0 B11R1.166 CC(=O)C1=C(Br)C=C(Br)C=C1 29275 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 29258 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=C1 8533 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.166 CC(=O)C1=C(Br)C=C(N)C=C1 28228 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 29261 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.166 CC(=O)C1=C(C)C=C(Br)C=C1 31226 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 3376 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 29273 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.166 CC(=O)C1=C(C)C=C(O)C=C1 24792 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 3265 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 13619 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 4187 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 28238 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 29270 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 24789 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 4207 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 4213 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 24419 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 36301 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.166 CC(=O)C1=C(N)C=C(F)C=C1 27374 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 19929 [0,0,0,0,0,0|2,0,1]=3 21 B11R1.166 CC(=O)C1=C(O)C=C(C)C=C1 16935 [0,0,0,0,0,0|1,0,1]=2 22 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 29061 [0,0,0,0,0,0|2,0,1]=3 23 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 13252 [0,0,0,0,0,0|2,0,1]=3 24 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 28229 [0,0,0,0,0,0|2,0,1]=3 25 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 3375 [0,0,0,0,0,0|2,0,1]=3 26 B11R1.166 CC(C)C1=C(O)C=C(O)C=C1 35906 [0,0,0,0,0,0|1,0,0]=1 27 B11R1.166 CC1=C(N(C)C)C=CC(Br)=C1 5343 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 4719 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.166 CC1=CC(Br)=C(N(C)C)C=C1 5342 [0,0,0,0,0,0|2,0,0]=2 30 B11R1.166 CC1=CC(Br)=C([N+](=O)[O-])C=C1 31562 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.166 CC1=CC(C)=C(B(O)O)C=C1 9565 [0,0,0,0,0,0|4,0,0]=4 32 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 15441 [0,0,0,0,0,0|3,0,1]=4 33 B11R1.166 CC1=CC(C)=C(C(F)F)C=C1 28468 [0,0,0,0,0,0|3,0,0]=3 34 B11R1.166 CC1=CC(Cl)=C(B(O)O)C=C1 1778 [0,0,0,0,0,0|4,0,0]=4 35 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 4567 [0,0,0,0,0,0|3,0,1]=4 36 B11R1.166 CC1=CC(Cl)=C([N+](=O)[O-])C=C1 4534 [0,0,0,0,0,0|4,0,0]=4 37 B11R1.166 CC1=CC(F)=C(B(O)O)C=C1 23775 [0,0,0,0,0,0|4,0,0]=4 38 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 1395 [0,0,0,0,0,0|3,0,1]=4 39 B11R1.166 CC1=CC(F)=C([N+](=O)[O-])C=C1 1595 [0,0,0,0,0,0|4,0,0]=4 40 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 30572 [0,0,0,0,0,0|3,0,1]=4 41 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 4952 [0,0,0,0,0,0|3,0,1]=4 42 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 4030 [0,0,0,0,0,0|3,0,1]=4 43 B11R1.166 CC1=CC(N)=C([N+](=O)[O-])C=C1 25695 [0,0,0,0,0,0|4,0,0]=4 44 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 32852 [0,0,0,0,0,0|3,0,0]=3 45 B11R1.166 CC1=CC(O)=C([N+](=O)[O-])C=C1 25410 [0,0,0,0,0,0|3,0,0]=3 46 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 18270 [0,0,0,0,0,0|2,0,1]=3 47 B11R1.166 CC1=CC=C(C(=O)O)C(O)=N1 26524 [0,0,0,0,0,0|3,0,1]=4 48 B11R1.166 CC1=CC=C([N+](=O)[O-])C(O)=N1 1112 [0,0,0,0,0,0|4,0,0]=4 49 B11R1.166 CN(C)C1=C(Br)C=C(F)C=C1 5227 [0,0,0,0,0,0|3,0,0]=3 50 B11R1.166 CN(C)C1=C(Cl)C=C(Br)C=C1 5366 [0,0,0,0,0,0|3,0,0]=3 51 B11R1.166 CN(C)C1=C(Cl)C=C(F)C=C1 5235 [0,0,0,0,0,0|3,0,0]=3 52 B11R1.166 CN(C)C1=C(F)C=C(Br)C=C1 5229 [0,0,0,0,0,0|3,0,0]=3 53 B11R1.166 CN(C)C1=C(F)C=C(Cl)C=C1 5236 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.166 CN(C)C1=C(F)C=C(F)C=C1 5240 [0,0,0,0,0,0|3,0,0]=3 55 B11R1.166 C[C@H](O)C1=C(Cl)C=C(F)C=C1 15575 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.166 Clc1ccc(C(Cl)Cl)c(Cl)c1 31174 [0,0,0,0,0,0|4,0,0]=4 57 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 23542 [0,0,0,0,0,0|3,0,1]=4 58 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 4010 [0,0,0,0,0,0|3,0,1]=4 59 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 3845 [0,0,0,0,0,0|3,0,1]=4 60 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 3493 [0,0,0,0,0,0|3,0,1]=4 61 B11R1.166 O=C(O)C1=C(O)C=C(I)C=C1 3888 [0,0,0,0,0,0|3,0,1]=4 62 B11R1.166 O=[N+]([O-])C1=C(O)C=C(Br)C=C1 16073 [0,0,0,0,0,0|4,0,0]=4 63 B11R1.166 O=[N+]([O-])C1=C(O)C=C(F)C=C1 2371 [0,0,0,0,0,0|4,0,0]=4 64 B11R1.166 O=[N+]([O-])C1=C(O)C=C(O)C=C1 27732 [0,0,0,0,0,0|4,0,0]=4 65 B11R1.166 OB(O)C1=C(O)C=C(Cl)C=C1 33194 [0,0,0,0,0,0|4,0,0]=4 66 B11R1.166 OB(O)C1=C(O)C=C(F)C=C1 32850 [0,0,0,0,0,0|4,0,0]=4 67 B10R1.13 C=C(C)C1=CC=C(O)C=C1 27834 [1,0,0,0,0,0|1,0,2]=4 68 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 3294 [1,0,0,0,0,0|2,0,1]=4 69 B10R1.13 CC(=O)C1=CC=C(C)C=C1 3326 [1,0,0,0,0,0|1,0,1]=3 70 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 3297 [1,0,0,0,0,0|2,0,1]=4 71 B10R1.13 CC(=O)C1=CC=C(F)C=C1 10587 [1,0,0,0,0,0|2,0,1]=4 72 B10R1.13 CC(=O)C1=CC=C(I)C=C1 3323 [1,0,0,0,0,0|2,0,1]=4 73 B10R1.13 CC(=O)C1=CC=C(N)C=C1 3288 [1,0,0,0,0,0|2,0,1]=4 74 B10R1.13 CC(=O)C1=CC=C(O)C=C1 3311 [1,0,0,0,0,0|2,0,1]=4 75 B10R1.13 CC(=O)C1=CN=C(C)C=C1 14412 [1,0,0,0,0,0|2,0,1]=4 76 B10R1.13 CC(=O)C1=NC=C(C)C=C1 16371 [1,0,0,0,0,0|2,0,1]=4 77 B10R1.13 CC(C)C1=CC=C(Br)C=C1 18676 [1,0,0,0,0,0|1,0,0]=2 78 B10R1.13 CC(C)C1=CC=C(I)C=C1 3975 [1,0,0,0,0,0|1,0,0]=2 79 B10R1.13 CC(C)C1=CC=C(N)C=N1 19458 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.13 CC(C)C1=CC=C(S)C=C1 6814 [1,0,0,0,0,0|1,0,0]=2 81 B10R1.13 CC(C)C1=NC=C(Br)C=N1 27971 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 27544 [1,0,0,0,0,0|2,0,0]=3 83 B10R1.13 CC(N)C1=CC=C(F)C=C1 3425 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.13 CC(O)C1=CC=C(Br)C=C1 12552 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.13 CC1=CC=C(B(O)O)C=C1 1873 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.13 CC1=CC=C(B(O)O)C=C1 27335 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 15455 [1,0,0,0,0,0|2,0,1]=4 88 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15433 [1,0,0,0,0,0|2,0,1]=4 89 B10R1.13 CC1=CC=C(C(N)=O)C=C1 27569 [1,0,0,0,0,0|2,0,1]=4 90 B10R1.13 CC1=CC=C(C(O)=S)C=C1 10665 [1,0,0,0,0,0|2,0,1]=4 91 B10R1.13 CC1=CC=C(N(C)C)C=C1 21347 [1,0,0,0,0,0|1,0,0]=2 92 B10R1.13 CC1=CC=C(S(=O)O)C=C1 35986 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 35988 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 15589 [1,0,0,0,0,0|1,0,0]=2 95 B10R1.13 CN(C)C1=CC=C(Br)C=C1 2230 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.13 CN(C)C1=CC=C(Br)N=C1 33778 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 5271 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.13 CN(C)C1=CC=C(F)C=C1 3365 [1,0,0,0,0,0|2,0,0]=3 99 B10R1.13 CN(C)C1=CC=C(O)C=C1 27800 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.13 CN(C)C1=NC=C(Br)C=C1 5051 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.13 CN(C)C1=NC=C(N)C=C1 15373 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.13 CN(C)c1ccc(N)cc1 21651 [1,0,0,0,0,0|2,0,0]=3 103 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 15222 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 15219 [1,0,0,0,0,0|2,0,0]=3 105 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 2454 [1,0,0,0,0,0|2,0,0]=3 106 B10R1.13 C[C@@H](N)c1ccc(Br)cc1 14234 [1,0,0,0,0,0|2,0,0]=3 107 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 14252 [1,0,0,0,0,0|2,0,0]=3 108 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 14249 [1,0,0,0,0,0|2,0,0]=3 109 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 14245 [1,0,0,0,0,0|2,0,0]=3 110 B10R1.13 C[C@H](N)C1=CC=C(Cl)C=C1 15221 [1,0,0,0,0,0|2,0,0]=3 111 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 15218 [1,0,0,0,0,0|2,0,0]=3 112 B10R1.13 C[C@H](N)c1ccc(Br)cc1 5736 [1,0,0,0,0,0|2,0,0]=3 113 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 14253 [1,0,0,0,0,0|2,0,0]=3 114 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 14251 [1,0,0,0,0,0|2,0,0]=3 115 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 14247 [1,0,0,0,0,0|2,0,0]=3 116 B10R1.13 Cc1ccc(C(Cl)Cl)cc1 10212 [1,0,0,0,0,0|2,0,0]=3 117 B10R1.13 Cc1ccc([C@@H](C)N)cc1 8021 [1,0,0,0,0,0|1,0,0]=2 118 B10R1.13 Cc1ccc([S@@](N)=O)cc1 9914 [1,0,0,0,0,0|3,0,0]=4 119 B10R1.13 Cc1ccc([S@](N)=O)cc1 9913 [1,0,0,0,0,0|3,0,0]=4 120 B10R1.13 FC(F)C1=CC=C(Br)C=C1 23296 [1,0,0,0,0,0|3,0,0]=4 121 B10R1.13 NC1=CC=C(C(F)F)C=C1 23828 [1,0,0,0,0,0|3,0,0]=4 122 B10R1.13 OC1=CC=C(C(F)F)C=C1 19704 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.25 CC1=C(CN)C=CC(Br)=C1 19930 [1,0,0,0,0,0|3,0,0]=4 124 B10R1.25 CC1=C(CN)C=CC(O)=C1 27617 [1,0,0,0,0,0|3,0,0]=4 125 B10R1.25 CC1=C(CO)C=CC(Br)=C1 27441 [1,0,0,0,0,0|3,0,0]=4 126 B10R1.25 CC1=CC(C)=C(C=O)C=C1 3070 [1,0,0,0,0,0|2,0,1]=4 127 B10R1.25 CC1=CC(C)=C(CO)C=C1 35348 [1,0,0,0,0,0|2,0,0]=3 128 B10R1.25 CC1=CC(C)=C(NN)C=C1 6399 [1,0,0,0,0,0|3,0,0]=4 129 B10R1.25 CC1=CC(Cl)=C(C#N)C=C1 4732 [1,0,0,0,0,0|2,0,1]=4 130 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 17007 [1,0,0,0,0,0|2,0,1]=4 131 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 28906 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 35435 [1,0,0,0,0,0|3,0,0]=4 133 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 4481 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.25 CC1=CC(F)=C(C#N)C=C1 1555 [1,0,0,0,0,0|2,0,1]=4 135 B10R1.25 CC1=CC(F)=C(C=O)C=C1 1451 [1,0,0,0,0,0|2,0,1]=4 136 B10R1.25 CC1=CC(N)=C(C#N)C=C1 4661 [1,0,0,0,0,0|2,0,1]=4 137 B10R1.25 CC1=CC(O)=C(C#N)C=C1 30774 [1,0,0,0,0,0|1,0,1]=3 138 B10R1.25 CC1=CC=C(C=O)C(O)=C1 8154 [1,0,0,0,0,0|1,0,1]=3 139 B10R1.25 CCC1=C(Br)C=C(N)C=C1 27787 [1,0,0,0,0,0|2,0,0]=3 140 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 27794 [1,0,0,0,0,0|2,0,0]=3 141 B10R1.25 CNC1=C(F)C=C(F)C=C1 10041 [1,0,0,0,0,0|3,0,0]=4 142 B10R1.25 CNC1=CC=C(Br)C=C1N 34299 [1,0,0,0,0,0|3,0,0]=4 143 B10R1.25 COC1=C(Br)C=C(Br)C=C1 3847 [1,0,0,0,0,0|3,0,0]=4 144 B10R1.25 COC1=C(Br)C=C(C)C=C1 3797 [1,0,0,0,0,0|2,0,0]=3 145 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 2629 [1,0,0,0,0,0|3,0,0]=4 146 B10R1.25 COC1=C(Br)C=C(F)C=C1 1972 [1,0,0,0,0,0|3,0,0]=4 147 B10R1.25 COC1=C(Br)C=C(N)C=C1 16856 [1,0,0,0,0,0|3,0,0]=4 148 B10R1.25 COC1=C(Br)C=C(O)C=C1 31091 [1,0,0,0,0,0|3,0,0]=4 149 B10R1.25 COC1=C(C)C=C(Br)C=C1 3798 [1,0,0,0,0,0|3,0,0]=4 150 B10R1.25 COC1=C(C)C=C(C)C=C1 5359 [1,0,0,0,0,0|2,0,0]=3 151 B10R1.25 COC1=C(C)C=C(Cl)C=C1 2665 [1,0,0,0,0,0|3,0,0]=4 152 B10R1.25 COC1=C(C)C=C(F)C=C1 2622 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.25 COC1=C(C)C=C(N)C=C1 15790 [1,0,0,0,0,0|3,0,0]=4 154 B10R1.25 COC1=C(C)C=C(O)C=C1 33186 [1,0,0,0,0,0|3,0,0]=4 155 B10R1.25 COC1=C(Cl)C=C(Br)C=C1 2630 [1,0,0,0,0,0|3,0,0]=4 156 B10R1.25 COC1=C(Cl)C=C(C)C=C1 27687 [1,0,0,0,0,0|2,0,0]=3 157 B10R1.25 COC1=C(Cl)C=C(F)C=C1 2658 [1,0,0,0,0,0|3,0,0]=4 158 B10R1.25 COC1=C(Cl)C=C(N)C=C1 17270 [1,0,0,0,0,0|3,0,0]=4 159 B10R1.25 COC1=C(Cl)C=C(O)C=C1 33443 [1,0,0,0,0,0|3,0,0]=4 160 B10R1.25 COC1=C(F)C=C(Br)C=C1 1971 [1,0,0,0,0,0|3,0,0]=4 161 B10R1.25 COC1=C(F)C=C(C)C=C1 24850 [1,0,0,0,0,0|2,0,0]=3 162 B10R1.25 COC1=C(F)C=C(Cl)C=C1 2662 [1,0,0,0,0,0|3,0,0]=4 163 B10R1.25 COC1=C(F)C=C(F)C=C1 3455 [1,0,0,0,0,0|3,0,0]=4 164 B10R1.25 COC1=C(F)C=C(N)C=C1 2125 [1,0,0,0,0,0|3,0,0]=4 165 B10R1.25 COC1=C(F)C=C(O)C=C1 2369 [1,0,0,0,0,0|3,0,0]=4 166 B10R1.25 COC1=C(F)C=C(S)C=C1 6875 [1,0,0,0,0,0|3,0,0]=4 167 B10R1.25 COC1=C(I)C=C(Cl)C=C1 14310 [1,0,0,0,0,0|3,0,0]=4 168 B10R1.25 COC1=C(I)C=C(N)C=C1 3307 [1,0,0,0,0,0|3,0,0]=4 169 B10R1.25 COC1=C(I)C=C(N)C=C1 3310 [1,0,0,0,0,0|3,0,0]=4 170 B10R1.25 COC1=C(N)C=C(F)C=C1 2256 [1,0,0,0,0,0|3,0,0]=4 171 B10R1.25 COC1=C(N)C=C(I)C=C1 28345 [1,0,0,0,0,0|3,0,0]=4 172 B10R1.25 COC1=C(N)C=C(N)C=C1 1905 [1,0,0,0,0,0|3,0,0]=4 173 B10R1.25 COC1=C(N)C=C(N)C=C1 24784 [1,0,0,0,0,0|3,0,0]=4 174 B10R1.25 COC1=C(N)C=C(N)C=C1 4107 [1,0,0,0,0,0|3,0,0]=4 175 B10R1.25 COC1=C(O)C=C(Br)C=C1 26431 [1,0,0,0,0,0|2,0,0]=3 176 B10R1.25 COC1=C(O)C=C(C)C=C1 31088 [1,0,0,0,0,0|1,0,0]=2 177 B10R1.25 COC1=C(O)C=C(F)C=C1 3882 [1,0,0,0,0,0|2,0,0]=3 178 B10R1.25 COC1=C(O)C=C(N)C=C1 3112 [1,0,0,0,0,0|2,0,0]=3 179 B10R1.25 COC1=NC=C(C)C=C1I 26966 [1,0,0,0,0,0|3,0,0]=4 180 B10R1.25 COC1=NC=C(Cl)C=C1O 26938 [1,0,0,0,0,0|3,0,0]=4 181 B10R1.25 COC1=NC=C(F)C=C1O 15267 [1,0,0,0,0,0|3,0,0]=4 182 B10R1.25 COc1ccc(Cl)cc1O 31127 [1,0,0,0,0,0|2,0,0]=3 183 B10R1.25 CSC1=C(C)C=C(O)C=C1 10656 [1,0,0,0,0,0|3,0,0]=4 184 B10R1.25 CSC1=C(F)C=C(F)C=C1 10719 [1,0,0,0,0,0|3,0,0]=4 185 B10R1.25 ClC1=C(CBr)C=CC(Br)=C1 31300 [1,0,0,0,0,0|3,0,0]=4 186 B10R1.25 ClC1=CC(Cl)=C(CBr)C=C1 27460 [1,0,0,0,0,0|3,0,0]=4 187 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 16507 [1,0,0,0,0,0|3,0,0]=4 188 B10R1.25 FC1=C(CBr)C=CC(Br)=C1 4887 [1,0,0,0,0,0|3,0,0]=4 189 B10R1.25 FC1=C(CBr)C=CC(Cl)=C1 4897 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.25 FC1=CC(Br)=C(CBr)C=C1 4883 [1,0,0,0,0,0|3,0,0]=4 191 B10R1.25 FC1=CC(Cl)=C(CBr)C=C1 4893 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.25 FC1=CC(Cl)=C(CCl)C=C1 36215 [1,0,0,0,0,0|3,0,0]=4 193 B10R1.25 FC1=CC(F)=C(CBr)C=C1 4911 [1,0,0,0,0,0|3,0,0]=4 194 B10R1.25 FC1=CC(F)=C(CCl)C=C1 4912 [1,0,0,0,0,0|3,0,0]=4 195 B10R1.25 N#CC1=C(O)C=C(Br)C=C1 3781 [1,0,0,0,0,0|2,0,1]=4 196 B10R1.25 N#CC1=C(O)C=C(Cl)C=C1 28727 [1,0,0,0,0,0|2,0,1]=4 197 B10R1.25 N#CC1=C(O)C=C(F)C=C1 26276 [1,0,0,0,0,0|2,0,1]=4 198 B10R1.25 N#CC1=C(O)C=C(N)C=C1 27615 [1,0,0,0,0,0|2,0,1]=4 199 B10R1.25 N#CC1=C(O)C=C(O)C=C1 13114 [1,0,0,0,0,0|2,0,1]=4 200 B10R1.25 NC1=C(CO)C=CC(Br)=C1 31328 [1,0,0,0,0,0|3,0,0]=4 201 B10R1.25 NCC1=C(Cl)C=C(F)C=C1 25411 [1,0,0,0,0,0|3,0,0]=4 202 B10R1.25 NCC1=C(F)C=C(Br)C=C1 12660 [1,0,0,0,0,0|3,0,0]=4 203 B10R1.25 NCC1=C(F)C=C(Br)C=C1 4709 [1,0,0,0,0,0|3,0,0]=4 204 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 27456 [1,0,0,0,0,0|3,0,0]=4 205 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 3428 [1,0,0,0,0,0|3,0,0]=4 206 B10R1.25 NCC1=C(F)C=C(F)C=C1 4399 [1,0,0,0,0,0|3,0,0]=4 207 B10R1.25 O=CC1=C(O)C=C(Br)C=C1 16944 [1,0,0,0,0,0|2,0,1]=4 208 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 22142 [1,0,0,0,0,0|2,0,1]=4 209 B10R1.25 O=CC1=C(O)C=C(F)C=C1 8483 [1,0,0,0,0,0|2,0,1]=4 210 B10R1.25 O=CC1=C(O)C=C(O)C=C1 8218 [1,0,0,0,0,0|2,0,1]=4 211 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 9781 [1,0,0,0,0,0|3,0,0]=4 212 B10R1.25 OCC1=C(Br)C=C(F)C=C1 3222 [1,0,0,0,0,0|3,0,0]=4 213 B10R1.25 OCC1=C(Br)C=C(I)C=C1 31340 [1,0,0,0,0,0|3,0,0]=4 214 B10R1.25 OCC1=C(Cl)C=C(Cl)C=C1 9993 [1,0,0,0,0,0|3,0,0]=4 215 B10R1.25 OCC1=C(Cl)C=C(F)C=C1 3426 [1,0,0,0,0,0|3,0,0]=4 216 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 31313 [1,0,0,0,0,0|3,0,0]=4 217 B10R1.25 OCC1=C(F)C=C(Br)C=C1 3223 [1,0,0,0,0,0|3,0,0]=4 218 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 26669 [1,0,0,0,0,0|3,0,0]=4 219 B10R1.25 OCC1=C(F)C=C(F)C=C1 4910 [1,0,0,0,0,0|3,0,0]=4 220 B10R1.25 OCC1=C(I)C=C(F)C=C1 31350 [1,0,0,0,0,0|3,0,0]=4 221 B10R1.25 OCC1=C(O)C=C(Br)C=C1 15237 [1,0,0,0,0,0|2,0,0]=3 222 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 3086 [1,0,0,0,0,0|2,0,1]=4 223 B10R1.61 CC(=O)C1=C(C)C=CC=C1 3090 [1,0,0,0,0,0|2,0,1]=4 224 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 3084 [1,0,0,0,0,0|2,0,1]=4 225 B10R1.61 CC(=O)C1=C(F)C=CC=C1 22574 [1,0,0,0,0,0|2,0,1]=4 226 B10R1.61 CC(=O)C1=C(I)C=CC=C1 3893 [1,0,0,0,0,0|2,0,1]=4 227 B10R1.61 CC(=O)C1=C(O)C=CC=C1 23010 [1,0,0,0,0,0|1,0,1]=3 228 B10R1.61 CC(C)C1=C(Br)C=CC=C1 16461 [1,0,0,0,0,0|1,0,0]=2 229 B10R1.61 CC(C)C1=C(Cl)C=NC=C1 6618 [1,0,0,0,0,0|2,0,0]=3 230 B10R1.61 CC(C)C1=C(I)C=CC=C1 12584 [1,0,0,0,0,0|1,0,0]=2 231 B10R1.61 CC(C)C1=C(O)C=CN=C1 35264 [1,0,0,0,0,0|1,0,0]=2 232 B10R1.61 CC(C)C1=C(S)C=CC=C1 6880 [1,0,0,0,0,0|0,1,0]=2 233 B10R1.61 CC(C)C1=CC=CN=C1Cl 6145 [1,0,0,0,0,0|2,0,0]=3 234 B10R1.61 CC(C)C1=NC=CC=C1Br 32481 [1,0,0,0,0,0|2,0,0]=3 235 B10R1.61 CC1=C(C(Cl)Cl)C=CC=C1 10210 [1,0,0,0,0,0|3,0,0]=4 236 B10R1.61 CC1=NC=CN=C1C(C)C 24268 [1,0,0,0,0,0|3,0,0]=4 237 B10R1.61 CN(C)C1=C(Br)C=CC=C1 3759 [1,0,0,0,0,0|2,0,0]=3 238 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 5269 [1,0,0,0,0,0|2,0,0]=3 239 B10R1.61 CN(C)C1=C(F)C=CC=C1 5243 [1,0,0,0,0,0|2,0,0]=3 240 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 24734 [1,0,0,0,0,0|2,0,0]=3 241 B10R1.61 C[C@@H](N)C1=C(O)C=CC=C1 23367 [1,0,0,0,0,0|1,0,0]=2 242 B10R1.61 C[C@@H](O)C1=C(Br)C=CC=C1 5686 [1,0,0,0,0,0|2,0,0]=3 243 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 3980 [1,0,0,0,0,0|2,0,0]=3 244 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 24769 [1,0,0,0,0,0|2,0,0]=3 245 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 24731 [1,0,0,0,0,0|2,0,0]=3 246 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 15728 [1,0,0,0,0,0|2,0,0]=3 247 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 5682 [1,0,0,0,0,0|2,0,0]=3 248 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 5670 [1,0,0,0,0,0|2,0,0]=3 249 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 24768 [1,0,0,0,0,0|2,0,0]=3 250 B10R1.61 NC(=O)C1=CC=CC=C1O 10992 [1,0,0,0,0,0|2,0,1]=4 251 B10R1.61 OB(O)C1=C(O)C=CC=C1 9522 [1,0,0,0,0,0|3,0,0]=4 252 B12R1.57 COC1=C(B(O)O)C=CC(C)=C1 33213 [0,1,0,0,0,0|3,0,0]=4 253 B12R1.57 COC1=C(C(=O)O)C=CC(C)=C1 30703 [0,1,0,0,0,0|2,0,1]=4 254 B12R1.57 COC1=C(C(C)=O)C=CC(Br)=C1 31217 [0,1,0,0,0,0|2,0,1]=4 255 B12R1.57 COC1=C(C(C)=O)C=CC(F)=C1 13459 [0,1,0,0,0,0|2,0,1]=4 256 B12R1.57 COC1=C(C(C)=O)C=CC(N)=C1 31215 [0,1,0,0,0,0|2,0,1]=4 257 B12R1.57 COc1cc(C)ccc1[N+](=O)[O-] 26673 [0,1,0,0,0,0|3,0,0]=4 258 B12R1.126 CC(C)(C)C1=C(Br)C=C(N)C=C1 31844 [0,1,0,0,0,0|2,0,0]=3 259 B12R1.126 CC1=CC(Br)=C(C(F)(F)F)C=C1 31557 [0,1,0,0,0,0|3,0,0]=4 260 B12R1.126 CC1=CC(Cl)=C(C(F)(F)F)C=C1 4851 [0,1,0,0,0,0|3,0,0]=4 261 B12R1.126 CC1=CC(O)=C(C(C)(C)C)C=C1 24316 [0,1,0,0,0,0|0,0,0]=1 262 B12R1.126 OC1=C(C(F)(F)F)C=CC(Br)=C1 34230 [0,1,0,0,0,0|3,0,0]=4 263 B12R1.126 OC1=C(C(F)(F)F)C=CC(F)=C1 2171 [0,1,0,0,0,0|3,0,0]=4 264 B12R1.232 CC(=O)C1=C(F)C=C(C)C(Cl)=C1 31201 [0,1,0,0,0,0|2,0,1]=4 265 B12R1.232 CC(=O)C1=C(O)C=C(C)C(C)=C1 29281 [0,1,0,0,0,0|1,0,1]=3 266 B12R1.232 CC(=O)C1=C(O)C=C(F)C(F)=C1 29146 [0,1,0,0,0,0|2,0,1]=4 267 B12R1.232 CC1=CC(O)=C(C(=O)O)C=C1I 28668 [0,1,0,0,0,0|2,0,1]=4 268 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1Br 19801 [0,1,0,0,0,0|0,0,0]=1 269 B12R1.452 CC(=O)C1=C(O)C=C(C#N)C=C1 29274 [0,1,0,0,0,0|1,0,2]=4 270 B12R1.452 CN(C)C1=C(Cl)C=C([N+]#N)C=C1 3519 [0,1,0,0,0,0|3,0,0]=4 271 B12R1.452 CN(C)C1=C(F)C=C(C#N)C=C1 28116 [0,1,0,0,0,0|2,0,1]=4 272 B12R1.452 COC1=CC(Br)=C(C(F)F)C=C1 31147 [0,1,0,0,0,0|3,0,0]=4 273 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 2548 [0,1,0,0,0,0|2,0,1]=4 274 B12R1.452 COC1=CC(N)=C(C(C)=O)C=C1 29252 [0,1,0,0,0,0|2,0,1]=4 275 B12R1.452 COC1=CC(O)=C(C(=O)O)C=C1 18895 [0,1,0,0,0,0|2,0,1]=4 276 B12R1.452 COC1=CC(O)=C(C(C)=O)C=C1 3271 [0,1,0,0,0,0|1,0,1]=3 277 B12R1.452 COC1=CC(O)=C([N+](=O)[O-])C=C1 22230 [0,1,0,0,0,0|3,0,0]=4 278 B12R1.893 CC(=O)C1=C(F)C(F)=C(C)C=C1 29150 [0,1,0,0,0,0|2,0,1]=4 279 B12R1.893 CC(=O)C1=C(O)C(O)=C(O)C=C1 3246 [0,1,0,0,0,0|2,0,1]=4 280 B12R1.893 CC1=CC=C([N+](=O)[O-])C(O)=C1Br 33936 [0,1,0,0,0,0|3,0,0]=4 281 B12R1.1000 CC(=O)C1=C(F)C=C(Br)C=C1O 29168 [0,1,0,0,0,0|2,0,1]=4 282 B12R1.1000 CC(=O)C1=C(O)C=C(C)C=C1O 3379 [0,1,0,0,0,0|1,0,1]=3 283 B12R1.1000 CC(=O)C1=C(O)C=C(C)OC1=O 9713 [0,1,0,0,0,0|2,0,1]=4 284 B12R1.1000 CC(=O)C1=C(O)C=C(O)C=C1O 3402 [0,1,0,0,0,0|2,0,1]=4 285 B12R1.1000 CC1=CC(Br)=CC(C)=C1N(C)C 5369 [0,1,0,0,0,0|3,0,0]=4 286 B12R1.1000 CC1=CC(C)=C(N(C)C)C(C)=C1 3219 [0,1,0,0,0,0|2,0,0]=3 287 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(C)=C1 27604 [0,1,0,0,0,0|2,0,1]=4 288 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(O)=C1 3124 [0,1,0,0,0,0|2,0,1]=4 289 B12R1.1703 CC1=CC(C)=C(C(=O)CBr)C=C1 16796 [0,1,0,0,0,0|2,0,1]=4 290 B12R1.1703 COC(=O)C1=C(Br)C=C(C)C=C1 14035 [0,1,0,0,0,0|2,0,1]=4 291 B12R1.1703 COC(=O)C1=C(N)C=C(C)C=C1 30496 [0,1,0,0,0,0|2,0,1]=4 292 B12R1.1703 COC(=O)C1=C(O)C=C(Br)C=C1 30520 [0,1,0,0,0,0|2,0,1]=4 293 B12R1.1703 COC(=O)C1=C(O)C=C(N)C=C1 32352 [0,1,0,0,0,0|2,0,1]=4 294 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 35728 [0,1,0,0,0,0|2,0,1]=4 295 B12R1.1703 COC(=O)C1=CC=C(F)C=C1O 4089 [0,1,0,0,0,0|2,0,1]=4 296 B12R1.1703 NC[C@@H](O)C1=C(Cl)C=C(Cl)C=C1 19373 [0,1,0,0,0,0|3,0,0]=4 297 B12R1.1703 OC[C@@H](O)C1=C(Cl)C=C(Cl)C=C1 35982 [0,1,0,0,0,0|3,0,0]=4 298 B12R1.1703 O[C@H](CCl)C1=C(Cl)C=C(Cl)C=C1 30376 [0,1,0,0,0,0|3,0,0]=4 299 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 8850 [0,0,0,1,0,0|2,0,1]=4 300 B12R2.612 CC1=COC2=C1C=CC(Br)=C2 32472 [0,0,0,1,0,0|1,0,2]=4 301 B12R2.612 CC1=NOC2=C1C=CC(Br)=C2 24259 [0,0,0,1,0,0|2,0,1]=4 302 B12R2.612 CC1=NOC2=C1C=CC(Cl)=C2 26079 [0,0,0,1,0,0|2,0,1]=4 303 B12R2.612 CC1NCC2=CC(Br)=CC=C21 11459 [0,0,0,1,0,0|3,0,0]=4 304 B12R2.612 CC1NCC2=CC(Br)=CC=C21 16791 [0,0,0,1,0,0|3,0,0]=4 305 B12R2.612 C[C@H]1NCC2=CC(Br)=CC=C21 11460 [0,0,0,1,0,0|3,0,0]=4 306 B12R2.612 NC1COC2=C1C=CC(Br)=C2 17825 [0,0,0,1,0,0|2,0,0]=3 307 B12R2.612 NC1COC2=C1C=CC(Br)=C2 23149 [0,0,0,1,0,0|2,0,0]=3 308 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 17998 [0,0,0,1,0,0|2,0,1]=4 309 B12R2.612 O=C1COC2=C1C=CC(Cl)=C2 17996 [0,0,0,1,0,0|2,0,1]=4 310 B12R2.612 O=C1COC2=C1C=CC(I)=C2 22336 [0,0,0,1,0,0|2,0,1]=4 311 B12R2.612 O=C1COC2=C1C=CC(O)=C2 28015 [0,0,0,1,0,0|2,0,1]=4 312 B12R1.233 CC(C)OC1=C(Cl)C=C(Br)C=C1 34524 [0,0,0,0,0,1|2,0,0]=3 313 B12R1.233 CC(C)OC1=NC=C(Br)C=C1Cl 22056 [0,0,0,0,0,1|3,0,0]=4 314 B12R1.233 CC(C)OC1=NC=C(Br)C=C1I 26898 [0,0,0,0,0,1|3,0,0]=4 315 B9R1.1 BrCC1=CC=C(Br)C=C1 7460 [2,0,0,0,0,0|2,0,0]=4 316 B9R1.1 BrCC1=CC=C(I)C=C1 3557 [2,0,0,0,0,0|2,0,0]=4 317 B9R1.1 C#CC1=CC=C(C)C=C1 10922 [2,0,0,0,0,0|0,0,2]=4 318 B9R1.1 CC1=CC=C(C#N)C=C1 8168 [2,0,0,0,0,0|1,0,1]=4 319 B9R1.1 CC1=CC=C(C=O)C=C1 15497 [2,0,0,0,0,0|1,0,1]=4 320 B9R1.1 CC1=CC=C(CN)C=C1 10199 [2,0,0,0,0,0|1,0,0]=3 321 B9R1.1 CC1=CC=C(CO)C=N1 27403 [2,0,0,0,0,0|2,0,0]=4 322 B9R1.1 CC1=CC=C(NN)C=C1 4500 [2,0,0,0,0,0|2,0,0]=4 323 B9R1.1 CCC1=CC=C(Br)C=C1 3772 [2,0,0,0,0,0|1,0,0]=3 324 B9R1.1 CCC1=CC=C(C)C=C1 21843 [2,0,0,0,0,0|0,0,0]=2 325 B9R1.1 CCC1=CC=C(I)C=C1 3877 [2,0,0,0,0,0|1,0,0]=3 326 B9R1.1 CCC1=CC=C(N)C=C1 26342 [2,0,0,0,0,0|1,0,0]=3 327 B9R1.1 CCC1=CC=C(O)C=C1 3874 [2,0,0,0,0,0|1,0,0]=3 328 B9R1.1 CCC1=CC=C(S)C=C1 6813 [2,0,0,0,0,0|1,0,0]=3 329 B9R1.1 CCC1=CN=C(C)C=C1 10482 [2,0,0,0,0,0|1,0,0]=3 330 B9R1.1 CCC1=CN=C(C)C=C1 18256 [2,0,0,0,0,0|1,0,0]=3 331 B9R1.1 CCC1=NC=C(Br)C=C1 16886 [2,0,0,0,0,0|2,0,0]=4 332 B9R1.1 CCC1=NC=C(N)C=C1 25855 [2,0,0,0,0,0|2,0,0]=4 333 B9R1.1 CCc1ccc(F)cc1 22752 [2,0,0,0,0,0|1,0,0]=3 334 B9R1.1 CNC1=CC=C(Cl)C=C1 23344 [2,0,0,0,0,0|2,0,0]=4 335 B9R1.1 CNC1=CC=C(I)C=C1 28328 [2,0,0,0,0,0|2,0,0]=4 336 B9R1.1 COC1=CC=C(Br)C=C1 3726 [2,0,0,0,0,0|2,0,0]=4 337 B9R1.1 COC1=CC=C(C)N=C1 6640 [2,0,0,0,0,0|2,0,0]=4 338 B9R1.1 COC1=CC=C(Cl)C=C1 3616 [2,0,0,0,0,0|2,0,0]=4 339 B9R1.1 COC1=CC=C(F)C=C1 3475 [2,0,0,0,0,0|2,0,0]=4 340 B9R1.1 COC1=CC=C(I)C=C1 3911 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.1 COC1=CC=C(N)C=C1 21392 [2,0,0,0,0,0|2,0,0]=4 342 B9R1.1 COC1=CC=C(N)C=C1 36098 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.1 COC1=CC=C(O)C=C1 14584 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.1 COC1=CC=C(O)C=C1 2276 [2,0,0,0,0,0|2,0,0]=4 345 B9R1.1 COC1=CC=C(S)C=C1 6822 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.1 COC1=NC=C(C)C=C1 6609 [2,0,0,0,0,0|2,0,0]=4 347 B9R1.1 CSC1=CC=C(Br)C=C1 10650 [2,0,0,0,0,0|2,0,0]=4 348 B9R1.1 CSC1=CC=C(C)C=C1 10672 [2,0,0,0,0,0|1,0,0]=3 349 B9R1.1 CSC1=CC=C(Cl)C=C1 10645 [2,0,0,0,0,0|2,0,0]=4 350 B9R1.1 CSC1=CC=C(F)C=C1 10641 [2,0,0,0,0,0|2,0,0]=4 351 B9R1.1 CSC1=CC=C(I)C=C1 10670 [2,0,0,0,0,0|2,0,0]=4 352 B9R1.1 CSC1=CC=C(N)C=C1 10636 [2,0,0,0,0,0|2,0,0]=4 353 B9R1.1 CSC1=CC=C(O)C=C1 15277 [2,0,0,0,0,0|2,0,0]=4 354 B9R1.1 CSC1=CC=C(S)C=C1 6825 [2,0,0,0,0,0|2,0,0]=4 355 B9R1.1 ClC1=CC=C(CBr)C=C1 36109 [2,0,0,0,0,0|2,0,0]=4 356 B9R1.1 ClCC1=CC=C(Br)C=C1 2478 [2,0,0,0,0,0|2,0,0]=4 357 B9R1.1 ClCC1=CC=C(Cl)C=C1 5797 [2,0,0,0,0,0|2,0,0]=4 358 B9R1.1 FC1=CC=C(CBr)C=C1 7354 [2,0,0,0,0,0|2,0,0]=4 359 B9R1.1 FC1=CC=C(CCl)C=C1 8864 [2,0,0,0,0,0|2,0,0]=4 360 B9R1.1 FC1=CC=C(CS)C=C1 6855 [2,0,0,0,0,0|2,0,0]=4 361 B9R1.1 NC1=CC=C(CBr)C=C1 26393 [2,0,0,0,0,0|2,0,0]=4 362 B9R1.1 NC1=CC=C(CO)C=C1 7480 [2,0,0,0,0,0|2,0,0]=4 363 B9R1.1 NCC1=CC=C(Br)C=C1 23806 [2,0,0,0,0,0|2,0,0]=4 364 B9R1.1 NCC1=CC=C(Br)C=C1 3751 [2,0,0,0,0,0|2,0,0]=4 365 B9R1.1 NCC1=CC=C(Cl)C=C1 9028 [2,0,0,0,0,0|2,0,0]=4 366 B9R1.1 NCC1=CC=C(F)C=C1 3408 [2,0,0,0,0,0|2,0,0]=4 367 B9R1.1 NCC1=CC=C(F)C=C1 4420 [2,0,0,0,0,0|2,0,0]=4 368 B9R1.1 NCC1=CC=C(I)C=C1 3304 [2,0,0,0,0,0|2,0,0]=4 369 B9R1.1 NCC1=CC=C(N)C=C1 5803 [2,0,0,0,0,0|2,0,0]=4 370 B9R1.1 NCC1=CC=C(O)C=C1 26036 [2,0,0,0,0,0|2,0,0]=4 371 B9R1.1 OCC1=CC=C(Br)C=C1 3748 [2,0,0,0,0,0|2,0,0]=4 372 B9R1.1 OCC1=CC=C(Cl)C=C1 3627 [2,0,0,0,0,0|2,0,0]=4 373 B9R1.1 OCC1=CC=C(F)C=C1 3487 [2,0,0,0,0,0|2,0,0]=4 374 B9R1.1 OCC1=CC=C(I)C=C1 4081 [2,0,0,0,0,0|2,0,0]=4 375 B9R1.1 OCC1=CC=C(O)C=C1 29320 [2,0,0,0,0,0|2,0,0]=4 376 B9R1.1 OCC1=CC=C(S)C=C1 6879 [2,0,0,0,0,0|2,0,0]=4 377 B9R1.1 SCC1=CC=C(Br)C=C1 6868 [2,0,0,0,0,0|2,0,0]=4 378 B9R1.1 SCC1=CC=C(Cl)C=C1 6838 [2,0,0,0,0,0|2,0,0]=4 379 B9R1.6 CC(Cl)C1=CC=CC=C1 10204 [2,0,0,0,0,0|1,0,0]=3 380 B9R1.6 CC(N)C1=CC=CC=C1 21079 [2,0,0,0,0,0|1,0,0]=3 381 B9R1.6 CN(C)C1=CC=NC=C1 2377 [2,0,0,0,0,0|2,0,0]=4 382 B9R1.6 CN(C)C1=NC=CC=C1 14996 [2,0,0,0,0,0|2,0,0]=4 383 B9R1.6 CP(C)C1=CC=CC=C1 6420 [2,0,0,0,0,0|1,0,0]=3 384 B9R1.6 C[C@@H](N)c1ccccc1 6026 [2,0,0,0,0,0|1,0,0]=3 385 B9R1.6 C[C@@H](N)c1ccccc1 6060 [2,0,0,0,0,0|1,0,0]=3 386 B9R1.6 C[C@@H](N)c1ccccc1 9918 [2,0,0,0,0,0|1,0,0]=3 387 B9R1.6 C[C@@H](O)C1=CC=CN=C1 27201 [2,0,0,0,0,0|2,0,0]=4 388 B9R1.6 C[C@@H](O)C1=NC=CC=C1 5699 [2,0,0,0,0,0|2,0,0]=4 389 B9R1.6 C[C@@H](O)c1ccccc1 6851 [2,0,0,0,0,0|1,0,0]=3 390 B9R1.6 C[C@H](N)c1ccccc1 6025 [2,0,0,0,0,0|1,0,0]=3 391 B9R1.6 C[C@H](N)c1ccccc1 6061 [2,0,0,0,0,0|1,0,0]=3 392 B9R1.6 C[C@H](O)C1=NC=CC=C1 5701 [2,0,0,0,0,0|2,0,0]=4 393 B9R1.6 C[C@H](O)c1ccccc1 6858 [2,0,0,0,0,0|1,0,0]=3 394 B9R1.6 FC(Cl)C1=CC=CC=C1 15923 [2,0,0,0,0,0|2,0,0]=4 395 B9R1.15 BrCC1=C(Br)C=CC=C1 16915 [2,0,0,0,0,0|2,0,0]=4 396 B9R1.15 BrCC1=C(I)C=CC=C1 14812 [2,0,0,0,0,0|2,0,0]=4 397 B9R1.15 CC1=C(CCl)C=CC=C1 7487 [2,0,0,0,0,0|2,0,0]=4 398 B9R1.15 CC1=C(CN)C=CC=C1 10197 [2,0,0,0,0,0|2,0,0]=4 399 B9R1.15 CCC1=C(Br)C=CC=C1 3770 [2,0,0,0,0,0|1,0,0]=3 400 B9R1.15 CCC1=C(I)C=CC=C1 3876 [2,0,0,0,0,0|1,0,0]=3 401 B9R1.15 CCC1=C(N)C=CC=C1 20945 [2,0,0,0,0,0|1,0,0]=3 402 B9R1.15 CCC1=C(N)C=CC=C1 21080 [2,0,0,0,0,0|1,0,0]=3 403 B9R1.15 CCC1=C(O)C=CC=C1 3871 [2,0,0,0,0,0|0,0,0]=2 404 B9R1.15 CCC1=C(S)C=CC=C1 6844 [2,0,0,0,0,0|0,1,0]=3 405 B9R1.15 CCC1=CC=CN=C1N 35166 [2,0,0,0,0,0|2,0,0]=4 406 B9R1.15 CCC1=NC=CC=C1Br 27958 [2,0,0,0,0,0|2,0,0]=4 407 B9R1.15 CC[N+]1=C(Br)C=CC=C1 35190 [2,0,0,0,0,0|2,0,0]=4 408 B9R1.15 CNC1=C(F)C=CC=C1 15527 [2,0,0,0,0,0|2,0,0]=4 409 B9R1.15 CNC1=CC=CC=C1N 14987 [2,0,0,0,0,0|2,0,0]=4 410 B9R1.15 COC1=C(Br)C=CC=C1 3725 [2,0,0,0,0,0|2,0,0]=4 411 B9R1.15 COC1=C(Cl)C=CC=C1 3614 [2,0,0,0,0,0|2,0,0]=4 412 B9R1.15 COC1=C(F)C=CC=C1 3473 [2,0,0,0,0,0|2,0,0]=4 413 B9R1.15 COC1=C(I)C=CC=C1 3898 [2,0,0,0,0,0|2,0,0]=4 414 B9R1.15 COC1=C(O)C=CN=C1 34289 [2,0,0,0,0,0|2,0,0]=4 415 B9R1.15 COC1=C(S)C=CC=C1 6816 [2,0,0,0,0,0|1,1,0]=4 416 B9R1.15 COC1=CC=CC=C1O 26545 [2,0,0,0,0,0|1,0,0]=3 417 B9R1.15 COC1=CC=CN=C1O 6543 [2,0,0,0,0,0|2,0,0]=4 418 B9R1.15 CSC1=C(Br)C=CC=C1 10648 [2,0,0,0,0,0|2,0,0]=4 419 B9R1.15 CSC1=C(C)C=CC=C1 10730 [2,0,0,0,0,0|2,0,0]=4 420 B9R1.15 CSC1=C(Cl)C=CC=C1 10643 [2,0,0,0,0,0|2,0,0]=4 421 B9R1.15 CSC1=C(F)C=CC=C1 10638 [2,0,0,0,0,0|2,0,0]=4 422 B9R1.15 CSC1=C(I)C=CC=C1 10668 [2,0,0,0,0,0|2,0,0]=4 423 B9R1.15 CSC1=C(N)C=CC=C1 10633 [2,0,0,0,0,0|2,0,0]=4 424 B9R1.15 CSC1=C(O)C=CC=C1 10666 [2,0,0,0,0,0|1,0,0]=3 425 B9R1.15 ClC1=C(CBr)C=CC=C1 12482 [2,0,0,0,0,0|2,0,0]=4 426 B9R1.15 ClCC1=C(Cl)C=CC=C1 10203 [2,0,0,0,0,0|2,0,0]=4 427 B9R1.15 FC1=C(CBr)C=CC=C1 10383 [2,0,0,0,0,0|2,0,0]=4 428 B9R1.15 FC1=C(CCl)C=CC=C1 2094 [2,0,0,0,0,0|2,0,0]=4 429 B9R1.15 N#CC1=C(O)C=CC=C1 4803 [2,0,0,0,0,0|1,0,1]=4 430 B9R1.15 NC1=C(CO)C=CC=C1 7478 [2,0,0,0,0,0|2,0,0]=4 431 B9R1.15 NCC1=C(Br)C=CC=C1 20398 [2,0,0,0,0,0|2,0,0]=4 432 B9R1.15 NCC1=C(Br)C=CC=C1 3749 [2,0,0,0,0,0|2,0,0]=4 433 B9R1.15 NCC1=C(Cl)C=CC=C1 5800 [2,0,0,0,0,0|2,0,0]=4 434 B9R1.15 NCC1=C(Cl)C=CC=C1 6155 [2,0,0,0,0,0|2,0,0]=4 435 B9R1.15 NCC1=C(F)C=CC=C1 4415 [2,0,0,0,0,0|2,0,0]=4 436 B9R1.15 NCC1=C(N)C=CC=C1 23363 [2,0,0,0,0,0|2,0,0]=4 437 B9R1.15 NCC1=C(O)C=CC=C1 7383 [2,0,0,0,0,0|1,0,0]=3 438 B9R1.15 NCC1=NC=CC=C1O 34602 [2,0,0,0,0,0|2,0,0]=4 439 B9R1.15 OCC1=C(Br)C=CC=C1 3746 [2,0,0,0,0,0|2,0,0]=4 440 B9R1.15 OCC1=C(Cl)C=CC=C1 3625 [2,0,0,0,0,0|2,0,0]=4 441 B9R1.15 OCC1=C(F)C=CC=C1 3485 [2,0,0,0,0,0|2,0,0]=4 442 B9R1.15 OCC1=C(O)C=CC=C1 21869 [2,0,0,0,0,0|1,0,0]=3 443 B9R1.15 OCC1=NC=CC=C1O 4075 [2,0,0,0,0,0|2,0,0]=4 444 B9R1.15 SCC1=C(Cl)C=CC=C1 6836 [2,0,0,0,0,0|2,0,0]=4 445 B9R1.15 SCc1ccccc1Br 6847 [2,0,0,0,0,0|2,0,0]=4 446 B9R1.69 CC1=C(Br)C=C(Br)C=C1 3915 [2,0,0,0,0,0|2,0,0]=4 447 B9R1.69 CC1=C(Br)C=C(Cl)C=C1 3599 [2,0,0,0,0,0|2,0,0]=4 448 B9R1.69 CC1=C(Br)C=C(F)C=C1 1602 [2,0,0,0,0,0|2,0,0]=4 449 B9R1.69 CC1=C(Br)C=C(N)C=C1 5336 [2,0,0,0,0,0|2,0,0]=4 450 B9R1.69 CC1=C(Br)C=C(O)C=C1 27670 [2,0,0,0,0,0|2,0,0]=4 451 B9R1.69 CC1=C(C)C=C(Br)C=C1 3764 [2,0,0,0,0,0|2,0,0]=4 452 B9R1.69 CC1=C(C)C=C(Cl)C=C1 3641 [2,0,0,0,0,0|2,0,0]=4 453 B9R1.69 CC1=C(C)C=C(F)C=C1 14118 [2,0,0,0,0,0|2,0,0]=4 454 B9R1.69 CC1=C(C)C=C(I)C=C1 3105 [2,0,0,0,0,0|2,0,0]=4 455 B9R1.69 CC1=C(C)C=C(O)C=C1 21761 [2,0,0,0,0,0|2,0,0]=4 456 B9R1.69 CC1=C(C)C=C(S)C=C1 6812 [2,0,0,0,0,0|2,0,0]=4 457 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 3603 [2,0,0,0,0,0|2,0,0]=4 458 B9R1.69 CC1=C(Cl)C=C(F)C=C1 1605 [2,0,0,0,0,0|2,0,0]=4 459 B9R1.69 CC1=C(Cl)C=C(I)C=C1 3652 [2,0,0,0,0,0|2,0,0]=4 460 B9R1.69 CC1=C(Cl)C=C(N)C=C1 19746 [2,0,0,0,0,0|2,0,0]=4 461 B9R1.69 CC1=C(Cl)C=C(O)C=C1 3671 [2,0,0,0,0,0|2,0,0]=4 462 B9R1.69 CC1=C(F)C=C(Br)C=C1 1601 [2,0,0,0,0,0|2,0,0]=4 463 B9R1.69 CC1=C(F)C=C(Cl)C=C1 3437 [2,0,0,0,0,0|2,0,0]=4 464 B9R1.69 CC1=C(F)C=C(F)C=C1 1612 [2,0,0,0,0,0|2,0,0]=4 465 B9R1.69 CC1=C(F)C=C(I)C=C1 1618 [2,0,0,0,0,0|2,0,0]=4 466 B9R1.69 CC1=C(F)C=C(N)C=C1 1509 [2,0,0,0,0,0|2,0,0]=4 467 B9R1.69 CC1=C(F)C=C(O)C=C1 1499 [2,0,0,0,0,0|2,0,0]=4 468 B9R1.69 CC1=C(F)C=C(S)C=C1 6872 [2,0,0,0,0,0|2,0,0]=4 469 B9R1.69 CC1=C(I)C=C(Cl)C=C1 3657 [2,0,0,0,0,0|2,0,0]=4 470 B9R1.69 CC1=C(I)C=C(F)C=C1 1622 [2,0,0,0,0,0|2,0,0]=4 471 B9R1.69 CC1=C(I)C=C(N)C=C1 3314 [2,0,0,0,0,0|2,0,0]=4 472 B9R1.69 CC1=C(N)C=C(Br)C=C1 3801 [2,0,0,0,0,0|2,0,0]=4 473 B9R1.69 CC1=C(N)C=C(Cl)C=C1 14280 [2,0,0,0,0,0|2,0,0]=4 474 B9R1.69 CC1=C(N)C=C(Cl)C=C1 35457 [2,0,0,0,0,0|2,0,0]=4 475 B9R1.69 CC1=C(N)C=C(F)C=C1 1512 [2,0,0,0,0,0|2,0,0]=4 476 B9R1.69 CC1=C(N)C=C(I)C=C1 31023 [2,0,0,0,0,0|2,0,0]=4 477 B9R1.69 CC1=C(N)C=C(N)C=C1 21656 [2,0,0,0,0,0|2,0,0]=4 478 B9R1.69 CC1=C(N)C=C(O)C=C1 4524 [2,0,0,0,0,0|2,0,0]=4 479 B9R1.69 CC1=C(O)C=C(Br)C=C1 4132 [2,0,0,0,0,0|1,0,0]=3 480 B9R1.69 CC1=C(O)C=C(Cl)C=C1 3674 [2,0,0,0,0,0|1,0,0]=3 481 B9R1.69 CC1=C(O)C=C(F)C=C1 1502 [2,0,0,0,0,0|1,0,0]=3 482 B9R1.69 CC1=C(O)C=C(N)C=C1 8207 [2,0,0,0,0,0|1,0,0]=3 483 B9R1.69 CC1=C(O)C=C(O)C=C1 27666 [2,0,0,0,0,0|1,0,0]=3 484 B9R1.69 CC1=C(S)C=C(Cl)C=C1 6881 [2,0,0,0,0,0|1,1,0]=4 485 B9R1.69 CC1=CC(Br)=C(Br)C=C1 3930 [2,0,0,0,0,0|2,0,0]=4 486 B9R1.69 CC1=CC(Br)=C(C)C=C1 3763 [2,0,0,0,0,0|1,0,0]=3 487 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 3602 [2,0,0,0,0,0|2,0,0]=4 488 B9R1.69 CC1=CC(Br)=C(F)C=C1 1600 [2,0,0,0,0,0|2,0,0]=4 489 B9R1.69 CC1=CC(Br)=C(I)C=C1 3792 [2,0,0,0,0,0|2,0,0]=4 490 B9R1.69 CC1=CC(Br)=C(N)C=C1 3799 [2,0,0,0,0,0|2,0,0]=4 491 B9R1.69 CC1=CC(Br)=C(N)C=C1 3802 [2,0,0,0,0,0|2,0,0]=4 492 B9R1.69 CC1=CC(Br)=C(O)C=C1 4096 [2,0,0,0,0,0|2,0,0]=4 493 B9R1.69 CC1=CC(C)=C(Br)C=C1 3762 [2,0,0,0,0,0|2,0,0]=4 494 B9R1.69 CC1=CC(C)=C(Cl)C=C1 3639 [2,0,0,0,0,0|2,0,0]=4 495 B9R1.69 CC1=CC(C)=C(I)C=C1 3869 [2,0,0,0,0,0|2,0,0]=4 496 B9R1.69 CC1=CC(C)=C(N)C=C1 15152 [2,0,0,0,0,0|2,0,0]=4 497 B9R1.69 CC1=CC(C)=C(O)C=C1 21747 [2,0,0,0,0,0|2,0,0]=4 498 B9R1.69 CC1=CC(C)=C(S)C=C1 6810 [2,0,0,0,0,0|2,0,0]=4 499 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 9504 [2,0,0,0,0,0|2,0,0]=4 500 B9R1.69 CC1=CC(Cl)=C(C)C=C1 3640 [2,0,0,0,0,0|1,0,0]=3 501 B9R1.69 CC1=CC(Cl)=C(F)C=C1 3436 [2,0,0,0,0,0|2,0,0]=4 502 B9R1.69 CC1=CC(Cl)=C(I)C=C1 3656 [2,0,0,0,0,0|2,0,0]=4 503 B9R1.69 CC1=CC(Cl)=C(N)C=C1 2472 [2,0,0,0,0,0|2,0,0]=4 504 B9R1.69 CC1=CC(Cl)=C(O)C=C1 3672 [2,0,0,0,0,0|2,0,0]=4 505 B9R1.69 CC1=CC(F)=C(Br)C=C1 1604 [2,0,0,0,0,0|2,0,0]=4 506 B9R1.69 CC1=CC(F)=C(C)C=C1 35429 [2,0,0,0,0,0|1,0,0]=3 507 B9R1.69 CC1=CC(F)=C(Cl)C=C1 1611 [2,0,0,0,0,0|2,0,0]=4 508 B9R1.69 CC1=CC(F)=C(F)C=C1 1615 [2,0,0,0,0,0|2,0,0]=4 509 B9R1.69 CC1=CC(F)=C(I)C=C1 1621 [2,0,0,0,0,0|2,0,0]=4 510 B9R1.69 CC1=CC(F)=C(N)C=C1 1511 [2,0,0,0,0,0|2,0,0]=4 511 B9R1.69 CC1=CC(I)=C(C)C=C1 3875 [2,0,0,0,0,0|1,0,0]=3 512 B9R1.69 CC1=CC(I)=C(F)C=C1 1623 [2,0,0,0,0,0|2,0,0]=4 513 B9R1.69 CC1=CC(I)=C(N)C=C1 5353 [2,0,0,0,0,0|2,0,0]=4 514 B9R1.69 CC1=CC(N)=C(Br)C=C1 4337 [2,0,0,0,0,0|2,0,0]=4 515 B9R1.69 CC1=CC(N)=C(Cl)C=C1 18921 [2,0,0,0,0,0|2,0,0]=4 516 B9R1.69 CC1=CC(N)=C(F)C=C1 1507 [2,0,0,0,0,0|2,0,0]=4 517 B9R1.69 CC1=CC(N)=C(I)C=C1 20232 [2,0,0,0,0,0|2,0,0]=4 518 B9R1.69 CC1=CC(N)=C(N)C=C1 19699 [2,0,0,0,0,0|2,0,0]=4 519 B9R1.69 CC1=CC(N)=C(S)C=C1 24155 [2,0,0,0,0,0|2,0,0]=4 520 B9R1.69 CC1=CC(O)=C(Br)C=C1 25283 [2,0,0,0,0,0|1,0,0]=3 521 B9R1.69 CC1=CC(O)=C(C)C=C1 21763 [2,0,0,0,0,0|0,0,0]=2 522 B9R1.69 CC1=CC(O)=C(Cl)C=C1 3668 [2,0,0,0,0,0|1,0,0]=3 523 B9R1.69 CC1=CC(O)=C(F)C=C1 1498 [2,0,0,0,0,0|1,0,0]=3 524 B9R1.69 CC1=CC(O)=C(N)C=C1 11254 [2,0,0,0,0,0|1,0,0]=3 525 B9R1.69 CC1=CC(S)=C(C)C=C1 6811 [2,0,0,0,0,0|0,1,0]=3 526 B9R1.69 CC1=CC(S)=C(N)C=C1 18333 [2,0,0,0,0,0|1,1,0]=4 527 B9R1.69 CC1=CC=C(Br)C(O)=N1 6531 [2,0,0,0,0,0|2,0,0]=4 528 B9R1.69 CC1=CN=C(Br)C(O)=C1 5904 [2,0,0,0,0,0|2,0,0]=4 529 B9R1.69 CC1=CN=C(C)C(Br)=C1 35361 [2,0,0,0,0,0|2,0,0]=4 530 B9R1.69 CC1=CN=C(C)C(C)=C1 15901 [2,0,0,0,0,0|2,0,0]=4 531 B9R1.69 CC1=CN=C(C)C=C1Br 45193 [2,0,0,0,0,0|2,0,0]=4 532 B9R1.69 CC1=CN=C(C)N=C1O 26180 [2,0,0,0,0,0|2,0,0]=4 533 B9R1.69 CC1=CN=C(Cl)C(O)=C1 6141 [2,0,0,0,0,0|2,0,0]=4 534 B9R1.69 CC1=CN=C(N)C(O)=C1 5621 [2,0,0,0,0,0|2,0,0]=4 535 B9R1.69 NC1=C(O)C=C(Br)C=C1 10469 [2,0,0,0,0,0|2,0,0]=4 536 B9R1.69 NC1=C(O)C=C(Cl)C=C1 1478 [2,0,0,0,0,0|2,0,0]=4 537 B9R1.69 NC1=C(O)C=C(F)C=C1 2828 [2,0,0,0,0,0|2,0,0]=4 538 B9R1.69 NC1=C(O)C=C(O)C=C1 27733 [2,0,0,0,0,0|2,0,0]=4 539 B9R1.69 NC1=CC(O)=C(Cl)C=C1 21902 [2,0,0,0,0,0|2,0,0]=4 540 B9R1.69 OC1=C(Br)C=CC(Br)=C1 14527 [2,0,0,0,0,0|2,0,0]=4 541 B9R1.69 OC1=C(Br)C=CC(Cl)=C1 10956 [2,0,0,0,0,0|2,0,0]=4 542 B9R1.69 OC1=C(Br)C=CC(F)=C1 1964 [2,0,0,0,0,0|2,0,0]=4 543 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 1476 [2,0,0,0,0,0|2,0,0]=4 544 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 24852 [2,0,0,0,0,0|2,0,0]=4 545 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 3697 [2,0,0,0,0,0|2,0,0]=4 546 B9R1.69 OC1=C(Cl)C=CC(F)=C1 2146 [2,0,0,0,0,0|2,0,0]=4 547 B9R1.69 OC1=C(Cl)C=CC(I)=C1 3651 [2,0,0,0,0,0|2,0,0]=4 548 B9R1.69 OC1=C(F)C=CC(Br)=C1 1490 [2,0,0,0,0,0|2,0,0]=4 549 B9R1.69 OC1=C(F)C=CC(Cl)=C1 1492 [2,0,0,0,0,0|2,0,0]=4 550 B9R1.69 OC1=C(F)C=CC(F)=C1 3464 [2,0,0,0,0,0|2,0,0]=4 551 B9R1.69 OC1=C(F)C=CC(I)=C1 18134 [2,0,0,0,0,0|2,0,0]=4 552 B9R1.69 OC1=C(I)C=CC(Br)=C1 31124 [2,0,0,0,0,0|2,0,0]=4 553 B9R1.69 OC1=C(I)C=CC(Cl)=C1 9582 [2,0,0,0,0,0|2,0,0]=4 554 B9R1.69 OC1=C(I)C=CC(F)=C1 28089 [2,0,0,0,0,0|2,0,0]=4 555 B9R1.69 OC1=C(I)C=CC(I)=C1 28127 [2,0,0,0,0,0|2,0,0]=4 556 B9R1.69 OC1=CC(O)=C(Br)C=C1 27082 [2,0,0,0,0,0|2,0,0]=4 557 B9R1.69 OC1=CC(O)=C(Cl)C=C1 44767 [2,0,0,0,0,0|2,0,0]=4 558 B9R1.69 OC1=CC(O)=C(F)C=C1 22656 [2,0,0,0,0,0|2,0,0]=4 559 B9R1.69 OC1=CC=C(Cl)C=C1O 2215 [2,0,0,0,0,0|2,0,0]=4 560 B9R1.69 OC1=CC=C(F)C=C1O 4143 [2,0,0,0,0,0|2,0,0]=4 561 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 20531 [1,1,0,0,0,0|0,0,2]=4 562 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 31192 [1,1,0,0,0,0|1,0,1]=4 563 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 31334 [1,1,0,0,0,0|1,0,1]=4 564 B11R1.3 CC(C)C1=CC=C(NN)C=C1 7533 [1,1,0,0,0,0|1,0,0]=3 565 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 15495 [1,1,0,0,0,0|1,0,1]=4 566 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 8085 [1,1,0,0,0,0|1,0,1]=4 567 B11R1.3 CN(C)C1=CC=C(CO)C=C1 36061 [1,1,0,0,0,0|1,0,0]=3 568 B11R1.3 CN(C)C1=NC=C(CN)C=C1 34770 [1,1,0,0,0,0|2,0,0]=4 569 B11R1.3 COC1=CC=C(C(C)=O)C=C1 3324 [1,1,0,0,0,0|1,0,1]=4 570 B11R1.3 COC1=CC=C(N(C)C)C=C1 16956 [1,1,0,0,0,0|1,0,0]=3 571 B11R1.3 COc1ccc([C@@H](C)N)cc1 9920 [1,1,0,0,0,0|1,0,0]=3 572 B11R1.3 COc1ccc([C@H](C)N)cc1 9919 [1,1,0,0,0,0|1,0,0]=3 573 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 3333 [1,1,0,0,0,0|1,0,1]=4 574 B11R1.3 ClCC1=CC=C(C(Cl)Cl)C=C1 31325 [1,1,0,0,0,0|2,0,0]=4 575 B11R1.3 [C-]#[N+]C1=CC=C([C@@H](C)O)C=C1 14238 [1,1,0,0,0,0|1,0,1]=4 576 B11R1.3 [C-]#[N+]C1=CC=C([C@H](C)O)C=C1 14243 [1,1,0,0,0,0|1,0,1]=4 577 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 12522 [1,1,0,0,0,0|1,0,0]=3 578 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 3974 [1,1,0,0,0,0|1,0,0]=3 579 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 21472 [1,1,0,0,0,0|1,0,0]=3 580 B11R1.19 CC(C)(C)C1=CC=C(S)C=C1 6846 [1,1,0,0,0,0|1,0,0]=3 581 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 16914 [1,1,0,0,0,0|1,0,0]=3 582 B11R1.19 CC(C)(O)C1=CC=C(N)N=C1 30340 [1,1,0,0,0,0|2,0,0]=4 583 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 26273 [1,1,0,0,0,0|2,0,0]=4 584 B11R1.19 CC(F)(F)C1=CC=C(Cl)C=C1 44754 [1,1,0,0,0,0|2,0,0]=4 585 B11R1.19 CC1=CC=C(C(C)(C)C)C=C1 36092 [1,1,0,0,0,0|0,0,0]=2 586 B11R1.19 CC1=CC=C(C(F)(F)F)C=C1 1659 [1,1,0,0,0,0|2,0,0]=4 587 B11R1.19 CC1=CC=C(S(C)(=O)=O)C=C1 18694 [1,1,0,0,0,0|2,0,0]=4 588 B11R1.19 C[Si](C)(C)c1ccc(F)cc1 28497 [1,1,0,0,0,0|1,1,0]=4 589 B11R1.21 CC(=O)C1=CC(Br)=C(C)C=C1 29264 [1,1,0,0,0,0|1,0,1]=4 590 B11R1.21 CC(=O)C1=CC(F)=C(C)C=C1 29155 [1,1,0,0,0,0|1,0,1]=4 591 B11R1.21 CC(=O)C1=CC(O)=C(C)C=C1 31188 [1,1,0,0,0,0|1,0,1]=4 592 B11R1.21 CC(=O)c1ccc(C)c(O)c1 24105 [1,1,0,0,0,0|1,0,1]=4 593 B11R1.21 CC(C)C1=CC(Br)=C(N)C=C1 17446 [1,1,0,0,0,0|1,0,0]=3 594 B11R1.21 CC(C)C1=CC(O)=C(I)C=C1 34596 [1,1,0,0,0,0|1,0,0]=3 595 B11R1.21 CC(C)C1=CC=C(O)C(O)=C1 26367 [1,1,0,0,0,0|1,0,0]=3 596 B11R1.21 CC1=C(Br)C=CC(N(C)C)=C1 5345 [1,1,0,0,0,0|2,0,0]=4 597 B11R1.21 CC1=C(N)C=C(C(C)C)C=C1 25919 [1,1,0,0,0,0|0,0,0]=2 598 B11R1.21 CC1=C(N)C=C(C(C)C)C=C1 28331 [1,1,0,0,0,0|0,0,0]=2 599 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 10329 [1,1,0,0,0,0|0,0,0]=2 600 B11R1.21 CN(C)C1=CC(F)=C(F)C=C1 5241 [1,1,0,0,0,0|2,0,0]=4 601 B11R1.21 CN(C)C1=CC(F)=C(I)C=C1 28131 [1,1,0,0,0,0|2,0,0]=4 602 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 7423 [1,1,0,0,0,0|1,0,1]=4 603 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 22351 [1,1,0,0,0,0|1,0,1]=4 604 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 23893 [1,1,0,0,0,0|1,0,1]=4 605 B11R1.22 CC1=CC=C([C@H](O)CN)C=C1 19376 [1,1,0,0,0,0|1,0,0]=3 606 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 20971 [1,1,0,0,0,0|1,0,1]=4 607 B11R1.22 CC[C@@H](O)C1=CC=C(Br)C=C1 15566 [1,1,0,0,0,0|2,0,0]=4 608 B11R1.22 CC[C@@H](O)C1=CC=C(Cl)C=C1 15579 [1,1,0,0,0,0|2,0,0]=4 609 B11R1.22 CC[C@@H](O)C1=CC=C(F)C=C1 15586 [1,1,0,0,0,0|2,0,0]=4 610 B11R1.22 COC(=O)C1=CC=C(C)C=C1 15479 [1,1,0,0,0,0|1,0,1]=4 611 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 19370 [1,1,0,0,0,0|2,0,0]=4 612 B11R1.22 NCC(O)C1=CC=C(O)C=C1 18242 [1,1,0,0,0,0|2,0,0]=4 613 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 27665 [1,1,0,0,0,0|2,0,0]=4 614 B11R1.37 CCC1=C(C=O)C=C(Br)C=C1 30974 [1,1,0,0,0,0|1,0,1]=4 615 B11R1.37 COC1=C(C#N)C=CC(C)=C1 28757 [1,1,0,0,0,0|1,0,1]=4 616 B11R1.37 COC1=C(C=O)C=CC(C)=C1 18122 [1,1,0,0,0,0|1,0,1]=4 617 B11R1.37 COC1=C(CBr)C=CC(Br)=C1 31309 [1,1,0,0,0,0|2,0,0]=4 618 B11R1.37 COC1=C(CBr)C=CC(F)=C1 31307 [1,1,0,0,0,0|2,0,0]=4 619 B11R1.37 COC1=C(CN)C=CC(F)=C1 31244 [1,1,0,0,0,0|2,0,0]=4 620 B11R1.37 COC1=C(CO)C=C(Br)C=C1 4888 [1,1,0,0,0,0|2,0,0]=4 621 B11R1.37 COC1=C(CO)C=C(F)C=C1 27472 [1,1,0,0,0,0|2,0,0]=4 622 B11R1.37 COC1=C(CO)C=CC(F)=C1 31306 [1,1,0,0,0,0|2,0,0]=4 623 B11R1.37 COC1=C(OC)C=C(Br)C=C1 3037 [1,1,0,0,0,0|2,0,0]=4 624 B11R1.37 COC1=C(OC)C=C(C)C=C1 23595 [1,1,0,0,0,0|1,0,0]=3 625 B11R1.37 COC1=C(OC)C=C(Cl)C=C1 25469 [1,1,0,0,0,0|2,0,0]=4 626 B11R1.37 COC1=C(OC)C=C(I)C=C1 3052 [1,1,0,0,0,0|2,0,0]=4 627 B11R1.37 COC1=C(OC)C=C(N)C=C1 22907 [1,1,0,0,0,0|2,0,0]=4 628 B11R1.37 COC1=C(OC)C=C(O)C=C1 4113 [1,1,0,0,0,0|2,0,0]=4 629 B11R1.37 COC1=C(OC)C=C(S)C=C1 6823 [1,1,0,0,0,0|2,0,0]=4 630 B11R1.37 COC1=CC=C(F)C=C1OC 3048 [1,1,0,0,0,0|2,0,0]=4 631 B11R1.37 OCC1=CC=C(F)C=C1CO 2198 [1,1,0,0,0,0|2,0,0]=4 632 B11R1.81 CC1=CC(F)=C(CC#N)C=C1 4171 [1,1,0,0,0,0|1,0,1]=4 633 B11R1.81 CCCC1=C(O)C=C(O)C=C1 25562 [1,1,0,0,0,0|1,0,0]=3 634 B11R1.81 CCOC1=C(Cl)C=C(Cl)C=C1 9513 [1,1,0,0,0,0|2,0,0]=4 635 B11R1.81 CCOC1=C(Cl)C=C(F)C=C1 3155 [1,1,0,0,0,0|2,0,0]=4 636 B11R1.81 CCOC1=C(F)C=C(Cl)C=C1 3163 [1,1,0,0,0,0|2,0,0]=4 637 B11R1.81 CCOC1=C(N)C=C(N)C=C1 3168 [1,1,0,0,0,0|2,0,0]=4 638 B11R1.81 CNCC1=C(Cl)C=C(Cl)C=C1 22904 [1,1,0,0,0,0|2,0,0]=4 639 B11R1.81 COCC1=C(N)C=C(Br)C=C1 31052 [1,1,0,0,0,0|2,0,0]=4 640 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 31586 [1,1,0,0,0,0|2,0,0]=4 641 B11R1.277 CC1=CC(O)=C(C=O)C=C1Cl 30425 [1,1,0,0,0,0|1,0,1]=4 642 B11R1.277 CC1=CC(O)=C(C=O)C=C1F 28987 [1,1,0,0,0,0|1,0,1]=4 643 B11R1.277 COC1=C(O)C=C(Br)C(Cl)=C1 34577 [1,1,0,0,0,0|2,0,0]=4 644 B11R1.277 COC1=C(O)C=C(F)C(Br)=C1 28355 [1,1,0,0,0,0|2,0,0]=4 645 B11R1.278 COC1=C(F)C(F)=C(C)C=C1 7139 [1,1,0,0,0,0|2,0,0]=4 646 B11R1.279 COC1=C(C)C=C(CO)C=C1 24130 [1,1,0,0,0,0|2,0,0]=4 647 B11R1.279 COC1=C(Cl)C=C(CBr)C=C1 31299 [1,1,0,0,0,0|2,0,0]=4 648 B11R1.279 COC1=C(F)C=C(CBr)C=C1 4923 [1,1,0,0,0,0|2,0,0]=4 649 B11R1.279 COC1=C(O)C=C(C#N)C=C1 4806 [1,1,0,0,0,0|1,0,1]=4 650 B11R1.279 COC1=C(O)C=C(C=O)C=C1 7770 [1,1,0,0,0,0|1,0,1]=4 651 B11R1.279 COC1=C(O)C=C(CO)C=C1 15050 [1,1,0,0,0,0|1,0,0]=3 652 B11R1.279 COC1=CC(Br)=C(CBr)C=C1 31331 [1,1,0,0,0,0|2,0,0]=4 653 B11R1.279 COC1=CC(Br)=C(OC)C=C1 19785 [1,1,0,0,0,0|2,0,0]=4 654 B11R1.279 COC1=CC(C)=C(OC)C=C1 4543 [1,1,0,0,0,0|2,0,0]=4 655 B11R1.279 COC1=CC(Cl)=C(CBr)C=C1 31270 [1,1,0,0,0,0|2,0,0]=4 656 B11R1.279 COC1=CC(F)=C(CBr)C=C1 24293 [1,1,0,0,0,0|2,0,0]=4 657 B11R1.279 COC1=CC(F)=C(CCl)C=C1 25838 [1,1,0,0,0,0|2,0,0]=4 658 B11R1.279 COC1=CC(F)=C(CO)C=C1 7733 [1,1,0,0,0,0|2,0,0]=4 659 B11R1.279 COC1=CC(F)=C(OC)C=C1 3050 [1,1,0,0,0,0|2,0,0]=4 660 B11R1.279 COC1=CC(N)=C(OC)C=C1 25396 [1,1,0,0,0,0|2,0,0]=4 661 B11R1.279 COC1=CC(O)=C(C#N)C=C1 22496 [1,1,0,0,0,0|1,0,1]=4 662 B11R1.279 COC1=CC(O)=C(OC)C=C1 27372 [1,1,0,0,0,0|1,0,0]=3 663 B11R1.279 COC1=CC(S)=C(OC)C=C1 6852 [1,1,0,0,0,0|1,1,0]=4 664 B11R1.279 COC1=CC=C(C=O)C(O)=C1 8148 [1,1,0,0,0,0|1,0,1]=4 665 B11R1.279 COc1ccc(CN)cc1F 31259 [1,1,0,0,0,0|2,0,0]=4 666 B11R1.464 CC1=CC(C)=C(CBr)C(C)=C1 22050 [1,1,0,0,0,0|2,0,0]=4 667 B11R1.464 CC1=CC(C)=C(CCl)C(C)=C1 7456 [1,1,0,0,0,0|2,0,0]=4 668 B11R1.464 CC1=CC(C)=C(CN)C(C)=C1 7408 [1,1,0,0,0,0|2,0,0]=4 669 B11R1.464 CC1=CC(C)=C(CN)C(O)=N1 28163 [1,1,0,0,0,0|2,0,0]=4 670 B11R1.464 CC1=CC(C)=C(CO)C(C)=C1 7455 [1,1,0,0,0,0|2,0,0]=4 671 B11R1.464 CC1=CC(O)=C(C=O)C(C)=C1 28415 [1,1,0,0,0,0|1,0,1]=4 672 B11R1.464 COC1=C(C)C=C(C)C=C1C 28391 [1,1,0,0,0,0|2,0,0]=4 673 B11R1.464 COC1=C(O)C=C(F)C=C1F 33435 [1,1,0,0,0,0|2,0,0]=4 674 B11R1.53 CC(C)C1=C(C=O)C=CC=C1 27833 [1,1,0,0,0,0|0,0,1]=3 675 B11R1.53 COC1=C(C(C)=O)C=CC=C1 4278 [1,1,0,0,0,0|1,0,1]=4 676 B11R1.53 COC1=C(C(C)O)C=CC=C1 25006 [1,1,0,0,0,0|1,0,0]=3 677 B11R1.53 COC1=C([C@@H](C)N)C=CC=C1 24748 [1,1,0,0,0,0|1,0,0]=3 678 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 24747 [1,1,0,0,0,0|1,0,0]=3 679 B11R1.53 COC1=NC=CN=C1C(C)C 8619 [1,1,0,0,0,0|2,0,0]=4 680 B11R1.87 CC(C)(C)C1=C(N)C=CC=C1 20188 [1,1,0,0,0,0|1,0,0]=3 681 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 18555 [1,1,0,0,0,0|1,0,0]=3 682 B11R1.87 CC(C)(O)C1=CC=CN=C1F 21047 [1,1,0,0,0,0|2,0,0]=4 683 B11R1.87 CC1=C(C(C)(C)C)C=CC=C1 27429 [1,1,0,0,0,0|1,0,0]=3 684 B11R1.87 OC1=C(C(F)(F)F)C=CC=C1 10389 [1,1,0,0,0,0|2,0,0]=4 685 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O 24613 [1,1,0,0,0,0|1,0,1]=4 686 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1O 31212 [1,1,0,0,0,0|1,0,1]=4 687 B11R1.156 CC(=O)C1=C(O)C=CC=C1C 31224 [1,1,0,0,0,0|1,0,1]=4 688 B11R1.156 CC(=O)C1=C(O)C=CC=C1O 3378 [1,1,0,0,0,0|1,0,1]=4 689 B11R1.156 CC(=O)c1c(O)cccc1F 28251 [1,1,0,0,0,0|1,0,1]=4 690 B11R1.156 CC(C)C1=C(O)C=CC=C1N 27651 [1,1,0,0,0,0|0,0,0]=2 691 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 29262 [1,1,0,0,0,0|1,0,1]=4 692 B11R1.159 CC(=O)C1=C(O)C(Cl)=CC=C1 31195 [1,1,0,0,0,0|1,0,1]=4 693 B11R1.159 CC(=O)C1=C(O)C(F)=CC=C1 19786 [1,1,0,0,0,0|1,0,1]=4 694 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 3281 [1,1,0,0,0,0|1,0,1]=4 695 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 33767 [1,1,0,0,0,0|1,0,1]=4 696 B11R1.159 CC(=O)c1cccc(N)c1O 10346 [1,1,0,0,0,0|1,0,1]=4 697 B11R1.159 CC(C)C1=C(O)C(O)=CC=C1 34649 [1,1,0,0,0,0|0,0,0]=2 698 B11R1.159 CC(C)C1=CC=CC(Br)=C1O 33834 [1,1,0,0,0,0|0,0,0]=2 699 B11R1.159 CC(C)C1=CC=CC(Cl)=C1O 28112 [1,1,0,0,0,0|0,0,0]=2 700 B11R1.159 CC(C)C1=CC=CC(O)=C1F 27792 [1,1,0,0,0,0|1,0,0]=3 701 B11R1.159 CC1=CC=CC(C(C)C)=C1N 4031 [1,1,0,0,0,0|1,0,0]=3 702 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 3913 [1,1,0,0,0,0|1,0,1]=4 703 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 16936 [1,1,0,0,0,0|1,0,1]=4 704 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 3353 [1,1,0,0,0,0|1,0,1]=4 705 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 3356 [1,1,0,0,0,0|1,0,1]=4 706 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 17597 [1,1,0,0,0,0|1,0,1]=4 707 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 3377 [1,1,0,0,0,0|1,0,1]=4 708 B11R1.167 CC(C)C1=C(O)C=CC(Br)=C1 34492 [1,1,0,0,0,0|0,0,0]=2 709 B11R1.167 CC(C)C1=C(O)C=CC(Cl)=C1 27613 [1,1,0,0,0,0|0,0,0]=2 710 B11R1.167 CC(C)N1C=C(Br)C=CC1=O 34479 [1,1,0,0,0,0|1,0,1]=4 711 B11R1.167 CC(O)C1=C(F)C=CC(Br)=C1 20348 [1,1,0,0,0,0|2,0,0]=4 712 B11R1.167 CC1=C(C(C)C)C=C(Br)C=C1 34618 [1,1,0,0,0,0|1,0,0]=3 713 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 21422 [1,1,0,0,0,0|1,0,1]=4 714 B11R1.222 CCC(C)C1=C(N)C=CC=C1 28284 [1,1,0,0,0,0|1,0,0]=3 715 B11R1.222 CCC(O)C1=C(F)C=CC=C1 19915 [1,1,0,0,0,0|2,0,0]=4 716 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 19367 [1,1,0,0,0,0|2,0,0]=4 717 B11R1.222 NC[C@@H](O)C1=C(Cl)C=CC=C1 19368 [1,1,0,0,0,0|2,0,0]=4 718 B11R1.222 OC[C@@H](O)C1=C(Cl)C=CC=C1 16150 [1,1,0,0,0,0|2,0,0]=4 719 B13R1.51 CC(C)OC1=C(C#N)C=C(Br)C=C1 30803 [0,1,0,0,0,1|2,0,0]=4 720 B13R1.99 COC1=CC(OC)=C(C(C)=O)C=C1 10582 [0,2,0,0,0,0|1,0,1]=4 721 B13R1.165 CC1=CC([N+](=O)[O-])=C(C(C)C)C=C1 23880 [0,2,0,0,0,0|0,0,1]=3 722 B13R1.165 CN(C)C1=C(C(=O)O)C=C(N)C=C1 21943 [0,2,0,0,0,0|2,0,0]=4 723 B13R1.2065 COC(=O)C1=C(OC)C=C(C)C=C1 30553 [0,2,0,0,0,0|1,0,1]=4 724 B13R1.96 COC1=CC(O)=C(C(F)(F)F)C=C1 33441 [0,2,0,0,0,0|2,0,0]=4 725 B13R1.652 COC1=C(Br)C=C(C(C)C)C(F)=C1 26353 [0,2,0,0,0,0|1,0,0]=3 726 B13R1.120 CC(C)c1ccc([N+](=O)[O-])cc1Br 27501 [0,2,0,0,0,0|2,0,0]=4 727 B13R1.961 COC(OC)C1=C(F)C=C(Br)C=C1 5232 [0,2,0,0,0,0|2,0,0]=4 728 B13R1.961 COC(OC)C1=C(F)C=C(I)C=C1 5256 [0,2,0,0,0,0|2,0,0]=4 729 B11R2.34 BrC1=CC=C(C2CC2)N=C1 22082 [1,0,0,1,0,0|2,0,0]=4 730 B11R2.34 BrC1=CC=C([C@@H]2CO2)C=C1 5705 [1,0,0,1,0,0|2,0,0]=4 731 B11R2.34 BrC1=CC=C([C@H]2CO2)C=C1 5704 [1,0,0,1,0,0|2,0,0]=4 732 B11R2.34 BrC1=NC=C(C2CC2)C=C1 27621 [1,0,0,1,0,0|2,0,0]=4 733 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 18166 [1,0,0,1,0,0|2,0,0]=4 734 B11R2.34 FC1=CC=C([C@H]2CO2)C=C1 18172 [1,0,0,1,0,0|2,0,0]=4 735 B11R2.34 NC1=CC=C(C2CC2)C=C1 19700 [1,0,0,1,0,0|1,0,0]=3 736 B11R2.34 OC1=CC=C(C2CC2)C=C1 17543 [1,0,0,1,0,0|1,0,0]=3 737 B11R2.36 BrC1=CC2=C(C=C1)CCO2 28031 [1,0,0,1,0,0|1,0,0]=3 738 B11R2.36 BrC1=CC2=C(C=C1)OCO2 3738 [1,0,0,1,0,0|2,0,0]=4 739 B11R2.36 BrC1=CC=C2CCCC2=C1 34435 [1,0,0,1,0,0|2,0,0]=4 740 B11R2.36 BrC1=CC=C2CCNC2=C1 22223 [1,0,0,1,0,0|2,0,0]=4 741 B11R2.36 BrC1=CC=C2CCNC2=C1 8320 [1,0,0,1,0,0|2,0,0]=4 742 B11R2.36 CC1=CC=C2CNCC2=C1 33793 [1,0,0,1,0,0|2,0,0]=4 743 B11R2.36 ClC1=CC2=C(C=C1)OCO2 3620 [1,0,0,1,0,0|2,0,0]=4 744 B11R2.36 FC1=CC=C2CCNC2=C1 34355 [1,0,0,1,0,0|2,0,0]=4 745 B11R2.36 IC1=CC2=C(C=C1)OCO2 33795 [1,0,0,1,0,0|2,0,0]=4 746 B11R2.36 NC1=CC2=C(C=C1)OCO2 22150 [1,0,0,1,0,0|2,0,0]=4 747 B11R2.36 OC1=CC2=C(C=C1)CCO2 32303 [1,0,0,1,0,0|1,0,0]=3 748 B11R2.36 OC1=CC2=C(C=C1)OCO2 15359 [1,0,0,1,0,0|2,0,0]=4 749 B11R2.36 SC1=CC2=C(C=C1)OCO2 15612 [1,0,0,1,0,0|2,0,0]=4 750 B11R2.1 CC1C=CC2=CC=CC=C21 15080 [1,0,0,1,0,0|1,0,1]=4 751 B11R2.1 CC1CNC2=CC=CC=C21 15858 [1,0,0,1,0,0|1,0,0]=3 752 B11R2.1 NC1CCC2=CC=CC=C21 10981 [1,0,0,1,0,0|2,0,0]=4 753 B11R2.1 NC1COC2=NC=CC=C21 34572 [1,0,0,1,0,0|2,0,0]=4 754 B11R2.1 N[C@@H]1CCC2=CC=CC=C21 21741 [1,0,0,1,0,0|2,0,0]=4 755 B11R2.1 N[C@H]1CCc2ccccc21 12577 [1,0,0,1,0,0|2,0,0]=4 756 B11R2.1 N[C@H]1CCc2ccccc21 23853 [1,0,0,1,0,0|2,0,0]=4 757 B11R2.1 O=C1COC2=C1C=CC=C2 7023 [1,0,0,1,0,0|1,0,1]=4 758 B13R2.3051 CC1(C)OC2=C(C=C(N)C=C2)O1 34264 [0,0,0,1,0,1|1,0,0]=3 759 B13R2.3683 C[C@@H]1CCC2=CC(F)=CC=C2N1 17279 [0,0,0,1,0,1|2,0,0]=4 760 B13R2.3683 C[C@H]1CCc2cc(F)ccc2N1 17280 [0,0,0,1,0,1|2,0,0]=4 761 B13R2.5397 CC1=CC(C)=C2C=C(C)CC2=C1 5430 [0,0,0,1,0,1|1,0,1]=4 762 B13R2.5179 NC1CCOC2=CC(Br)=CC=C21 31660 [0,1,0,1,0,0|2,0,0]=4 763 B13R2.5179 NC1CCOC2=CC(F)=CC=C21 25816 [0,1,0,1,0,0|2,0,0]=4 764 B13R2.5179 OC1CCOC2=CC(Br)=CC=C21 31659 [0,1,0,1,0,0|2,0,0]=4 765 B13R2.2130 COC1=CC2=C(C=C1)C(=O)CO2 18002 [0,1,0,1,0,0|1,0,1]=4 766 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 3342 [1,0,0,0,0,1|1,0,1]=4 767 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 27490 [1,0,0,0,0,1|1,0,0]=3 768 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 34794 [1,0,0,0,0,1|1,0,0]=3 769 B11R1.20 CC(C)OC1=CC=C(N)C=C1 28330 [1,0,0,0,0,1|1,0,0]=3 770 B11R1.20 CC(C)OC1=CC=C(O)C=C1 34515 [1,0,0,0,0,1|1,0,0]=3 771 B11R1.20 CC(C)OC1=CN=C(Br)C=C1 34828 [1,0,0,0,0,1|2,0,0]=4 772 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 22060 [1,0,0,0,0,1|2,0,0]=4 773 B11R1.20 CC(N)CC1=CC=C(F)C=C1 19961 [1,0,0,0,0,1|2,0,0]=4 774 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 3830 [1,0,0,0,0,1|1,0,1]=4 775 B11R1.86 CC(C)OC1=C(Br)C=CC=C1 3828 [1,0,0,0,0,1|1,0,0]=3 776 B11R1.86 CC(C)OC1=C(O)C=CC=C1 13205 [1,0,0,0,0,1|0,0,0]=2 777 B11R1.86 CC(C)OC1=NC=CC=C1Br 6576 [1,0,0,0,0,1|2,0,0]=4 778 B11R1.86 CC(C)OC1=NC=CC=C1I 16561 [1,0,0,0,0,1|2,0,0]=4 779 B11R1.86 CC(C)SC1=C(N)C=CC=C1 31985 [1,0,0,0,0,1|1,0,0]=3 780 B11R1.74 CN(C)C1=CC(O)=CC(O)=C1 22947 [0,0,0,0,1,1|2,0,0]=4