,0,0,0,0|2,0,0]=4 1686 B11R1.192 N#CCC1=CC(F)=C(I)C=C1 31431 [0,2,0,0,0,0|2,0,0]=4 1687 B11R1.192 NCCC1=CC(F)=C(F)C=C1 31257 [0,2,0,0,0,0|2,0,0]=4 1688 B11R1.192 NCCC1=CC(O)=C(O)C=C1 22727 [0,2,0,0,0,0|1,0,0]=3 1689 B11R1.192 OCCC1=CC(F)=C(F)C=C1 31602 [0,2,0,0,0,0|1,0,0]=3 1690 B11R1.192 OCCC1=CC=C(O)C(O)=C1 14271 [0,2,0,0,0,0|0,0,0]=2 1691 B11R1.3 C#CC1=CC=C(B(O)O)C=C1 33845 [0,2,0,0,0,0|1,0,1]=4 1692 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 30393 [0,2,0,0,0,0|1,0,1]=4 1693 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 20531 [0,2,0,0,0,0|1,0,1]=4 1694 B11R1.3 C=CC1=CC=C(B(O)O)C=C1 26297 [0,2,0,0,0,0|1,0,1]=4 1695 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 12624 [0,2,0,0,0,0|1,0,1]=4 1696 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 31192 [0,2,0,0,0,0|1,0,1]=4 1697 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 31334 [0,2,0,0,0,0|0,0,1]=3 1698 B11R1.3 CC(C)C1=CC=C(NN)C=C1 7533 [0,2,0,0,0,0|2,0,0]=4 1699 B11R1.3 CCC1=CC=C(B(O)O)C=C1 7884 [0,2,0,0,0,0|1,0,0]=3 1700 B11R1.3 CCC1=CC=C(B(O)O)C=N1 33743 [0,2,0,0,0,0|2,0,0]=4 1701 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 9725 [0,2,0,0,0,0|1,0,1]=4 1702 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 15495 [0,2,0,0,0,0|1,0,1]=4 1703 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 27848 [0,2,0,0,0,0|2,0,0]=4 1704 B11R1.3 CN(C)C1=CC=C(CO)C=C1 36061 [0,2,0,0,0,0|1,0,0]=3 1705 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 4517 [0,2,0,0,0,0|1,0,1]=4 1706 B11R1.3 COC1=CC=C(B(O)O)C=C1 15445 [0,2,0,0,0,0|1,0,0]=3 1707 B11R1.3 COC1=CC=C(B(O)O)C=C1 1867 [0,2,0,0,0,0|1,0,0]=3 1708 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 9808 [0,2,0,0,0,0|0,0,2]=4 1709 B11R1.3 COC1=CC=C(C(=O)O)C=C1 23856 [0,2,0,0,0,0|0,0,1]=3 1710 B11R1.3 COC1=CC=C(C(C)=O)C=C1 3324 [0,2,0,0,0,0|0,0,2]=4 1711 B11R1.3 COC1=CC=C(C(N)=S)C=C1 13558 [0,2,0,0,0,0|0,1,1]=4 1712 B11R1.3 COC1=CC=C(N(C)C)C=C1 16956 [0,2,0,0,0,0|2,0,0]=4 1713 B11R1.3 COC1=CN=C(C(=O)O)C=C1 15176 [0,2,0,0,0,0|1,0,1]=4 1714 B11R1.3 COC1=NC=C(B(O)O)C=C1 5047 [0,2,0,0,0,0|2,0,0]=4 1715 B11R1.3 COC1=NC=C(C(=O)O)C=C1 15177 [0,2,0,0,0,0|1,0,1]=4 1716 B11R1.3 COc1ccc([C@@H](C)N)cc1 9920 [0,2,0,0,0,0|1,0,0]=3 1717 B11R1.3 COc1ccc([C@H](C)N)cc1 9919 [0,2,0,0,0,0|1,0,0]=3 1718 B11R1.3 CSC1=CC=C(B(O)O)C=C1 9544 [0,2,0,0,0,0|1,1,0]=4 1719 B11R1.3 ClCC1=CC=C(C(Cl)Cl)C=C1 31325 [0,2,0,0,0,0|2,0,0]=4 1720 B11R1.3 N#CC1=CC=C(B(O)O)C=C1 1809 [0,2,0,0,0,0|1,0,1]=4 1721 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 19745 [0,2,0,0,0,0|1,0,1]=4 1722 B11R1.3 NC(=O)C1=CC=C(CBr)C=C1 34552 [0,2,0,0,0,0|1,0,1]=4 1723 B11R1.3 NCC1=CC=C(B(O)O)C=C1 5251 [0,2,0,0,0,0|1,0,0]=3 1724 B11R1.3 NCC1=CC=C(B(O)O)C=C1 7897 [0,2,0,0,0,0|1,0,0]=3 1725 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 5815 [0,2,0,0,0,0|1,0,0]=3 1726 B11R1.3 NCC1=CC=C([N+](=O)[O-])C=C1 12455 [0,2,0,0,0,0|1,0,1]=4 1727 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 7535 [0,2,0,0,0,0|1,0,1]=4 1728 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 7572 [0,2,0,0,0,0|1,0,1]=4 1729 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 14778 [0,2,0,0,0,0|1,0,1]=4 1730 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 28146 [0,2,0,0,0,0|1,0,0]=3 1731 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 15446 [0,2,0,0,0,0|1,0,0]=3 1732 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 12790 [0,2,0,0,0,0|0,0,0]=2 1733 B11R1.3 O=CC1=CC=C(B(O)O)C=C1 1720 [0,2,0,0,0,0|0,0,2]=4 1734 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 8075 [0,2,0,0,0,0|0,0,2]=4 1735 B11R1.3 O=[N+]([O-])C1=CC=C(CBr)C=C1 7473 [0,2,0,0,0,0|1,0,1]=4 1736 B11R1.3 O=[N+]([O-])C1=CC=C(CCl)C=C1 7476 [0,2,0,0,0,0|1,0,1]=4 1737 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 7472 [0,2,0,0,0,0|0,0,1]=3 1738 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 7903 [0,2,0,0,0,0|1,0,0]=3 1739 B11R1.3 OB(O)C1=CC=C(CCl)C=C1 8937 [0,2,0,0,0,0|1,0,0]=3 1740 B11R1.3 OCC1=CC=C(B(O)O)C=C1 1726 [0,2,0,0,0,0|0,0,0]=2 1741 B11R1.3 [C-]#[N+]C1=CC=C([C@@H](C)O)C=C1 14238 [0,2,0,0,0,0|1,0,0]=3 1742 B11R1.3 [C-]#[N+]C1=CC=C([C@H](C)O)C=C1 14243 [0,2,0,0,0,0|1,0,0]=3 1743 B11R1.279 COC1=C(Br)C=C(C#N)C=C1 3795 [0,2,0,0,0,0|1,0,1]=4 1744 B11R1.279 COC1=C(Br)C=C(C=O)C=C1 2643 [0,2,0,0,0,0|0,0,2]=4 1745 B11R1.279 COC1=C(Br)N=C(CO)C=C1 26737 [0,2,0,0,0,0|1,0,0]=3 1746 B11R1.279 COC1=C(C)C=C(C=O)C=C1 14879 [0,2,0,0,0,0|0,0,2]=4 1747 B11R1.279 COC1=C(C)C=C(CO)C=C1 24130 [0,2,0,0,0,0|0,0,0]=2 1748 B11R1.279 COC1=C(Cl)C=C(C#N)C=C1 3661 [0,2,0,0,0,0|1,0,1]=4 1749 B11R1.279 COC1=C(Cl)C=C(C=O)C=C1 2638 [0,2,0,0,0,0|0,0,2]=4 1750 B11R1.279 COC1=C(Cl)C=C(CBr)C=C1 31299 [0,2,0,0,0,0|1,0,0]=3 1751 B11R1.279 COC1=C(Cl)C=C(NN)C=C1 35436 [0,2,0,0,0,0|2,0,0]=4 1752 B11R1.279 COC1=C(F)C=C(C#N)C=C1 18462 [0,2,0,0,0,0|1,0,1]=4 1753 B11R1.279 COC1=C(F)C=C(C=O)C=C1 1448 [0,2,0,0,0,0|0,0,2]=4 1754 B11R1.279 COC1=C(F)C=C(CBr)C=C1 4923 [0,2,0,0,0,0|1,0,0]=3 1755 B11R1.279 COC1=C(N)C=C(C=O)C=C1 19765 [0,2,0,0,0,0|0,0,2]=4 1756 B11R1.279 COC1=C(O)C=C(C#N)C=C1 4806 [0,2,0,0,0,0|1,0,1]=4 1757 B11R1.279 COC1=C(O)C=C(C=O)C=C1 7770 [0,2,0,0,0,0|0,0,2]=4 1758 B11R1.279 COC1=C(O)C=C(CO)C=C1 15050 [0,2,0,0,0,0|0,0,0]=2 1759 B11R1.279 COC1=CC(Br)=C(C#N)C=C1 30831 [0,2,0,0,0,0|1,0,1]=4 1760 B11R1.279 COC1=CC(Br)=C(C=O)C=C1 12556 [0,2,0,0,0,0|0,0,2]=4 1761 B11R1.279 COC1=CC(Br)=C(CBr)C=C1 31331 [0,2,0,0,0,0|1,0,0]=3 1762 B11R1.279 COC1=CC(Br)=C(OC)C=C1 19785 [0,2,0,0,0,0|2,0,0]=4 1763 B11R1.279 COC1=CC(C)=C(C#N)C=C1 25451 [0,2,0,0,0,0|1,0,1]=4 1764 B11R1.279 COC1=CC(C)=C(C=O)C=C1 30912 [0,2,0,0,0,0|0,0,2]=4 1765 B11R1.279 COC1=CC(C)=C(OC)C=C1 4543 [0,2,0,0,0,0|2,0,0]=4 1766 B11R1.279 COC1=CC(Cl)=C(C#N)C=C1 4729 [0,2,0,0,0,0|1,0,1]=4 1767 B11R1.279 COC1=CC(Cl)=C(C=O)C=C1 27587 [0,2,0,0,0,0|0,0,2]=4 1768 B11R1.279 COC1=CC(Cl)=C(C=O)C=C1 30888 [0,2,0,0,0,0|0,0,2]=4 1769 B11R1.279 COC1=CC(Cl)=C(CBr)C=C1 31270 [0,2,0,0,0,0|1,0,0]=3 1770 B11R1.279 COC1=CC(F)=C(C#N)C=C1 4783 [0,2,0,0,0,0|1,0,1]=4 1771 B11R1.279 COC1=CC(F)=C(C=O)C=C1 1447 [0,2,0,0,0,0|0,0,2]=4 1772 B11R1.279 COC1=CC(F)=C(CBr)C=C1 24293 [0,2,0,0,0,0|1,0,0]=3 1773 B11R1.279 COC1=CC(F)=C(CCl)C=C1 25838 [0,2,0,0,0,0|1,0,0]=3 1774 B11R1.279 COC1=CC(F)=C(CO)C=C1 7733 [0,2,0,0,0,0|0,0,0]=2 1775 B11R1.279 COC1=CC(F)=C(NN)C=C1 11269 [0,2,0,0,0,0|2,0,0]=4 1776 B11R1.279 COC1=CC(F)=C(OC)C=C1 3050 [0,2,0,0,0,0|2,0,0]=4 1777 B11R1.279 COC1=CC(I)=C(C#N)C=C1 27647 [0,2,0,0,0,0|1,0,1]=4 1778 B11R1.279 COC1=CC(N)=C(C#N)C=C1 30767 [0,2,0,0,0,0|1,0,1]=4 1779 B11R1.279 COC1=CC(N)=C(OC)C=C1 25396 [0,2,0,0,0,0|2,0,0]=4 1780 B11R1.279 COC1=CC(O)=C(C#N)C=C1 22496 [0,2,0,0,0,0|1,0,1]=4 1781 B11R1.279 COC1=CC(O)=C(OC)C=C1 27372 [0,2,0,0,0,0|2,0,0]=4 1782 B11R1.279 COC1=CC(S)=C(OC)C=C1 6852 [0,2,0,0,0,0|2,0,0]=4 1783 B11R1.279 COC1=CC=C(C=O)C(O)=C1 8148 [0,2,0,0,0,0|0,0,2]=4 1784 B11R1.279 COc1ccc(CN)cc1F 31259 [0,2,0,0,0,0|1,0,0]=3 1785 B11R1.279 N#CC1=C(Br)C=C(CBr)C=C1 24598 [0,2,0,0,0,0|2,0,0]=4 1786 B11R1.279 N#CC1=C(F)C=C(CN)C=C1 16569 [0,2,0,0,0,0|2,0,0]=4 1787 B11R1.279 N#CC1=C(F)C=C(CO)C=C1 31301 [0,2,0,0,0,0|1,0,0]=3 1788 B11R1.279 N#CC1=CC(Br)=C(CBr)C=C1 31339 [0,2,0,0,0,0|2,0,0]=4 1789 B11R1.279 N#CC1=CC(Br)=C(CO)C=C1 31356 [0,2,0,0,0,0|1,0,0]=3 1790 B11R1.279 N#CC1=CC(Cl)=C(CO)C=C1 31319 [0,2,0,0,0,0|1,0,0]=3 1791 B11R1.279 N#CC1=CC(F)=C(CBr)C=C1 4907 [0,2,0,0,0,0|2,0,0]=4 1792 B11R1.279 N#CC1=CC(F)=C(CO)C=C1 11157 [0,2,0,0,0,0|1,0,0]=3 1793 B11R1.279 N#CC1=CC(I)=C(CBr)C=C1 27453 [0,2,0,0,0,0|2,0,0]=4 1794 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 12522 [0,2,0,0,0,0|2,0,0]=4 1795 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 3974 [0,2,0,0,0,0|2,0,0]=4 1796 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 21472 [0,2,0,0,0,0|2,0,0]=4 1797 B11R1.19 CC(C)(C)C1=CC=C(S)C=C1 6846 [0,2,0,0,0,0|1,1,0]=4 1798 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 16914 [0,2,0,0,0,0|2,0,0]=4 1799 B11R1.19 CC(C)(O)C1=CC=C(N)N=C1 30340 [0,2,0,0,0,0|2,0,0]=4 1800 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 26273 [0,2,0,0,0,0|2,0,0]=4 1801 B11R1.19 CC(F)(F)C1=CC=C(Cl)C=C1 44754 [0,2,0,0,0,0|2,0,0]=4 1802 B11R1.19 CC1=CC=C(C(C)(C)C)C=C1 36092 [0,2,0,0,0,0|2,0,0]=4 1803 B11R1.19 CC1=CC=C(C(F)(F)F)C=C1 1659 [0,2,0,0,0,0|2,0,0]=4 1804 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 11532 [0,2,0,0,0,0|2,0,0]=4 1805 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 11533 [0,2,0,0,0,0|2,0,0]=4 1806 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 12609 [0,2,0,0,0,0|2,0,0]=4 1807 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 16860 [0,2,0,0,0,0|2,0,0]=4 1808 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 16861 [0,2,0,0,0,0|2,0,0]=4 1809 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 17362 [0,2,0,0,0,0|2,0,0]=4 1810 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 19403 [0,2,0,0,0,0|2,0,0]=4 1811 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 22148 [0,2,0,0,0,0|2,0,0]=4 1812 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 22657 [0,2,0,0,0,0|2,0,0]=4 1813 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 26313 [0,2,0,0,0,0|2,0,0]=4 1814 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 10832 [0,2,0,0,0,0|1,0,1]=4 1815 B11R1.19 ClC1=CC=C(C(Cl)(Cl)Cl)C=C1 22049 [0,2,0,0,0,0|2,0,0]=4 1816 B11R1.19 FC(F)(F)C1=CC=C(Br)C=C1 11717 [0,2,0,0,0,0|2,0,0]=4 1817 B11R1.19 FC(F)(F)C1=CC=C(Br)C=C1 1635 [0,2,0,0,0,0|2,0,0]=4 1818 B11R1.19 FC(F)(F)C1=CC=C(Cl)C=C1 5435 [0,2,0,0,0,0|2,0,0]=4 1819 B11R1.19 FC(F)(F)C1=CC=C(I)C=C1 3563 [0,2,0,0,0,0|2,0,0]=4 1820 B11R1.19 FC(F)(F)C1=CC=C(S)C=C1 6864 [0,2,0,0,0,0|1,1,0]=4 1821 B11R1.19 FC1=CC=C(C(F)(F)F)C=C1 5437 [0,2,0,0,0,0|2,0,0]=4 1822 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 2815 [0,2,0,0,0,0|2,0,0]=4 1823 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 2816 [0,2,0,0,0,0|2,0,0]=4 1824 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 20323 [0,2,0,0,0,0|2,0,0]=4 1825 B11R1.19 NS(=O)(=O)C1=CC=C(O)C=C1 12595 [0,2,0,0,0,0|1,0,1]=4 1826 B11R1.19 O=S(=O)(O)C1=CC=C(O)N=C1 11085 [0,2,0,0,0,0|2,0,0]=4 1827 B11R1.19 OC1=CC=C(C(F)(F)F)C=C1 4011 [0,2,0,0,0,0|1,0,0]=3 1828 B11R1.19 OC1=CC=C(C(F)(F)F)N=C1 11257 [0,2,0,0,0,0|2,0,0]=4 1829 B11R1.19 OC1=CN=C(C(F)(F)F)C=C1 21818 [0,2,0,0,0,0|2,0,0]=4 1830 B11R1.19 OC1=NC=C(C(F)(F)F)C=C1 17576 [0,2,0,0,0,0|2,0,0]=4 1831 B11R1.19 OC1=NC=C(C(F)(F)F)C=C1 2402 [0,2,0,0,0,0|2,0,0]=4 1832 B11R1.21 CC(=O)C1=CC(C)=C(O)C=C1 15346 [0,2,0,0,0,0|0,0,2]=4 1833 B11R1.21 CC(=O)C1=CC(Cl)=C(O)C=C1 29271 [0,2,0,0,0,0|0,0,2]=4 1834 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 3492 [0,2,0,0,0,0|0,0,2]=4 1835 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 3384 [0,2,0,0,0,0|0,0,2]=4 1836 B11R1.21 CC(C)C1=CC(Br)=C(N)C=C1 17446 [0,2,0,0,0,0|2,0,0]=4 1837 B11R1.21 CC(C)C1=CC(O)=C(I)C=C1 34596 [0,2,0,0,0,0|2,0,0]=4 1838 B11R1.21 CC(C)C1=CC=C(O)C(O)=C1 26367 [0,2,0,0,0,0|1,0,0]=3 1839 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 3806 [0,2,0,0,0,0|1,0,1]=4 1840 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=C1 3807 [0,2,0,0,0,0|1,0,1]=4 1841 B11R1.21 CC1=C(C)C=C(B(O)O)C=C1 1832 [0,2,0,0,0,0|2,0,0]=4 1842 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 14893 [0,2,0,0,0,0|1,0,1]=4 1843 B11R1.21 CC1=C(Cl)C=C(B(O)O)C=C1 5132 [0,2,0,0,0,0|2,0,0]=4 1844 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 4569 [0,2,0,0,0,0|1,0,1]=4 1845 B11R1.21 CC1=C(Cl)C=CC(B(O)O)=C1 29622 [0,2,0,0,0,0|2,0,0]=4 1846 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 3666 [0,2,0,0,0,0|1,0,1]=4 1847 B11R1.21 CC1=C(F)C=C(B(O)O)C=C1 5124 [0,2,0,0,0,0|2,0,0]=4 1848 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 1330 [0,2,0,0,0,0|1,0,1]=4 1849 B11R1.21 CC1=C(F)C=CC(B(O)O)=C1 5146 [0,2,0,0,0,0|2,0,0]=4 1850 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 1397 [0,2,0,0,0,0|1,0,1]=4 1851 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 3947 [0,2,0,0,0,0|1,0,1]=4 1852 B11R1.21 CC1=C(I)C=CC(C(=O)O)=C1 3948 [0,2,0,0,0,0|1,0,1]=4 1853 B11R1.21 CC1=C(N)C=C(B(O)O)C=C1 1745 [0,2,0,0,0,0|2,0,0]=4 1854 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 8194 [0,2,0,0,0,0|1,0,1]=4 1855 B11R1.21 CC1=C(N)C=C(C(C)C)C=C1 25919 [0,2,0,0,0,0|2,0,0]=4 1856 B11R1.21 CC1=C(N)C=C(C(C)C)C=C1 28331 [0,2,0,0,0,0|2,0,0]=4 1857 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 2067 [0,2,0,0,0,0|1,0,1]=4 1858 B11R1.21 CC1=C(O)C=C(B(O)O)C=C1 33878 [0,2,0,0,0,0|2,0,0]=4 1859 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 3890 [0,2,0,0,0,0|1,0,1]=4 1860 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 10329 [0,2,0,0,0,0|2,0,0]=4 1861 B11R1.21 CC1=C(O)C=CC(B(O)O)=C1 32616 [0,2,0,0,0,0|1,0,0]=3 1862 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 20044 [0,2,0,0,0,0|0,0,1]=3 1863 B11R1.21 CC1=C(O)C=CC([N+](=O)[O-])=C1 17549 [0,2,0,0,0,0|1,0,1]=4 1864 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 3130 [0,2,0,0,0,0|1,0,1]=4 1865 B11R1.21 NC1=C(Cl)C=CC(B(O)O)=C1 1735 [0,2,0,0,0,0|2,0,0]=4 1866 B11R1.21 NC1=C(Cl)C=CC(B(O)O)=C1 29645 [0,2,0,0,0,0|2,0,0]=4 1867 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 8988 [0,2,0,0,0,0|1,0,1]=4 1868 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 3524 [0,2,0,0,0,0|1,0,1]=4 1869 B11R1.21 NC1=C(F)C=CC(B(O)O)=C1 1743 [0,2,0,0,0,0|2,0,0]=4 1870 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 4690 [0,2,0,0,0,0|1,0,1]=4 1871 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 14046 [0,2,0,0,0,0|1,0,1]=4 1872 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 29055 [0,2,0,0,0,0|1,0,1]=4 1873 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 14418 [0,2,0,0,0,0|1,0,1]=4 1874 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 20504 [0,2,0,0,0,0|0,0,1]=3 1875 B11R1.21 NC1=C(O)C=CC([N+](=O)[O-])=C1 14489 [0,2,0,0,0,0|1,0,1]=4 1876 B11R1.21 Nc1ccc(C(=O)O)cc1Cl 4652 [0,2,0,0,0,0|1,0,1]=4 1877 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 28612 [0,2,0,0,0,0|1,0,1]=4 1878 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 3585 [0,2,0,0,0,0|1,0,1]=4 1879 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 1320 [0,2,0,0,0,0|1,0,1]=4 1880 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 25903 [0,2,0,0,0,0|1,0,1]=4 1881 B11R1.21 O=C(O)C1=CC(Br)=C(O)N=C1 9825 [0,2,0,0,0,0|1,0,1]=4 1882 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 24806 [0,2,0,0,0,0|1,0,1]=4 1883 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 3686 [0,2,0,0,0,0|1,0,1]=4 1884 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 1334 [0,2,0,0,0,0|1,0,1]=4 1885 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 13038 [0,2,0,0,0,0|0,0,1]=3 1886 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 1316 [0,2,0,0,0,0|1,0,1]=4 1887 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 1333 [0,2,0,0,0,0|1,0,1]=4 1888 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 1337 [0,2,0,0,0,0|1,0,1]=4 1889 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 29708 [0,2,0,0,0,0|1,0,1]=4 1890 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 1388 [0,2,0,0,0,0|1,0,1]=4 1891 B11R1.21 O=C(O)C1=CC(F)=C(O)C=C1 2271 [0,2,0,0,0,0|0,0,1]=3 1892 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 28092 [0,2,0,0,0,0|1,0,1]=4 1893 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 12500 [0,2,0,0,0,0|1,0,1]=4 1894 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 1390 [0,2,0,0,0,0|1,0,1]=4 1895 B11R1.21 O=C(O)C1=CC(I)=C(I)C=C1 28093 [0,2,0,0,0,0|1,0,1]=4 1896 B11R1.21 O=C(O)C1=CC(I)=C(O)C=C1 32382 [0,2,0,0,0,0|0,0,1]=3 1897 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 17671 [0,2,0,0,0,0|1,0,1]=4 1898 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 14051 [0,2,0,0,0,0|1,0,1]=4 1899 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 3494 [0,2,0,0,0,0|1,0,1]=4 1900 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 28669 [0,2,0,0,0,0|1,0,1]=4 1901 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 9738 [0,2,0,0,0,0|0,0,1]=3 1902 B11R1.21 O=C(O)C1=CN=C(O)C(Cl)=C1 10618 [0,2,0,0,0,0|1,0,1]=4 1903 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(O)C=C1 18622 [0,2,0,0,0,0|1,0,1]=4 1904 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(O)C=C1 18908 [0,2,0,0,0,0|1,0,1]=4 1905 B11R1.21 O=[N+]([O-])C1=CC(F)=C(O)C=C1 4122 [0,2,0,0,0,0|1,0,1]=4 1906 B11R1.21 O=[N+]([O-])C1=CC(O)=C(O)C=C1 22910 [0,2,0,0,0,0|1,0,1]=4 1907 B11R1.21 OB(O)C1=CC(Cl)=C(Cl)C=C1 1812 [0,2,0,0,0,0|2,0,0]=4 1908 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 1780 [0,2,0,0,0,0|2,0,0]=4 1909 B11R1.21 OB(O)C1=CC(Cl)=C(O)C=C1 29592 [0,2,0,0,0,0|1,0,0]=3 1910 B11R1.21 OB(O)C1=CC(F)=C(Br)C=C1 7779 [0,2,0,0,0,0|2,0,0]=4 1911 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 1776 [0,2,0,0,0,0|2,0,0]=4 1912 B11R1.21 OB(O)C1=CC(F)=C(F)C=C1 1821 [0,2,0,0,0,0|2,0,0]=4 1913 B11R1.21 OB(O)C1=CC(F)=C(O)C=C1 18807 [0,2,0,0,0,0|1,0,0]=3 1914 B11R1.21 OB(O)C1=CC(O)=C(Cl)C=C1 27874 [0,2,0,0,0,0|2,0,0]=4 1915 B11R1.21 OB(O)C1=CC(O)=C(F)C=C1 32617 [0,2,0,0,0,0|2,0,0]=4 1916 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 29261 [0,2,0,0,0,0|0,0,2]=4 1917 B11R1.166 CC(=O)C1=C(C)C=C(O)C=C1 24792 [0,2,0,0,0,0|0,0,2]=4 1918 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 28238 [0,2,0,0,0,0|0,0,2]=4 1919 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 29270 [0,2,0,0,0,0|0,0,2]=4 1920 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 24419 [0,2,0,0,0,0|0,0,2]=4 1921 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 3375 [0,2,0,0,0,0|0,0,2]=4 1922 B11R1.166 CC(C)C1=C(O)C=C(O)C=C1 35906 [0,2,0,0,0,0|1,0,0]=3 1923 B11R1.166 CC1=C(B(O)O)C=CC(Cl)=C1 29614 [0,2,0,0,0,0|2,0,0]=4 1924 B11R1.166 CC1=C(B(O)O)C=CC(F)=C1 1852 [0,2,0,0,0,0|2,0,0]=4 1925 B11R1.166 CC1=C(B(O)O)C=CC(O)=C1 29621 [0,2,0,0,0,0|1,0,0]=3 1926 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 4029 [0,2,0,0,0,0|1,0,1]=4 1927 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 4570 [0,2,0,0,0,0|1,0,1]=4 1928 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 1327 [0,2,0,0,0,0|1,0,1]=4 1929 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 10924 [0,2,0,0,0,0|1,0,1]=4 1930 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 4719 [0,2,0,0,0,0|1,0,1]=4 1931 B11R1.166 CC1=CC(C)=C(B(O)O)C=C1 9565 [0,2,0,0,0,0|2,0,0]=4 1932 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 15441 [0,2,0,0,0,0|1,0,1]=4 1933 B11R1.166 CC1=CC(C)=C(C(F)F)C=C1 28468 [0,2,0,0,0,0|2,0,0]=4 1934 B11R1.166 CC1=CC(Cl)=C(B(O)O)C=C1 1778 [0,2,0,0,0,0|2,0,0]=4 1935 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 4567 [0,2,0,0,0,0|1,0,1]=4 1936 B11R1.166 CC1=CC(F)=C(B(O)O)C=C1 23775 [0,2,0,0,0,0|2,0,0]=4 1937 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 1395 [0,2,0,0,0,0|1,0,1]=4 1938 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 30572 [0,2,0,0,0,0|1,0,1]=4 1939 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 4952 [0,2,0,0,0,0|1,0,1]=4 1940 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 32852 [0,2,0,0,0,0|2,0,0]=4 1941 B11R1.166 CC1=CC(O)=CC=C1[N+](=O)[O-] 21648 [0,2,0,0,0,0|1,0,1]=4 1942 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 18270 [0,2,0,0,0,0|1,0,1]=4 1943 B11R1.166 C[C@H](O)C1=C(Cl)C=C(F)C=C1 15575 [0,2,0,0,0,0|1,0,0]=3 1944 B11R1.166 Clc1ccc(C(Cl)Cl)c(Cl)c1 31174 [0,2,0,0,0,0|2,0,0]=4 1945 B11R1.166 NC(=O)C1=C(Cl)C=C(O)C=C1 31609 [0,2,0,0,0,0|0,0,2]=4 1946 B11R1.166 NC1=C(B(O)O)C=CC(Cl)=C1 20178 [0,2,0,0,0,0|2,0,0]=4 1947 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 13462 [0,2,0,0,0,0|1,0,1]=4 1948 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 11211 [0,2,0,0,0,0|1,0,1]=4 1949 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 1323 [0,2,0,0,0,0|1,0,1]=4 1950 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 22552 [0,2,0,0,0,0|1,0,1]=4 1951 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 3109 [0,2,0,0,0,0|1,0,1]=4 1952 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 4693 [0,2,0,0,0,0|1,0,1]=4 1953 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 23542 [0,2,0,0,0,0|1,0,1]=4 1954 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 3856 [0,2,0,0,0,0|1,0,1]=4 1955 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 4028 [0,2,0,0,0,0|1,0,1]=4 1956 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 1314 [0,2,0,0,0,0|1,0,1]=4 1957 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 3586 [0,2,0,0,0,0|1,0,1]=4 1958 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 21313 [0,2,0,0,0,0|1,0,1]=4 1959 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 1370 [0,2,0,0,0,0|1,0,1]=4 1960 B11R1.166 O=C(O)C1=C(Cl)C=C(I)C=C1 10153 [0,2,0,0,0,0|1,0,1]=4 1961 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 4561 [0,2,0,0,0,0|0,0,1]=3 1962 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 1313 [0,2,0,0,0,0|1,0,1]=4 1963 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 1374 [0,2,0,0,0,0|1,0,1]=4 1964 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 1336 [0,2,0,0,0,0|1,0,1]=4 1965 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 1384 [0,2,0,0,0,0|1,0,1]=4 1966 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 2608 [0,2,0,0,0,0|0,0,1]=3 1967 B11R1.166 O=C(O)C1=C(I)C=C(Br)C=C1 13466 [0,2,0,0,0,0|1,0,1]=4 1968 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 4018 [0,2,0,0,0,0|1,0,1]=4 1969 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 1389 [0,2,0,0,0,0|1,0,1]=4 1970 B11R1.166 O=C(O)C1=C(I)C=C(O)C=C1 27646 [0,2,0,0,0,0|0,0,1]=3 1971 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 4010 [0,2,0,0,0,0|1,0,1]=4 1972 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 3845 [0,2,0,0,0,0|1,0,1]=4 1973 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 3493 [0,2,0,0,0,0|1,0,1]=4 1974 B11R1.166 O=C(O)C1=C(O)C=C(I)C=C1 3888 [0,2,0,0,0,0|1,0,1]=4 1975 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(O)C=C1 33263 [0,2,0,0,0,0|1,0,1]=4 1976 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(O)C=C1 28366 [0,2,0,0,0,0|1,0,1]=4 1977 B11R1.166 O=[N+]([O-])C1=C(F)C=C(O)C=C1 2101 [0,2,0,0,0,0|1,0,1]=4 1978 B11R1.166 O=[N+]([O-])C1=C(O)C=C(O)C=C1 27732 [0,2,0,0,0,0|1,0,1]=4 1979 B11R1.166 OB(O)C1=C(Cl)C=C(Cl)C=C1 1806 [0,2,0,0,0,0|2,0,0]=4 1980 B11R1.166 OB(O)C1=C(Cl)C=C(F)C=C1 5050 [0,2,0,0,0,0|2,0,0]=4 1981 B11R1.166 OB(O)C1=C(Cl)C=C(O)C=C1 25620 [0,2,0,0,0,0|1,0,0]=3 1982 B11R1.166 OB(O)C1=C(F)C=C(Br)C=C1 7778 [0,2,0,0,0,0|2,0,0]=4 1983 B11R1.166 OB(O)C1=C(F)C=C(Cl)C=C1 5034 [0,2,0,0,0,0|2,0,0]=4 1984 B11R1.166 OB(O)C1=C(F)C=C(F)C=C1 1815 [0,2,0,0,0,0|2,0,0]=4 1985 B11R1.166 OB(O)C1=C(F)C=C(I)C=C1 7885 [0,2,0,0,0,0|2,0,0]=4 1986 B11R1.166 OB(O)C1=C(F)C=C(O)C=C1 32854 [0,2,0,0,0,0|1,0,0]=3 1987 B11R1.166 OB(O)C1=C(O)C=C(Cl)C=C1 33194 [0,2,0,0,0,0|2,0,0]=4 1988 B11R1.166 OB(O)C1=C(O)C=C(F)C=C1 32850 [0,2,0,0,0,0|2,0,0]=4 1989 B11R1.37 BrCc1ccc(Br)cc1CBr 31349 [0,2,0,0,0,0|2,0,0]=4 1990 B11R1.37 C#CC1=C(OC)C=C(O)C=C1 45209 [0,2,0,0,0,0|1,0,1]=4 1991 B11R1.37 CCC1=C(C=O)C=C(Br)C=C1 30974 [0,2,0,0,0,0|2,0,0]=4 1992 B11R1.37 CCC1=C(C=O)C=CC(O)=C1 28097 [0,2,0,0,0,0|0,0,2]=4 1993 B11R1.37 COC1=C(C#N)C=CC(O)=C1 27703 [0,2,0,0,0,0|1,0,1]=4 1994 B11R1.37 COC1=C(C=O)C=CC(O)=C1 8130 [0,2,0,0,0,0|0,0,2]=4 1995 B11R1.37 COC1=C(CBr)C=CC(Br)=C1 31309 [0,2,0,0,0,0|2,0,0]=4 1996 B11R1.37 COC1=C(CBr)C=CC(F)=C1 31307 [0,2,0,0,0,0|2,0,0]=4 1997 B11R1.37 COC1=C(CN)C=CC(F)=C1 31244 [0,2,0,0,0,0|2,0,0]=4 1998 B11R1.37 COC1=C(CO)C=CC(F)=C1 31306 [0,2,0,0,0,0|1,0,0]=3 1999 B11R1.37 COC1=C(OC)C=C(O)C=C1 4113 [0,2,0,0,0,0|2,0,0]=4 2000 B11R1.37 N#CC1=C(CBr)C=CC(F)=C1 31271 [0,2,0,0,0,0|2,0,0]=4 2001 B11R1.37 N#CC1=CC=C(O)C=C1C#N 20526 [0,2,0,0,0,0|1,0,1]=4 2002 B11R1.37 OCC1=CC=C(F)C=C1CO 2198 [0,2,0,0,0,0|1,0,0]=3 2003 B11R1.277 CC1=CC(C=O)=C(C)C=C1O 22697 [0,2,0,0,0,0|0,0,2]=4 2004 B11R1.277 Cc1cc(C#N)c(C)cc1O 30763 [0,2,0,0,0,0|1,0,1]=4 2005 B11R1.277 FC1=CC(Br)=C(CBr)C=C1F 31330 [0,2,0,0,0,0|2,0,0]=4 2006 B11R1.277 FC1=CC(CBr)=C(F)C=C1Cl 27443 [0,2,0,0,0,0|2,0,0]=4 2007 B11R1.277 FC1=CC(F)=C(CBr)C=C1F 3026 [0,2,0,0,0,0|2,0,0]=4 2008 B11R1.277 Fc1cc(F)c(CCl)cc1F 4024 [0,2,0,0,0,0|2,0,0]=4 2009 B11R1.277 N#CC1=C(Br)C=C(O)C(Br)=C1 30812 [0,2,0,0,0,0|1,0,1]=4 2010 B11R1.277 NCC1=C(F)C=C(F)C(Cl)=C1 4368 [0,2,0,0,0,0|2,0,0]=4 2011 B11R1.277 NCC1=C(F)C=C(F)C(F)=C1 27541 [0,2,0,0,0,0|2,0,0]=4 2012 B11R1.277 O=CC1=C(F)C=C(O)C(Cl)=C1 30956 [0,2,0,0,0,0|0,0,2]=4 2013 B11R1.277 O=CC1=C(F)C=C(O)C(F)=C1 27695 [0,2,0,0,0,0|0,0,2]=4 2014 B11R1.277 O=CC1=C(O)C=C(O)C(I)=C1 22927 [0,2,0,0,0,0|0,0,2]=4 2015 B11R1.277 OCC1=C(Br)C=C(F)C(F)=C1 31329 [0,2,0,0,0,0|1,0,0]=3 2016 B11R1.277 OCC1=C(Cl)C=C(Br)C(F)=C1 31323 [0,2,0,0,0,0|1,0,0]=3 2017 B11R1.277 OCC1=C(Cl)C=C(O)C(Cl)=N1 26865 [0,2,0,0,0,0|1,0,0]=3 2018 B11R1.277 OCC1=C(F)C=C(F)C(F)=C1 4664 [0,2,0,0,0,0|1,0,0]=3 2019 B11R1.278 CC1=C(O)C=CC(C=O)=C1O 25581 [0,2,0,0,0,0|0,0,2]=4 2020 B11R1.278 FC1=C(Br)C=CC(CBr)=C1F 31368 [0,2,0,0,0,0|2,0,0]=4 2021 B11R1.278 FC1=C(Br)C=CC(CCl)=C1F 31369 [0,2,0,0,0,0|2,0,0]=4 2022 B11R1.278 FC1=C(Cl)C=CC(CBr)=C1F 31372 [0,2,0,0,0,0|2,0,0]=4 2023 B11R1.278 FC1=C(Cl)C=CC(CCl)=C1F 31373 [0,2,0,0,0,0|2,0,0]=4 2024 B11R1.278 FC1=C(F)C(Br)=C(CBr)C=C1 31353 [0,2,0,0,0,0|2,0,0]=4 2025 B11R1.278 FC1=C(F)C(Br)=C(CCl)C=C1 31354 [0,2,0,0,0,0|2,0,0]=4 2026 B11R1.278 FC1=C(F)C(Cl)=C(CBr)C=C1 31360 [0,2,0,0,0,0|2,0,0]=4 2027 B11R1.278 FC1=C(F)C(Cl)=C(CCl)C=C1 31361 [0,2,0,0,0,0|2,0,0]=4 2028 B11R1.278 FC1=C(F)C(F)=C(CBr)C=C1 4662 [0,2,0,0,0,0|2,0,0]=4 2029 B11R1.278 N#CC1=C(F)C(F)=C(O)C=C1 2222 [0,2,0,0,0,0|1,0,1]=4 2030 B11R1.278 NCC1=C(F)C(F)=C(F)C=C1 10200 [0,2,0,0,0,0|2,0,0]=4 2031 B11R1.278 O=CC1=C(F)C(F)=C(O)C=C1 10121 [0,2,0,0,0,0|0,0,2]=4 2032 B11R1.278 O=CC1=C(O)C(I)=C(O)C=C1 22928 [0,2,0,0,0,0|0,0,2]=4 2033 B11R1.278 O=CC1=C(O)C(O)=C(O)C=C1 8260 [0,2,0,0,0,0|0,0,2]=4 2034 B11R1.278 OCC1=C(Br)C(F)=C(F)C=C1 31355 [0,2,0,0,0,0|1,0,0]=3 2035 B11R1.278 OCC1=C(Cl)C(F)=C(F)C=C1 31359 [0,2,0,0,0,0|1,0,0]=3 2036 B11R1.278 OCC1=C(F)C(F)=C(Cl)C=C1 31371 [0,2,0,0,0,0|1,0,0]=3 2037 B11R1.278 OCC1=C(F)C(F)=C(F)C=C1 8282 [0,2,0,0,0,0|1,0,0]=3 2038 B11R1.278 OCc1ccc(Br)c(F)c1F 31370 [0,2,0,0,0,0|1,0,0]=3 2039 B11R1.464 CC1=CC(Br)=CC(C)=C1CO 24281 [0,2,0,0,0,0|1,0,0]=3 2040 B11R1.464 CC1=CC(C)=C(CBr)C(C)=C1 22050 [0,2,0,0,0,0|2,0,0]=4 2041 B11R1.464 CC1=CC(C)=C(CCl)C(C)=C1 7456 [0,2,0,0,0,0|2,0,0]=4 2042 B11R1.464 CC1=CC(C)=C(CN)C(C)=C1 7408 [0,2,0,0,0,0|2,0,0]=4 2043 B11R1.464 CC1=CC(C)=C(CO)C(C)=C1 7455 [0,2,0,0,0,0|1,0,0]=3 2044 B11R1.464 CC1=CC(F)=CC(Br)=C1CO 31318 [0,2,0,0,0,0|1,0,0]=3 2045 B11R1.464 CC1=CC(O)=CC(C)=C1C#N 30818 [0,2,0,0,0,0|1,0,1]=4 2046 B11R1.464 CC1=CC(O)=CC(C)=C1C=O 3148 [0,2,0,0,0,0|0,0,2]=4 2047 B11R1.464 FC1=CC(Br)=CC(F)=C1CBr 13032 [0,2,0,0,0,0|2,0,0]=4 2048 B11R1.464 FC1=CC(F)=C(CBr)C(F)=C1 4668 [0,2,0,0,0,0|2,0,0]=4 2049 B11R1.464 N#CC1=C(F)C=C(O)C=C1F 5196 [0,2,0,0,0,0|1,0,1]=4 2050 B11R1.464 NCC1=C(F)C=C(F)C=C1F 16416 [0,2,0,0,0,0|2,0,0]=4 2051 B11R1.464 O=CC1=C(Cl)C=C(O)C=C1Cl 28408 [0,2,0,0,0,0|0,0,2]=4 2052 B11R1.464 O=CC1=C(F)C=C(O)C=C1F 30883 [0,2,0,0,0,0|0,0,2]=4 2053 B11R1.464 O=CC1=C(O)C=C(O)C=C1O 21790 [0,2,0,0,0,0|0,0,2]=4 2054 B11R1.464 OCC1=C(Cl)C=C(Br)C=C1Cl 31297 [0,2,0,0,0,0|1,0,0]=3 2055 B11R1.464 OCC1=C(Cl)C=C(Cl)C=C1Cl 31263 [0,2,0,0,0,0|1,0,0]=3 2056 B11R1.464 OCC1=C(F)C=C(Br)C=C1F 4882 [0,2,0,0,0,0|1,0,0]=3 2057 B11R1.464 OCC1=C(F)C=C(F)C=C1F 28815 [0,2,0,0,0,0|1,0,0]=3 2058 B11R1.14 CC1=CC(C#N)=CC(C)=C1O 11065 [0,2,0,0,0,0|1,0,1]=4 2059 B11R1.14 CC1=CC(C=O)=CC(C)=C1O 8252 [0,2,0,0,0,0|0,0,2]=4 2060 B11R1.14 CC1=CC(CO)=CC(C)=C1Br 28797 [0,2,0,0,0,0|1,0,0]=3 2061 B11R1.14 COC1=CC(F)=C(O)C(F)=C1 33445 [0,2,0,0,0,0|2,0,0]=4 2062 B11R1.14 COC1=CC(N)=C(O)C(Br)=C1 11030 [0,2,0,0,0,0|2,0,0]=4 2063 B11R1.14 FC1=CC(CBr)=CC(F)=C1F 4670 [0,2,0,0,0,0|2,0,0]=4 2064 B11R1.14 N#CC1=CC(Br)=C(O)C(Br)=C1 18552 [0,2,0,0,0,0|1,0,1]=4 2065 B11R1.14 N#CC1=CC(F)=C(O)C(F)=C1 23504 [0,2,0,0,0,0|1,0,1]=4 2066 B11R1.14 N#CC1=CC(F)=C(O)C(F)=C1 30805 [0,2,0,0,0,0|1,0,1]=4 2067 B11R1.14 NCC1=CC(F)=C(F)C(F)=C1 7403 [0,2,0,0,0,0|2,0,0]=4 2068 B11R1.14 O=CC1=CC(Br)=C(O)C(F)=C1 30897 [0,2,0,0,0,0|0,0,2]=4 2069 B11R1.14 O=CC1=CC(Br)=C(O)C(O)=C1 27759 [0,2,0,0,0,0|0,0,2]=4 2070 B11R1.14 O=CC1=CC(F)=C(O)C(F)=C1 17015 [0,2,0,0,0,0|0,0,2]=4 2071 B11R1.14 O=CC1=CC(I)=C(O)C(I)=C1 28413 [0,2,0,0,0,0|0,0,2]=4 2072 B11R1.14 O=CC1=CC(O)=C(O)C(O)=C1 21300 [0,2,0,0,0,0|0,0,2]=4 2073 B11R1.14 O=CC1=CC(O)=C(O)C(O)=C1 8268 [0,2,0,0,0,0|0,0,2]=4 2074 B11R1.280 CCC1=C(O)C=CC(C=O)=C1 28101 [0,2,0,0,0,0|0,0,2]=4 2075 B11R1.280 CCC1=CC(OC)=C(Cl)C=C1 5280 [0,2,0,0,0,0|2,0,0]=4 2076 B11R1.280 COC1=C(Br)C=CC(CO)=C1 31324 [0,2,0,0,0,0|1,0,0]=3 2077 B11R1.280 COC1=C(F)C=CC(CBr)=C1 27471 [0,2,0,0,0,0|2,0,0]=4 2078 B11R1.280 COC1=C(F)C=CC(CN)=C1 27537 [0,2,0,0,0,0|2,0,0]=4 2079 B11R1.280 COC1=C(F)C=CC(CO)=C1 7734 [0,2,0,0,0,0|1,0,0]=3 2080 B11R1.280 COC1=C(O)C=CC(C#N)=C1 13112 [0,2,0,0,0,0|1,0,1]=4 2081 B11R1.280 COC1=C(O)C=CC(C=O)=C1 25440 [0,2,0,0,0,0|0,0,2]=4 2082 B11R1.280 COC1=C(O)C=CC(CN)=C1 7385 [0,2,0,0,0,0|1,0,0]=3 2083 B11R1.280 COC1=CC(C#N)=C(O)C=C1 30775 [0,2,0,0,0,0|2,0,0]=4 2084 B11R1.280 COC1=CC(C=O)=C(O)C=C1 2649 [0,2,0,0,0,0|2,0,0]=4 2085 B11R1.280 N#CC1=C(F)C=CC(CBr)=C1 31280 [0,2,0,0,0,0|2,0,0]=4 2086 B11R1.280 N#CC1=C(F)C=CC(CN)=C1 17581 [0,2,0,0,0,0|2,0,0]=4 2087 B11R1.280 N#CC1=C(F)C=CC(CO)=C1 31332 [0,2,0,0,0,0|1,0,0]=3 2088 B11R1.280 N#CC1=CC(C#N)=C(O)C=C1 27702 [0,2,0,0,0,0|1,0,1]=4 2089 B11R1.280 N#CC1=CC(C=O)=C(O)C=C1 17451 [0,2,0,0,0,0|1,0,1]=4 2090 B11R1.280 N#Cc1cc(CBr)ccc1Br 31390 [0,2,0,0,0,0|2,0,0]=4 2091 B9R1.3 CC1=C(O)C=CC=C1O 15385 [0,0,1,1,0,0|0,0,2]=4 2092 B9R1.3 NC1=C(O)C=CC=C1O 19659 [0,0,1,1,0,0|1,0,1]=4 2093 B9R1.3 OC1=CC=CC(O)=C1Br 34182 [0,0,1,1,0,0|1,0,1]=4 2094 B9R1.3 OC1=CC=CC(O)=C1Cl 28103 [0,0,1,1,0,0|1,0,1]=4 2095 B9R1.3 OC1=CC=CC(O)=C1F 4141 [0,0,1,1,0,0|1,0,1]=4 2096 B9R1.3 OC1=CC=CC(O)=C1I 34463 [0,0,1,1,0,0|1,0,1]=4 2097 B9R2.50 C1=CC=C2CCC2=C1 18889 [1,0,0,1,0,0|1,0,0]=3 2098 B11R2.34 BrC1=CC=C([C@@H]2CO2)C=C1 5705 [0,1,0,1,0,0|1,0,0]=3 2099 B11R2.34 BrC1=CC=C([C@H]2CO2)C=C1 5704 [0,1,0,1,0,0|1,0,0]=3 2100 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 18166 [0,1,0,1,0,0|1,0,0]=3 2101 B11R2.34 FC1=CC=C([C@H]2CO2)C=C1 18172 [0,1,0,1,0,0|1,0,0]=3 2102 B11R2.34 NC1=CC=C(C2CC2)C=C1 19700 [0,1,0,1,0,0|2,0,0]=4 2103 B11R2.34 OC1=CC=C(C2CC2)C=C1 17543 [0,1,0,1,0,0|1,0,0]=3 2104 B11R2.36 BrC1=CC2=C(C=C1)CCO2 28031 [0,1,0,1,0,0|1,0,0]=3 2105 B11R2.36 BrC1=CC2=C(C=C1)N=CO2 34235 [0,1,0,1,0,0|1,0,1]=4 2106 B11R2.36 BrC1=CC2=C(C=C1)OCC2 7055 [0,1,0,1,0,0|2,0,0]=4 2107 B11R2.36 BrC1=CC2=C(C=C1)OCO2 3738 [0,1,0,1,0,0|1,0,0]=3 2108 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 28003 [0,1,0,1,0,0|1,0,1]=4 2109 B11R2.36 BrC1=CC2=NON=C2C=C1 15922 [0,1,0,1,0,0|2,0,0]=4 2110 B11R2.36 BrC1=CC=C2CCCC2=C1 34435 [0,1,0,1,0,0|2,0,0]=4 2111 B11R2.36 BrC1=CC=C2CCNC2=C1 22223 [0,1,0,1,0,0|2,0,0]=4 2112 B11R2.36 BrC1=CC=C2CCNC2=C1 8320 [0,1,0,1,0,0|2,0,0]=4 2113 B11R2.36 BrC1=CC=C2CNCC2=C1 12928 [0,1,0,1,0,0|2,0,0]=4 2114 B11R2.36 BrC1=CC=C2CNCC2=C1 18079 [0,1,0,1,0,0|2,0,0]=4 2115 B11R2.36 BrC1=CC=C2NCCC2=C1 7319 [0,1,0,1,0,0|2,0,0]=4 2116 B11R2.36 CC1=CC2=NON=C2C=C1 14814 [0,1,0,1,0,0|2,0,0]=4 2117 B11R2.36 CC1=CC=C2CNCC2=C1 33793 [0,1,0,1,0,0|2,0,0]=4 2118 B11R2.36 ClC1=CC2=C(C=C1)OCO2 3620 [0,1,0,1,0,0|1,0,0]=3 2119 B11R2.36 ClC1=CC2=C(C=CO2)C=C1 32456 [0,1,0,1,0,0|1,0,1]=4 2120 B11R2.36 ClC1=CC=C2CNCC2=C1 18083 [0,1,0,1,0,0|2,0,0]=4 2121 B11R2.36 ClC1=CC=C2CNCC2=C1 18084 [0,1,0,1,0,0|2,0,0]=4 2122 B11R2.36 ClC1=CC=C2NCCC2=C1 2112 [0,1,0,1,0,0|2,0,0]=4 2123 B11R2.36 FC1=CC2=C(C=C1)OCC2 24189 [0,1,0,1,0,0|2,0,0]=4 2124 B11R2.36 FC1=CC=C2CCNC2=C1 34355 [0,1,0,1,0,0|2,0,0]=4 2125 B11R2.36 FC1=CC=C2CNCC2=C1 18062 [0,1,0,1,0,0|2,0,0]=4 2126 B11R2.36 IC1=CC2=C(C=C1)OCC2 27760 [0,1,0,1,0,0|2,0,0]=4 2127 B11R2.36 IC1=CC2=C(C=C1)OCO2 33795 [0,1,0,1,0,0|1,0,0]=3 2128 B11R2.36 NC1=CC2=C(C=C1)C=NO2 24258 [0,1,0,1,0,0|1,0,1]=4 2129 B11R2.36 NC1=CC2=C(C=C1)N=CO2 17704 [0,1,0,1,0,0|1,0,1]=4 2130 B11R2.36 NC1=CC2=C(C=C1)OCC2 16462 [0,1,0,1,0,0|2,0,0]=4 2131 B11R2.36 NC1=CC2=C(C=C1)OCC2 20541 [0,1,0,1,0,0|2,0,0]=4 2132 B11R2.36 NC1=CC2=C(C=C1)OCO2 22150 [0,1,0,1,0,0|1,0,0]=3 2133 B11R2.36 NC1=CC=C2CNCC2=C1 18060 [0,1,0,1,0,0|2,0,0]=4 2134 B11R2.36 NC1=CC=C2CNCC2=C1 26253 [0,1,0,1,0,0|2,0,0]=4 2135 B11R2.36 OC1=CC2=C(C=C1)CCO2 32303 [0,1,0,1,0,0|0,0,0]=2 2136 B11R2.36 OC1=CC2=C(C=C1)OC=C2 34267 [0,1,0,1,0,0|1,0,1]=4 2137 B11R2.36 OC1=CC2=C(C=C1)OCO2 15359 [0,1,0,1,0,0|0,0,0]=2 2138 B11R2.36 OC1=CC2=C(C=CO2)C=C1 28025 [0,1,0,1,0,0|0,0,1]=3 2139 B11R2.36 OC1=CC2=C(C=CS2)C=C1 33018 [0,1,0,1,0,0|0,1,1]=4 2140 B11R2.36 OC1=CC=C2C=CNC2=C1 7261 [0,1,0,1,0,0|1,0,1]=4 2141 B11R2.36 OC1=CC=C2C=NNC2=C1 15662 [0,1,0,1,0,0|1,0,1]=4 2142 B11R2.36 OC1=CC=C2CNCC2=C1 17682 [0,1,0,1,0,0|1,0,0]=3 2143 B11R2.36 OC1=CC=C2NC=CC2=C1 7263 [0,1,0,1,0,0|1,0,1]=4 2144 B11R2.36 OC1=CC=C2NN=CC2=C1 15661 [0,1,0,1,0,0|2,0,0]=4 2145 B11R2.36 SC1=CC2=C(C=C1)OCO2 15612 [0,1,0,1,0,0|0,1,0]=3 2146 B11R2.190 C=CC1=CC=C2CCC2=C1 35204 [0,1,0,1,0,0|2,0,0]=4 2147 B7R1.1 BrCC1=CSC=C1 5295 [1,0,0,0,1,0|2,0,0]=4 2148 B7R1.1 CCC1=CC=CS1 5536 [1,0,0,0,1,0|2,0,0]=4 2149 B7R1.1 CCN1C=CC=C1 35829 [1,0,0,0,1,0|2,0,0]=4 2150 B7R1.1 NCC1=CC=CO1 6967 [1,0,0,0,1,0|2,0,0]=4 2151 B7R1.1 NCC1=CC=CS1 22278 [1,0,0,0,1,0|2,0,0]=4 2152 B7R1.1 NCC1=CC=CS1 5606 [1,0,0,0,1,0|2,0,0]=4 2153 B7R1.1 NCC1=CSC=C1 12348 [1,0,0,0,1,0|2,0,0]=4 2154 B7R1.1 OCC1=CC=CO1 19996 [1,0,0,0,1,0|1,0,0]=3 2155 B7R1.1 OCC1=CC=CS1 5603 [1,0,0,0,1,0|1,0,0]=3 2156 B7R1.1 OCC1=CC=NO1 24993 [1,0,0,0,1,0|2,0,0]=4 2157 B7R1.1 OCC1=CN=CS1 10259 [1,0,0,0,1,0|2,0,0]=4 2158 B7R1.1 OCC1=CN=CS1 20003 [1,0,0,0,1,0|2,0,0]=4 2159 B7R1.1 OCC1=CNC=N1 9502 [1,0,0,0,1,0|2,0,0]=4 2160 B7R1.1 OCC1=CNN=C1 23620 [1,0,0,0,1,0|2,0,0]=4 2161 B7R1.1 OCC1=COC=C1 6951 [1,0,0,0,1,0|1,0,0]=3 2162 B7R1.1 OCC1=CSC=C1 8860 [1,0,0,0,1,0|1,0,0]=3 2163 B7R1.1 OCC1=NC=CS1 10257 [1,0,0,0,1,0|2,0,0]=4 2164 B7R1.1 OCC1=NNC=C1 14333 [1,0,0,0,1,0|2,0,0]=4 2165 B7R1.1 OCC1=NOC=C1 24952 [1,0,0,0,1,0|2,0,0]=4 2166 B7R1.1 OCN1C=CC=N1 7853 [1,0,0,0,1,0|2,0,0]=4 2167 B7R1.1 OCN1C=CN=C1 8052 [1,0,0,0,1,0|2,0,0]=4 2168 B7R1.1 SCC1=CC=CO1 10566 [1,0,0,0,1,0|1,1,0]=4 2169 B7R1.2 CC1=CC(Br)=CS1 5261 [1,0,0,0,1,0|2,0,0]=4 2170 B7R1.2 CC1=CC(O)=NO1 8647 [1,0,0,0,1,0|2,0,0]=4 2171 B7R1.2 CC1=CC=C(Br)O1 36047 [1,0,0,0,1,0|2,0,0]=4 2172 B7R1.2 CC1=CC=C(Br)S1 5193 [1,0,0,0,1,0|2,0,0]=4 2173 B7R1.2 CC1=CC=C(C)S1 5194 [1,0,0,0,1,0|2,0,0]=4 2174 B7R1.2 CC1=CC=C(Cl)S1 5197 [1,0,0,0,1,0|2,0,0]=4 2175 B7R1.2 CC1=CC=C(I)S1 7417 [1,0,0,0,1,0|2,0,0]=4 2176 B7R1.2 CC1=CC=C(O)O1 22254 [1,0,0,0,1,0|1,0,0]=3 2177 B7R1.2 CC1=CNC(C)=C1 24003 [1,0,0,0,1,0|2,0,0]=4 2178 B7R1.2 CC1=COC(O)=C1 22255 [1,0,0,0,1,0|1,0,0]=3 2179 B7R1.2 OC1=CC=C(O)O1 22253 [1,0,0,0,1,0|1,0,0]=3