0 B9R1.3 C1=C(C(=C(C=N1)Cl)Br)Cl 8892 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.3 C1=C(C(=C(C=N1)Cl)N)Cl 5218 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.3 C1=C(C(=O)C(=CN1)Br)Br 8526 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.3 C1=CC(=C(C(=C1)Br)Cl)F 5658 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.3 C1=CC(=C(C(=C1)Br)F)Cl 5208 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.3 C1=CC(=C(C(=C1)Br)F)F 5097 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.3 C1=CC(=C(C(=C1)Br)I)Cl B0109 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.3 C1=CC(=C(C(=C1)Br)N)F 8782 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)F 8207 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)S 5293 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.3 C1=CC(=C(C(=C1)Cl)F)Cl 6165 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.3 C1=CC(=C(C(=C1)Cl)F)N 5333 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.3 C1=CC(=C(C(=C1)Cl)F)N 6188 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.3 C1=CC(=C(C(=C1)Cl)F)O 5115 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.3 C1=CC(=C(C(=C1)Cl)N)Cl 5390 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.3 C1=CC(=C(C(=C1)Cl)O)F 5578 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.3 C1=CC(=C(C(=C1)F)Br)F 5329 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.3 C1=CC(=C(C(=C1)F)F)F 9474 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.3 C1=CC(=C(C(=C1)F)F)N 6062 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.3 C1=CC(=C(C(=C1)F)I)F 9527 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.3 C1=CC(=C(C(=C1)F)O)F 5418 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.3 C1=CC(=C(C(=C1)F)O)O 6478 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.3 C1=CC(=C(C(=C1)O)O)O 6821 [0,0,0,0,0,0|2,0,0]=2 23 B9R1.3 C1=CN=C(C(=C1N)Br)Cl 10232 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.3 CC1=C(C(=CC=C1)Br)F 8654 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.3 CC1=C(C(=CC=C1)C)Br 8575 [0,0,0,0,0,0|1,0,0]=1 26 B9R1.3 CC1=C(C(=CC=C1)C)O 5710 [0,0,0,0,0,0|0,0,0]=0 27 B9R1.3 CC1=C(C(=CC=C1)F)Br 10618 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.3 CC1=C(C(=CC=C1)F)C 6112 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.3 CC1=C(C(=CC=C1)F)F 9232 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.3 CC1=C(C(=CC=C1)N)F 5245 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.3 CC1=C(C(=NC=C1)Cl)N 5231 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.3 CC1=C(C(=O)C=CO1)O 5716 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.3 CC1=C(C=CC=C1Br)Cl 5544 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.3 CC1=C(C=CC=C1Br)F 6229 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.3 CC1=C(C=CC=C1Cl)O 8169 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.3 CC1=C(C=CC=C1F)N 10395 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.3 CC1=C(C=CC=C1F)O 9587 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.3 CC1=C(C=CC=C1I)Cl 8102 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.3 c1cc(c(c(c1)Cl)I)F C0095 [0,0,0,0,0,0|3,0,0]=3 40 B8R1.4 C1=C(C=NC=C1Br)Br 5217 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.4 C1=C(C=NC=C1Br)F 5671 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.4 C1=C(C=NC=C1Br)O 10431 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.4 C1=C(C=NC=C1Cl)Cl 10175 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.4 C1=C(C=NC=C1Cl)F 8265 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.4 C1=C(C=NC=C1F)F 5685 [1,0,0,0,0,0|3,0,0]=4 46 B8R1.4 C1=C(C=NC=C1F)N 6698 [1,0,0,0,0,0|3,0,0]=4 47 B8R1.4 C1=CC(=CC(=C1)Br)Br 5153 [1,0,0,0,0,0|2,0,0]=3 48 B8R1.4 C1=CC(=CC(=C1)Br)N 8582 [1,0,0,0,0,0|2,0,0]=3 49 B8R1.4 C1=CC(=CC(=C1)Br)N 8583 [1,0,0,0,0,0|2,0,0]=3 50 B8R1.4 C1=CC(=CC(=C1)Br)S 5283 [1,0,0,0,0,0|2,0,0]=3 51 B8R1.4 C1=CC(=CC(=C1)Cl)O 10156 [1,0,0,0,0,0|2,0,0]=3 52 B8R1.4 C1=CC(=CC(=C1)F)F 6015 [1,0,0,0,0,0|2,0,0]=3 53 B8R1.4 C1=CC(=CC(=C1)I)Br 5550 [1,0,0,0,0,0|2,0,0]=3 54 B8R1.4 C1=CC(=CC(=C1)I)F 8911 [1,0,0,0,0,0|2,0,0]=3 55 B8R1.4 C1=CC(=CC(=C1)I)O 9915 [1,0,0,0,0,0|2,0,0]=3 56 B8R1.4 C1=CC(=NC(=C1)Br)Br 5221 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.4 C1=CC(=NC(=C1)Br)Cl 8069 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.4 C1=CC(=NC(=C1)Cl)F 5672 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.4 C1=CC(=NC(=C1)Cl)N 5316 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.4 C1=CC(=NC(=C1)F)F 10361 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.4 C1=CC(=NC(=C1)F)N 5229 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.4 C1=CC(=NC(=C1)N)N 6752 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.4 C1=CC(=O)NC(=C1)Cl 10464 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.4 C1=CC(=O)NC(=C1)F 6665 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.4 C1=CN=C(C=C1Br)Br 5241 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.4 C1=CN=C(C=C1Br)Cl 8808 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.4 C1=CN=C(C=C1Br)F 6500 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.4 C1=CN=C(C=C1Br)N 8459 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.4 C1=CN=C(C=C1Cl)Cl 5661 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.4 C1=CN=C(C=C1I)F 8362 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.4 C1=CN=C(C=C1N)Br 9320 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.4 C1=CN=C(C=C1N)Cl 5451 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.4 C1=CNC(=O)C=C1O 10547 [1,0,0,0,0,0|3,0,0]=4 74 B8R1.4 CC1=CC(=CC=C1)Br 9432 [1,0,0,0,0,0|1,0,0]=2 75 B8R1.4 CC1=CC(=CC=C1)I 8771 [1,0,0,0,0,0|1,0,0]=2 76 B8R1.4 CC1=CC(=CN=C1)N 8645 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.4 CC1=CC(=NC=C1)Br 9012 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.4 CC1=CC(=NC=C1)Cl 5069 [1,0,0,0,0,0|2,0,0]=3 79 B8R1.4 CC1=CC(=NC=C1)F 5561 [1,0,0,0,0,0|2,0,0]=3 80 B8R1.4 CC1=CC(=NC=C1)F 6308 [1,0,0,0,0,0|2,0,0]=3 81 B8R1.4 CC1=NC(=CC=C1)Br 5660 [1,0,0,0,0,0|2,0,0]=3 82 B8R1.4 CC1=NC(=CC=C1)Cl 5070 [1,0,0,0,0,0|2,0,0]=3 83 B8R1.4 CC1=NC(=CC=C1)F 9658 [1,0,0,0,0,0|2,0,0]=3 84 B8R1.4 CC1=NC(=NC=C1)Br B1240 [1,0,0,0,0,0|3,0,0]=4 85 B8R1.4 CC1=NC(=NC=C1)Cl 5673 [1,0,0,0,0,0|3,0,0]=4 86 B8R1.4 CC1=NC=CC(=C1)N 6613 [1,0,0,0,0,0|2,0,0]=3 87 B8R1.4 Cc1ccnc(n1)N A0244 [1,0,0,0,0,0|3,0,0]=4 88 B8R1.4 Cc1ccnc(n1)O H0124 [1,0,0,0,0,0|3,0,0]=4 89 B8R1.4 c1cc(cc(c1)Br)F B0235 [1,0,0,0,0,0|2,0,0]=3 90 B8R1.5 C1=CC(=C(N=C1)Br)Br 9457 [1,0,0,0,0,0|3,0,0]=4 91 B8R1.5 C1=CC(=C(N=C1)Cl)Br 9039 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.5 C1=CC(=C(N=C1)Cl)Cl 5463 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.5 C1=CC(=C(N=C1)Cl)Cl 6656 [1,0,0,0,0,0|3,0,0]=4 94 B8R1.5 C1=CC(=C(N=C1)Cl)F 5206 [1,0,0,0,0,0|3,0,0]=4 95 B8R1.5 C1=CC(=C(N=C1)Cl)I 8613 [1,0,0,0,0,0|3,0,0]=4 96 B8R1.5 C1=CC(=C(N=C1)Cl)N 6694 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.5 C1=CC(=C(N=C1)Cl)O 6690 [1,0,0,0,0,0|2,0,0]=3 98 B8R1.5 C1=CC(=C(N=C1)F)Cl 8500 [1,0,0,0,0,0|3,0,0]=4 99 B8R1.5 C1=CC(=C(N=C1)F)F 5471 [1,0,0,0,0,0|3,0,0]=4 100 B8R1.5 C1=CC(=C(N=C1)N)Br 6715 [1,0,0,0,0,0|3,0,0]=4 101 B8R1.5 C1=CC(=C(N=C1)N)Cl 10389 [1,0,0,0,0,0|3,0,0]=4 102 B8R1.5 C1=CC(=C(N=C1)N)F 10619 [1,0,0,0,0,0|3,0,0]=4 103 B8R1.5 C1=CC(=C(N=C1)N)N 9712 [1,0,0,0,0,0|3,0,0]=4 104 B8R1.5 C1=CC=C(C(=C1)Br)Br 5382 [1,0,0,0,0,0|2,0,0]=3 105 B8R1.5 C1=CC=C(C(=C1)Br)I 6003 [1,0,0,0,0,0|2,0,0]=3 106 B8R1.5 C1=CC=C(C(=C1)Cl)Br 9010 [1,0,0,0,0,0|2,0,0]=3 107 B8R1.5 C1=CC=C(C(=C1)Cl)Cl 5752 [1,0,0,0,0,0|2,0,0]=3 108 B8R1.5 C1=CC=C(C(=C1)F)Br 6002 [1,0,0,0,0,0|2,0,0]=3 109 B8R1.5 C1=CC=C(C(=C1)F)Cl 10274 [1,0,0,0,0,0|2,0,0]=3 110 B8R1.5 C1=CC=C(C(=C1)F)Cl 6006 [1,0,0,0,0,0|2,0,0]=3 111 B8R1.5 C1=CC=C(C(=C1)F)F 6007 [1,0,0,0,0,0|2,0,0]=3 112 B8R1.5 C1=CC=C(C(=C1)F)F 8369 [1,0,0,0,0,0|2,0,0]=3 113 B8R1.5 C1=CC=C(C(=C1)N)Br 5510 [1,0,0,0,0,0|2,0,0]=3 114 B8R1.5 C1=CC=C(C(=C1)N)F 6030 [1,0,0,0,0,0|2,0,0]=3 115 B8R1.5 C1=CC=C(C(=C1)N)I 9774 [1,0,0,0,0,0|2,0,0]=3 116 B8R1.5 C1=CC=C(C(=C1)O)Br 8498 [1,0,0,0,0,0|1,0,0]=2 117 B8R1.5 C1=CN=CC(=C1Br)Cl 6714 [1,0,0,0,0,0|3,0,0]=4 118 B8R1.5 C1=CN=CC(=C1Cl)Cl 6626 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.5 C1=CN=CC(=C1Cl)F 6867 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.5 C1=CN=CC(=C1I)F 8281 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.5 C1=CN=CC(=C1N)Br 9751 [1,0,0,0,0,0|3,0,0]=4 122 B8R1.5 C1=CN=CC(=C1N)N 9425 [1,0,0,0,0,0|3,0,0]=4 123 B8R1.5 C1=CNC=C(C1=O)N 9533 [1,0,0,0,0,0|2,0,1]=4 124 B8R1.5 CC1=C(C=CC=N1)Br 5675 [1,0,0,0,0,0|2,0,0]=3 125 B8R1.5 CC1=C(C=CC=N1)N 10626 [1,0,0,0,0,0|2,0,0]=3 126 B8R1.5 CC1=C(C=CN=C1)Cl 9936 [1,0,0,0,0,0|2,0,0]=3 127 B8R1.5 CC1=C(C=NC=C1)Br 10003 [1,0,0,0,0,0|2,0,0]=3 128 B8R1.5 CC1=C(N=CC=C1)Br 8086 [1,0,0,0,0,0|2,0,0]=3 129 B8R1.5 CC1=CC=CC=C1Cl 5808 [1,0,0,0,0,0|1,0,0]=2 130 B8R1.5 CC1=CC=CC=C1I 5298 [1,0,0,0,0,0|1,0,0]=2 131 B8R1.5 CC1=NC=CN=C1C 10470 [1,0,0,0,0,0|3,0,0]=4 132 B8R1.5 c1ccc(c(c1)N)F F0011 [1,0,0,0,0,0|2,0,0]=3 133 B10R1.2 C1=CC(=C(C(=C1)Br)F)C#N 10090 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.2 C1=CC(=C(C(=C1)Cl)Cl)C=O 6819 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.2 C1=CC(=C(C(=C1)Cl)F)C#N 10487 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.2 C1=CC(=C(C(=C1)Cl)F)C=O 5345 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.2 C1=CC(=C(C(=C1)Cl)F)C=O 6249 [0,1,0,0,0,0|2,0,1]=4 138 B10R1.2 C1=CC(=C(C(=C1)Cl)F)CN 6252 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.2 C1=CC(=C(C(=C1)F)Cl)C#N 6689 [0,1,0,0,0,0|2,0,1]=4 140 B10R1.2 C1=CC(=C(C(=C1)F)F)C#N 6064 [0,1,0,0,0,0|2,0,1]=4 141 B10R1.2 C1=CC(=C(C(=C1)F)F)C=O 6063 [0,1,0,0,0,0|2,0,1]=4 142 B10R1.2 C1=CC(=C(C(=C1)F)F)CBr 9909 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.2 CC1=C(C(=CC=C1)CN)C 6546 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.2 CC1=C(C=CC=C1Br)C#N 6769 [0,1,0,0,0,0|2,0,1]=4 145 B10R1.2 CC1=C(C=CC=C1Cl)C#N 5120 [0,1,0,0,0,0|2,0,1]=4 146 B10R1.2 CC1=C(C=CC=C1Cl)CN 6533 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.2 CC1=C(C=CC=C1F)C=O 9593 [0,1,0,0,0,0|2,0,1]=4 148 B10R1.2 CC1=CC=CC(=C1C)C#N 5505 [0,1,0,0,0,0|1,0,1]=3 149 B10R1.2 CC1=CC=CC(=C1C)C=O 9617 [0,1,0,0,0,0|1,0,1]=3 150 B10R1.2 CC1=CC=CC(=C1F)C#N 9385 [0,1,0,0,0,0|1,0,1]=3 151 B10R1.2 COC1=C(C(=CC=C1)Cl)F 9762 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.2 COC1=C(C(=CC=C1)F)Br 9813 [0,1,0,0,0,0|2,0,0]=3 153 B10R1.2 COC1=C(C(=CC=C1)F)F 5984 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.22 C1=C(C=C(C(=C1Br)Cl)F)Cl 8902 [0,1,0,0,0,0|3,0,0]=4 155 B10R1.22 C1=C(C=C(C(=C1Br)I)Br)F 8585 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.22 C1=C(C=C(C(=C1Br)I)F)Cl 6612 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.22 C1=C(C=C(C(=C1Cl)F)Cl)N 8435 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.22 C1=C(C=C(C(=C1Cl)O)F)Br 10302 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.22 C1=C(C=C(C(=C1F)Br)F)Cl 9364 [0,1,0,0,0,0|3,0,0]=4 160 B10R1.22 C1=C(C=C(C(=C1F)Br)F)F 6056 [0,1,0,0,0,0|3,0,0]=4 161 B10R1.22 C1=C(C=C(C(=C1F)Br)F)I 10292 [0,1,0,0,0,0|3,0,0]=4 162 B10R1.22 C1=C(C=C(C(=C1F)Br)F)N 10112 [0,1,0,0,0,0|3,0,0]=4 163 B10R1.22 C1=C(C=C(C(=C1F)F)F)Br 5965 [0,1,0,0,0,0|3,0,0]=4 164 B10R1.22 C1=C(C=C(C(=C1F)F)F)N 5140 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.22 C1=C(C=C(C(=C1F)F)F)O 5145 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.22 C1=C(C=C(C(=C1F)F)O)Br 8561 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.22 C1=C(C=C(C(=C1F)I)F)Br 9280 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.22 C1=C(C=C(C(=C1F)I)F)N 8249 [0,1,0,0,0,0|3,0,0]=4 169 B10R1.22 C1=C(C=C(C(=C1F)N)F)Br 8942 [0,1,0,0,0,0|3,0,0]=4 170 B10R1.22 C1=C(C=C(C(=C1F)N)N)F 8463 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.22 C1=C(C=C(C(=C1F)O)Br)F 5969 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.22 C1=C(C=C(C(=C1F)O)F)Br 6378 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.22 C1=C(C=C(C(=C1F)O)F)F 5591 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.22 CC1=CC(=C(C(=C1)Br)N)Br 6657 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.22 CC1=CC(=C(C(=C1)C)I)C 5640 [0,1,0,0,0,0|1,0,0]=2 176 B10R1.22 CC1=CC(=C(C(=C1)O)C)C 9036 [0,1,0,0,0,0|2,0,0]=3 177 B10R1.22 CC1=CC(=CC(=C1F)C)Br 8749 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.22 CC1=CC(=CC(=C1I)C)Br 6527 [0,1,0,0,0,0|1,0,0]=2 179 B10R1.22 CC1=CC(=CC(=C1N)C)Br 8071 [0,1,0,0,0,0|1,0,0]=2 180 B10R1.22 CC1=CC(=CC(=C1O)Cl)Br 10541 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.22 CC1=CC(=O)NC(=C1C)O 6842 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.22 c1c(cc(c(c1F)Br)Cl)Br D1021 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.119 C1=CC(=C(C(=C1F)F)F)F 5280 [0,1,0,0,0,0|3,0,0]=4 184 B10R1.119 C1=CC(=C(C(=C1F)F)F)I 6573 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.119 C1=CC(=C(C(=C1F)N)F)F 6061 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.119 C1=CC(=C(C(=C1F)O)Cl)F 9245 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.119 C1=CC(=C(C(=C1F)O)F)Cl 6248 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.119 C1=CC(=C(C(=C1F)O)F)F 5590 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.119 C1=CC(=C(C(=C1N)F)Cl)Br 9702 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.119 C1=CC(=C(C(=C1N)F)F)F 6057 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.119 C1=CC(=C(C(=C1O)F)F)Br 9998 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.119 C1=CC(=C(C(=C1O)F)F)F 6059 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.119 C1=CC(=C(C(=C1O)F)F)F 6060 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.119 CC1=C(C(=C(C=C1)Cl)O)F 6260 [0,1,0,0,0,0|2,0,0]=3 195 B10R1.119 CC1=C(C(=C(C=C1)F)O)Cl 6259 [0,1,0,0,0,0|2,0,0]=3 196 B10R1.119 CC1=C(C(=C(C=C1)F)O)F 6277 [0,1,0,0,0,0|2,0,0]=3 197 B10R1.119 CC1=C(C(=C(C=C1)O)F)F 6276 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.119 CC1=C(C(=NC=C1Br)N)Br 9508 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.119 CC1=C(C=CC(=C1C)O)O 10027 [0,1,0,0,0,0|2,0,0]=3 200 B10R1.245 C1=CC(=C(C(=C1)Br)C#N)N 10485 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.245 C1=CC(=C(C(=C1)Br)C=O)F 8811 [0,1,0,0,0,0|2,0,1]=4 202 B10R1.245 C1=CC(=C(C(=C1)Cl)C#N)Cl 8090 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.245 C1=CC(=C(C(=C1)Cl)C#N)F 6235 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.245 C1=CC(=C(C(=C1)Cl)C=O)F 8182 [0,1,0,0,0,0|2,0,1]=4 205 B10R1.245 C1=CC(=C(C(=C1)Cl)CBr)F 5354 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.245 C1=CC(=C(C(=C1)Cl)CCl)F 5130 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.245 C1=CC(=C(C(=C1)Cl)CN)F 8913 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.245 C1=CC(=C(C(=C1)F)C#N)F 6071 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.245 C1=CC(=C(C(=C1)F)C#N)N 6171 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.245 C1=CC(=C(C(=C1)F)C#N)O 5655 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.245 C1=CC(=C(C(=C1)F)C=O)F 5392 [0,1,0,0,0,0|2,0,1]=4 212 B10R1.245 C1=CC(=C(C(=C1)F)CBr)F 5163 [0,1,0,0,0,0|3,0,0]=4 213 B10R1.245 C1=CC(=C(C(=C1)F)CN)F 5399 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.245 C1=CC(=C(C(=C1)F)CN)N 10115 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.245 C1=CC(=C(C(=C1)F)CO)F 6072 [0,1,0,0,0,0|2,0,0]=3 216 B10R1.245 C1=CC(=C(C(=C1)I)C#N)F 6301 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.245 CC1=C(C(=CC=C1)C)C=O 8504 [0,1,0,0,0,0|0,0,1]=2 218 B10R1.245 CC1=C(C(=CC=C1)C)CCl 6548 [0,1,0,0,0,0|1,0,0]=2 219 B10R1.245 CC1=C(C(=CC=C1)Cl)C=O 9501 [0,1,0,0,0,0|1,0,1]=3 220 B10R1.245 COC1=C(C=CC=C1Cl)F 5577 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.245 COC1=C(C=CC=C1F)F 10315 [0,1,0,0,0,0|2,0,0]=3 222 B8R1.50 CC1=C(C(=NO1)C)I 5030 [0,0,0,0,1,0|3,0,0]=4 223 B7R1.3 C1=CC(=CN=C1)N 9511 [2,0,0,0,0,0|2,0,0]=4 224 B7R1.3 C1=CC(=CN=C1)O 6695 [2,0,0,0,0,0|1,0,0]=3 225 B7R1.3 C1=CC(=CN=C1)O 6696 [2,0,0,0,0,0|1,0,0]=3 226 B7R1.3 C1=CC=C(C=C1)F 5387 [2,0,0,0,0,0|1,0,0]=3 227 B7R1.3 C1=CC=C(C=C1)O 5847 [2,0,0,0,0,0|0,0,0]=2 228 B7R1.3 C1=CC=NC(=C1)Br 6647 [2,0,0,0,0,0|2,0,0]=4 229 B7R1.3 C1=CC=[N+](C=C1)[O-] 9065 [2,0,0,0,0,0|1,0,1]=4 230 B7R1.3 CC1=CN=CC=C1 8633 [2,0,0,0,0,0|1,0,0]=3 231 B7R1.3 c1ccc(cc1)F B0042 [2,0,0,0,0,0|1,0,0]=3 232 B7R1.3 c1ccnc(c1)Br B0025 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.2 C1=CC(=CC(=C1)Br)C=O 8210 [1,1,0,0,0,0|1,0,1]=4 234 B9R1.2 C1=CC(=CC(=C1)Br)CN 9996 [1,1,0,0,0,0|1,0,0]=3 235 B9R1.2 C1=CC(=CC(=C1)Br)NN 10008 [1,1,0,0,0,0|2,0,0]=4 236 B9R1.2 C1=CC(=CC(=C1)Cl)NN 9850 [1,1,0,0,0,0|2,0,0]=4 237 B9R1.2 C1=CC(=CC(=C1)F)C#N 8577 [1,1,0,0,0,0|1,0,1]=4 238 B9R1.2 C1=CC(=CC(=C1)F)C=O 9272 [1,1,0,0,0,0|1,0,1]=4 239 B9R1.2 C1=CC(=CC(=C1)F)CO 6086 [1,1,0,0,0,0|1,0,0]=3 240 B9R1.2 C1=CC(=CC(=C1)F)NN 5986 [1,1,0,0,0,0|2,0,0]=4 241 B9R1.2 C1=CC(=CC(=C1)I)C#N 9764 [1,1,0,0,0,0|1,0,1]=4 242 B9R1.2 C1=CC(=CC(=C1)I)C=O 9442 [1,1,0,0,0,0|1,0,1]=4 243 B9R1.2 C1=CC(=CC(=C1)N)C#N 6460 [1,1,0,0,0,0|1,0,1]=4 244 B9R1.2 C1=CN=C(C=C1CO)Br 8980 [1,1,0,0,0,0|2,0,0]=4 245 B9R1.2 C1=CN=C(C=C1Cl)CO 9975 [1,1,0,0,0,0|2,0,0]=4 246 B9R1.2 CC1=CC(=CC=C1)CBr 8441 [1,1,0,0,0,0|0,0,0]=2 247 B9R1.2 CC1=CC=CC(=C1)C=O 8187 [1,1,0,0,0,0|0,0,1]=3 248 B9R1.2 CC1=CC=CC(=N1)C#N 10417 [1,1,0,0,0,0|1,0,1]=4 249 B9R1.2 CC1=CC=CC(=N1)C=O 10415 [1,1,0,0,0,0|1,0,1]=4 250 B9R1.2 CC1=NC(=NC=C1)SC 8077 [1,1,0,0,0,0|2,0,0]=4 251 B9R1.2 COC1=CC(=CC=C1)F 5384 [1,1,0,0,0,0|1,0,0]=3 252 B9R1.2 COC1=CC(=CC=C1)S 5358 [1,1,0,0,0,0|1,0,0]=3 253 B9R1.2 COC1=CC(=CN=C1)Br 10627 [1,1,0,0,0,0|2,0,0]=4 254 B9R1.2 COC1=CC(=CN=C1)Br 5648 [1,1,0,0,0,0|2,0,0]=4 255 B9R1.2 COC1=CC=CC(=C1)N 9172 [1,1,0,0,0,0|1,0,0]=3 256 B9R1.2 COC1=NC(=CC=C1)Br 6692 [1,1,0,0,0,0|2,0,0]=4 257 B9R1.2 COC1=NC(=CC=C1)Cl 8886 [1,1,0,0,0,0|2,0,0]=4 258 B9R1.2 COc1cccc(c1)Br B0420 [1,1,0,0,0,0|1,0,0]=3 259 B9R1.2 COc1cccc(c1)Cl C0028 [1,1,0,0,0,0|1,0,0]=3 260 B9R1.2 CSC1=CC(=CC=C1)Cl 5596 [1,1,0,0,0,0|1,0,0]=3 261 B9R1.2 CSC1=CC=CC(=C1)F 9504 [1,1,0,0,0,0|1,0,0]=3 262 B9R1.2 CSC1=CC=CC(=C1)N 6516 [1,1,0,0,0,0|1,0,0]=3 263 B9R1.34 C1=C(C=C(C=C1Br)Br)O 8530 [1,1,0,0,0,0|2,0,0]=4 264 B9R1.34 C1=C(C=C(C=C1Cl)Cl)F 5622 [1,1,0,0,0,0|2,0,0]=4 265 B9R1.34 C1=C(C=C(C=C1F)Br)F 9223 [1,1,0,0,0,0|2,0,0]=4 266 B9R1.34 C1=C(C=C(C=C1F)Cl)N 8294 [1,1,0,0,0,0|2,0,0]=4 267 B9R1.34 C1=C(C=C(C=C1F)F)F 6040 [1,1,0,0,0,0|2,0,0]=4 268 B9R1.34 C1=C(C=C(C=C1F)F)O 5292 [1,1,0,0,0,0|2,0,0]=4 269 B9R1.34 C1=C(C=C(C=C1F)I)F 5458 [1,1,0,0,0,0|2,0,0]=4 270 B9R1.34 CC1=CC(=CC(=C1)Br)Br 10173 [1,1,0,0,0,0|1,0,0]=3 271 B9R1.34 CC1=CC(=CC(=C1)Br)C 6396 [1,1,0,0,0,0|0,0,0]=2 272 B9R1.34 CC1=CC(=CC(=C1)Br)C 8945 [1,1,0,0,0,0|0,0,0]=2 273 B9R1.34 CC1=CC(=CC(=C1)C)C 5777 [1,1,0,0,0,0|0,0,0]=2 274 B9R1.34 CC1=CC(=CC(=C1)I)C 9209 [1,1,0,0,0,0|0,0,0]=2 275 B9R1.34 CC1=CC(=NC(=N1)Cl)C 9808 [1,1,0,0,0,0|2,0,0]=4 276 B9R1.34 CC1=CC(=NC(=S)N1)C 6651 [1,1,0,0,0,0|2,0,0]=4 277 B9R1.34 CC1=CC(=NC(=S)N1)C 8595 [1,1,0,0,0,0|2,0,0]=4 278 B9R1.34 CC1=CC(=O)C=C(N1)C 6464 [1,1,0,0,0,0|1,0,0]=3 279 B9R1.69 C1=CC(=C(C=C1Br)Br)F 6201 [1,1,0,0,0,0|2,0,0]=4 280 B9R1.69 C1=CC(=C(C=C1Br)Br)N 6160 [1,1,0,0,0,0|2,0,0]=4 281 B9R1.69 C1=CC(=C(C=C1Br)Cl)Cl 5098 [1,1,0,0,0,0|2,0,0]=4 282 B9R1.69 C1=CC(=C(C=C1Br)Cl)F 5541 [1,1,0,0,0,0|2,0,0]=4 283 B9R1.69 C1=CC(=C(C=C1Br)Cl)I 8228 [1,1,0,0,0,0|2,0,0]=4 284 B9R1.69 C1=CC(=C(C=C1Br)F)Br 5609 [1,1,0,0,0,0|2,0,0]=4 285 B9R1.69 C1=CC(=C(C=C1Br)F)Cl 5073 [1,1,0,0,0,0|2,0,0]=4 286 B9R1.69 C1=CC(=C(C=C1Br)F)Cl 6178 [1,1,0,0,0,0|2,0,0]=4 287 B9R1.69 C1=CC(=C(C=C1Br)F)F 6000 [1,1,0,0,0,0|2,0,0]=4 288 B9R1.69 C1=CC(=C(C=C1Br)F)I 5546 [1,1,0,0,0,0|2,0,0]=4 289 B9R1.69 C1=CC(=C(C=C1Br)F)N 5271 [1,1,0,0,0,0|2,0,0]=4 290 B9R1.69 C1=CC(=C(C=C1Br)F)N 5547 [1,1,0,0,0,0|2,0,0]=4 291 B9R1.69 C1=CC(=C(C=C1Br)F)O 5337 [1,1,0,0,0,0|2,0,0]=4 292 B9R1.69 C1=CC(=C(C=C1Br)N)N 5041 [1,1,0,0,0,0|2,0,0]=4 293 B9R1.69 C1=CC(=C(C=C1Br)N)O 8620 [1,1,0,0,0,0|2,0,0]=4 294 B9R1.69 C1=CC(=C(C=C1Cl)Br)F 6484 [1,1,0,0,0,0|2,0,0]=4 295 B9R1.69 C1=CC(=C(C=C1Cl)Br)N 8533 [1,1,0,0,0,0|2,0,0]=4 296 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Br 6522 [1,1,0,0,0,0|2,0,0]=4 297 B9R1.69 C1=CC(=C(C=C1Cl)Cl)F 5400 [1,1,0,0,0,0|2,0,0]=4 298 B9R1.69 C1=CC(=C(C=C1Cl)Cl)S 6151 [1,1,0,0,0,0|2,0,0]=4 299 B9R1.69 C1=CC(=C(C=C1Cl)F)Br 6177 [1,1,0,0,0,0|2,0,0]=4 300 B9R1.69 C1=CC(=C(C=C1Cl)F)I 9921 [1,1,0,0,0,0|2,0,0]=4 301 B9R1.69 C1=CC(=C(C=C1Cl)F)N 5025 [1,1,0,0,0,0|2,0,0]=4 302 B9R1.69 C1=CC(=C(C=C1Cl)F)O 8240 [1,1,0,0,0,0|2,0,0]=4 303 B9R1.69 C1=CC(=C(C=C1Cl)I)N 5011 [1,1,0,0,0,0|2,0,0]=4 304 B9R1.69 C1=CC(=C(C=C1Cl)N)Br 10527 [1,1,0,0,0,0|2,0,0]=4 305 B9R1.69 C1=CC(=C(C=C1Cl)N)F 5788 [1,1,0,0,0,0|2,0,0]=4 306 B9R1.69 C1=CC(=C(C=C1Cl)N)N 10655 [1,1,0,0,0,0|2,0,0]=4 307 B9R1.69 C1=CC(=C(C=C1F)Cl)Br 9301 [1,1,0,0,0,0|2,0,0]=4 308 B9R1.69 C1=CC(=C(C=C1F)Cl)N 6049 [1,1,0,0,0,0|2,0,0]=4 309 B9R1.69 C1=CC(=C(C=C1F)Cl)S 6413 [1,1,0,0,0,0|2,0,0]=4 310 B9R1.69 C1=CC(=C(C=C1F)F)Cl 6187 [1,1,0,0,0,0|2,0,0]=4 311 B9R1.69 C1=CC(=C(C=C1F)F)I 8762 [1,1,0,0,0,0|2,0,0]=4 312 B9R1.69 C1=CC(=C(C=C1F)F)N 5063 [1,1,0,0,0,0|2,0,0]=4 313 B9R1.69 C1=CC(=C(C=C1F)F)O 10593 [1,1,0,0,0,0|2,0,0]=4 314 B9R1.69 C1=CC(=C(C=C1F)I)N 6566 [1,1,0,0,0,0|2,0,0]=4 315 B9R1.69 C1=CC(=C(C=C1F)N)Br 5466 [1,1,0,0,0,0|2,0,0]=4 316 B9R1.69 C1=CC(=C(C=C1F)N)Cl 8573 [1,1,0,0,0,0|2,0,0]=4 317 B9R1.69 C1=CC(=C(C=C1F)N)F 5391 [1,1,0,0,0,0|2,0,0]=4 318 B9R1.69 C1=CC(=C(C=C1F)N)N 8159 [1,1,0,0,0,0|2,0,0]=4 319 B9R1.69 C1=CC(=C(C=C1F)N)O 9491 [1,1,0,0,0,0|2,0,0]=4 320 B9R1.69 C1=CC(=C(C=C1F)O)Br 6182 [1,1,0,0,0,0|2,0,0]=4 321 B9R1.69 C1=CC(=C(C=C1F)O)N 5456 [1,1,0,0,0,0|2,0,0]=4 322 B9R1.69 C1=CC(=C(C=C1I)Cl)Br 9399 [1,1,0,0,0,0|2,0,0]=4 323 B9R1.69 C1=CC(=C(C=C1I)Cl)F 8917 [1,1,0,0,0,0|2,0,0]=4 324 B9R1.69 C1=CC(=C(C=C1I)Cl)N 5567 [1,1,0,0,0,0|2,0,0]=4 325 B9R1.69 C1=CC(=C(C=C1I)F)Br 6412 [1,1,0,0,0,0|2,0,0]=4 326 B9R1.69 C1=CC(=C(C=C1I)F)F 8933 [1,1,0,0,0,0|2,0,0]=4 327 B9R1.69 C1=CC(=C(C=C1I)F)I 8788 [1,1,0,0,0,0|2,0,0]=4 328 B9R1.69 C1=CC(=C(C=C1I)F)N 5568 [1,1,0,0,0,0|2,0,0]=4 329 B9R1.69 C1=CC(=C(C=C1N)Br)Cl 8804 [1,1,0,0,0,0|2,0,0]=4 330 B9R1.69 C1=CC(=C(C=C1N)Br)F 9837 [1,1,0,0,0,0|2,0,0]=4 331 B9R1.69 C1=CC(=C(C=C1N)Cl)Cl 6584 [1,1,0,0,0,0|2,0,0]=4 332 B9R1.69 C1=CC(=C(C=C1N)Cl)F 6046 [1,1,0,0,0,0|2,0,0]=4 333 B9R1.69 C1=CC(=C(C=C1N)Cl)F 9805 [1,1,0,0,0,0|2,0,0]=4 334 B9R1.69 C1=CC(=C(C=C1N)F)F 6033 [1,1,0,0,0,0|2,0,0]=4 335 B9R1.69 C1=CC(=C(C=C1N)F)O 6473 [1,1,0,0,0,0|2,0,0]=4 336 B9R1.69 C1=CC(=C(C=C1O)F)Cl 6195 [1,1,0,0,0,0|2,0,0]=4 337 B9R1.69 C1=CC(=C(C=C1O)F)F 10058 [1,1,0,0,0,0|2,0,0]=4 338 B9R1.69 C1=CC(=C(C=C1O)N)F 8132 [1,1,0,0,0,0|2,0,0]=4 339 B9R1.69 CC1=C(C=C(C=C1)Br)Br 8117 [1,1,0,0,0,0|2,0,0]=4 340 B9R1.69 CC1=C(C=C(C=C1)Br)F 5338 [1,1,0,0,0,0|2,0,0]=4 341 B9R1.69 CC1=C(C=C(C=C1)Br)O 8476 [1,1,0,0,0,0|2,0,0]=4 342 B9R1.69 CC1=C(C=C(C=C1)Cl)Br 10285 [1,1,0,0,0,0|2,0,0]=4 343 B9R1.69 CC1=C(C=C(C=C1)Cl)I 8997 [1,1,0,0,0,0|2,0,0]=4 344 B9R1.69 CC1=C(C=C(C=C1)Cl)S 9802 [1,1,0,0,0,0|2,0,0]=4 345 B9R1.69 CC1=C(C=C(C=C1)F)Br 9373 [1,1,0,0,0,0|2,0,0]=4 346 B9R1.69 CC1=C(C=C(C=C1)F)C 6113 [1,1,0,0,0,0|1,0,0]=3 347 B9R1.69 CC1=C(C=C(C=C1)F)N 6050 [1,1,0,0,0,0|2,0,0]=4 348 B9R1.69 CC1=C(C=C(C=C1)N)F 6047 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.69 CC1=C(C=C(C=C1)N)O 10159 [1,1,0,0,0,0|2,0,0]=4 350 B9R1.69 CC1=C(C=CC(=C1)Br)Br 8391 [1,1,0,0,0,0|1,0,0]=3 351 B9R1.69 CC1=C(C=CC(=C1)Br)Cl 5543 [1,1,0,0,0,0|1,0,0]=3 352 B9R1.69 CC1=C(C=CC(=C1)Br)F 6043 [1,1,0,0,0,0|1,0,0]=3 353 B9R1.69 CC1=C(C=CC(=C1)Br)I 10304 [1,1,0,0,0,0|1,0,0]=3 354 B9R1.69 CC1=C(C=CC(=C1)Br)I 6526 [1,1,0,0,0,0|1,0,0]=3 355 B9R1.69 CC1=C(C=CC(=C1)Br)N 9725 [1,1,0,0,0,0|1,0,0]=3 356 B9R1.69 CC1=C(C=CC(=C1)Br)O 5111 [1,1,0,0,0,0|1,0,0]=3 357 B9R1.69 CC1=C(C=CC(=C1)Cl)Br 9792 [1,1,0,0,0,0|1,0,0]=3 358 B9R1.69 CC1=C(C=CC(=C1)Cl)I 8729 [1,1,0,0,0,0|1,0,0]=3 359 B9R1.69 CC1=C(C=CC(=C1)F)Br 5273 [1,1,0,0,0,0|1,0,0]=3 360 B9R1.69 CC1=C(C=CC(=C1)F)Br 6041 [1,1,0,0,0,0|1,0,0]=3 361 B9R1.69 CC1=C(C=CC(=C1)F)F 5294 [1,1,0,0,0,0|1,0,0]=3 362 B9R1.69 CC1=C(C=CC(=C1)F)F 8711 [1,1,0,0,0,0|1,0,0]=3 363 B9R1.69 CC1=C(C=CC(=C1)F)I 5554 [1,1,0,0,0,0|1,0,0]=3 364 B9R1.69 CC1=C(C=CC(=C1)F)N 5346 [1,1,0,0,0,0|1,0,0]=3 365 B9R1.69 CC1=C(C=CC(=C1)I)F 6231 [1,1,0,0,0,0|1,0,0]=3 366 B9R1.69 CC1=C(C=CC(=C1)I)N 5381 [1,1,0,0,0,0|1,0,0]=3 367 B9R1.69 CC1=C(C=CC(=C1)N)Br 10225 [1,1,0,0,0,0|1,0,0]=3 368 B9R1.69 CC1=C(C=CC(=C1)N)F 5275 [1,1,0,0,0,0|1,0,0]=3 369 B9R1.69 CC1=C(C=CC(=C1)O)Br 10033 [1,1,0,0,0,0|1,0,0]=3 370 B9R1.69 CC1=C(C=CC(=C1)O)F 6307 [1,1,0,0,0,0|1,0,0]=3 371 B9R1.69 CC1=C(C=CC(=C1)O)N 10166 [1,1,0,0,0,0|1,0,0]=3 372 B9R1.69 CC1=C(C=CC(=N1)Br)Br 10157 [1,1,0,0,0,0|2,0,0]=4 373 B9R1.69 CC1=C(C=CC(=N1)Cl)Br 5242 [1,1,0,0,0,0|2,0,0]=4 374 B9R1.69 CC1=C(C=CC(=N1)Cl)F 5081 [1,1,0,0,0,0|2,0,0]=4 375 B9R1.69 CC1=C(C=CC(=N1)Cl)N 10002 [1,1,0,0,0,0|2,0,0]=4 376 B9R1.69 CC1=C(C=CC(=N1)F)Br 5681 [1,1,0,0,0,0|2,0,0]=4 377 B9R1.69 CC1=C(C=CC(=N1)F)N 8257 [1,1,0,0,0,0|2,0,0]=4 378 B9R1.69 CC1=C(C=CC(=N1)N)Br 5101 [1,1,0,0,0,0|2,0,0]=4 379 B9R1.69 CC1=C(C=CC(=N1)N)Cl C2896 [1,1,0,0,0,0|2,0,0]=4 380 B9R1.69 CC1=CC(=C(C=C1)Br)Cl 8156 [1,1,0,0,0,0|1,0,0]=3 381 B9R1.69 CC1=CC(=C(C=C1)Br)F 6101 [1,1,0,0,0,0|1,0,0]=3 382 B9R1.69 CC1=CC(=C(C=C1)C)Br 8829 [1,1,0,0,0,0|1,0,0]=3 383 B9R1.69 CC1=CC(=C(C=C1)C)I 8028 [1,1,0,0,0,0|1,0,0]=3 384 B9R1.69 CC1=CC(=C(C=C1)C)N 5322 [1,1,0,0,0,0|1,0,0]=3 385 B9R1.69 CC1=CC(=C(C=C1)C)O 6763 [1,1,0,0,0,0|1,0,0]=3 386 B9R1.69 CC1=CC(=C(C=C1)Cl)Br 5106 [1,1,0,0,0,0|1,0,0]=3 387 B9R1.69 CC1=CC(=C(C=C1)F)Br 6183 [1,1,0,0,0,0|1,0,0]=3 388 B9R1.69 CC1=CC(=C(C=C1)F)Cl 6423 [1,1,0,0,0,0|1,0,0]=3 389 B9R1.69 CC1=CC(=C(C=C1)F)I 6427 [1,1,0,0,0,0|1,0,0]=3 390 B9R1.69 CC1=CC(=C(C=C1)F)N 6577 [1,1,0,0,0,0|1,0,0]=3 391 B9R1.69 CC1=CC(=C(C=C1)F)O 5573 [1,1,0,0,0,0|1,0,0]=3 392 B9R1.69 CC1=CC(=C(C=C1)I)Br 5051 [1,1,0,0,0,0|1,0,0]=3 393 B9R1.69 CC1=CC(=C(C=C1)I)C 9318 [1,1,0,0,0,0|0,0,0]=2 394 B9R1.69 CC1=CC(=C(C=C1)N)F 6048 [1,1,0,0,0,0|1,0,0]=3 395 B9R1.69 CC1=CC(=C(C=C1)N)N 6659 [1,1,0,0,0,0|1,0,0]=3 396 B9R1.69 CC1=CC(=C(C=C1)O)Cl 10579 [1,1,0,0,0,0|1,0,0]=3 397 B9R1.69 CC1=CC(=C(C=C1)O)N 8098 [1,1,0,0,0,0|1,0,0]=3 398 B9R1.69 CC1=CC(=C(N=C1)Br)N 8112 [1,1,0,0,0,0|2,0,0]=4 399 B9R1.69 CC1=CC(=C(N=C1)Cl)Br 8055 [1,1,0,0,0,0|2,0,0]=4 400 B9R1.69 CC1=CC(=C(N=C1)Cl)F 10553 [1,1,0,0,0,0|2,0,0]=4 401 B9R1.69 CC1=CC(=C(N=C1)Cl)N 8400 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.69 CC1=CC(=C(N=C1)F)Br 9709 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.69 CC1=CC(=CN=C1Br)Br 5235 [1,1,0,0,0,0|2,0,0]=4 404 B9R1.69 CC1=CC(=CN=C1Cl)N 9387 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.69 CC1=CC(=CN=C1F)Br 5236 [1,1,0,0,0,0|2,0,0]=4 406 B9R1.69 CC1=CC(=CN=C1N)Br 5024 [1,1,0,0,0,0|2,0,0]=4 407 B9R1.69 CC1=CC(=CN=C1N)I 6628 [1,1,0,0,0,0|2,0,0]=4 408 B9R1.69 CC1=CC(=NC=C1Br)Br 8455 [1,1,0,0,0,0|2,0,0]=4 409 B9R1.69 CC1=NC(=C(C=C1)Br)C 6834 [1,1,0,0,0,0|1,0,0]=3 410 B9R1.69 CC1=NC(=C(C=C1)N)Br 6720 [1,1,0,0,0,0|2,0,0]=4 411 B9R1.69 CC1=NC(=C(C=C1)N)Cl 8825 [1,1,0,0,0,0|2,0,0]=4 412 B9R1.69 Cc1ccc(c(c1)O)N A0481 [1,1,0,0,0,0|1,0,0]=3 413 B9R1.69 c1cc(c(cc1Cl)N)N C0263 [1,1,0,0,0,0|2,0,0]=4 414 B9R1.15 C1=CC(=C(N=C1)Cl)CO 6736 [1,1,0,0,0,0|2,0,0]=4 415 B9R1.15 C1=CC=C(C(=C1)C#N)Br 5156 [1,1,0,0,0,0|1,0,1]=4 416 B9R1.15 C1=CC=C(C(=C1)C#N)F 9273 [1,1,0,0,0,0|1,0,1]=4 417 B9R1.15 C1=CC=C(C(=C1)C#N)F 9465 [1,1,0,0,0,0|1,0,1]=4 418 B9R1.15 C1=CC=C(C(=C1)C#N)I 5184 [1,1,0,0,0,0|1,0,1]=4 419 B9R1.15 C1=CC=C(C(=C1)C#N)N 5222 [1,1,0,0,0,0|1,0,1]=4 420 B9R1.15 C1=CC=C(C(=C1)C#N)O 9517 [1,1,0,0,0,0|0,0,1]=3 421 B9R1.15 C1=CC=C(C(=C1)C=O)O 5096 [1,1,0,0,0,0|0,0,1]=3 422 B9R1.15 C1=CC=C(C(=C1)CBr)F 5007 [1,1,0,0,0,0|1,0,0]=3 423 B9R1.15 C1=CC=C(C(=C1)CBr)F 5138 [1,1,0,0,0,0|1,0,0]=3 424 B9R1.15 C1=CC=C(C(=C1)CN)Br 8860 [1,1,0,0,0,0|1,0,0]=3 425 B9R1.15 C1=CC=C(C(=C1)CN)Cl 9625 [1,1,0,0,0,0|1,0,0]=3 426 B9R1.15 C1=CC=C(C(=C1)CN)F 8921 [1,1,0,0,0,0|1,0,0]=3 427 B9R1.15 C1=CC=C(C(=C1)CO)Cl 5137 [1,1,0,0,0,0|1,0,0]=3 428 B9R1.15 C1=CC=C(C(=C1)CO)F 6299 [1,1,0,0,0,0|1,0,0]=3 429 B9R1.15 C1=CC=C(C(=C1)CO)O 10170 [1,1,0,0,0,0|0,0,0]=2 430 B9R1.15 C1=CC=C(C(=C1)CO)O 8851 [1,1,0,0,0,0|0,0,0]=2 431 B9R1.15 C1=CC=C(C(=C1)NN)F 5985 [1,1,0,0,0,0|2,0,0]=4 432 B9R1.15 CC1=CC=CC=C1CO 6723 [1,1,0,0,0,0|0,0,0]=2 433 B9R1.15 CCC1=CC=CC=C1I 6010 [1,1,0,0,0,0|1,0,0]=3 434 B9R1.15 CCC1=CC=CC=C1S 5060 [1,1,0,0,0,0|0,1,0]=3 435 B9R1.15 COC1=C(C=CC=N1)N 6512 [1,1,0,0,0,0|2,0,0]=4 436 B9R1.15 COC1=C(N=CC=C1)Cl 9004 [1,1,0,0,0,0|2,0,0]=4 437 B9R1.15 COC1=CC=CC=C1Br 6133 [1,1,0,0,0,0|1,0,0]=3 438 B9R1.15 COC1=CC=CC=C1F 6115 [1,1,0,0,0,0|1,0,0]=3 439 B9R1.15 COC1=CC=CC=C1I 9182 [1,1,0,0,0,0|1,0,0]=3 440 B9R1.15 COC1=CC=CC=C1N 6674 [1,1,0,0,0,0|1,0,0]=3 441 B9R1.15 COc1ccccc1Br B0022 [1,1,0,0,0,0|1,0,0]=3 442 B9R1.15 CSC1=CC=CC=C1Br 5058 [1,1,0,0,0,0|1,0,0]=3 443 B9R1.15 CSC1=CC=CC=C1Cl 6157 [1,1,0,0,0,0|1,0,0]=3 444 B9R1.15 CSC1=CC=CC=C1N 8226 [1,1,0,0,0,0|1,0,0]=3 445 B9R1.15 CSC1=CC=CC=C1O 8029 [1,1,0,0,0,0|0,0,0]=2 446 B9R1.15 c1ccc(c(c1)CBr)Cl 8338 [1,1,0,0,0,0|1,0,0]=3 447 B11R1.8 C1=C(C=C(C(=C1Br)O)C=O)Cl 10028 [0,2,0,0,0,0|1,0,1]=4 448 B11R1.8 C1=C(C=C(C(=C1F)F)CBr)F 8735 [0,2,0,0,0,0|2,0,0]=4 449 B11R1.8 C1=C(C=C(C(=C1F)F)CO)F 8197 [0,2,0,0,0,0|2,0,0]=4 450 B11R1.13 C1=CC(=C(C(=C1)Cl)F)CC#N 9241 [0,2,0,0,0,0|2,0,0]=4 451 B11R1.13 CC1=C(C(=CC=C1)N=C=S)C 8930 [0,2,0,0,0,0|1,0,1]=4 452 B11R1.72 C1=CC(=C(C(=C1F)CBr)F)F 5367 [0,2,0,0,0,0|2,0,0]=4 453 B11R1.72 C1=CC(=C(C(=C1F)CN)Cl)F 8161 [0,2,0,0,0,0|2,0,0]=4 454 B11R1.72 C1=CC(=C(C(=C1F)CO)Cl)F 8317 [0,2,0,0,0,0|2,0,0]=4 455 B11R1.72 C1=CC(=C(C(=C1F)CO)F)F 5586 [0,2,0,0,0,0|2,0,0]=4 456 B11R1.72 CC1=C(C(=C(C=C1)Cl)CO)F 9661 [0,2,0,0,0,0|1,0,0]=3 457 B11R1.72 CC1=C(C(=C(C=C1)F)C=O)Cl 6254 [0,2,0,0,0,0|1,0,1]=4 458 B11R1.72 CC1=C(C(=C(C=C1)F)C=O)F 6273 [0,2,0,0,0,0|1,0,1]=4 459 B11R1.72 CC1=C(C(=C(C=C1)F)CO)Cl 8181 [0,2,0,0,0,0|1,0,0]=3 460 B11R1.72 CC1=C(C(=C(C=C1)F)CO)F 10055 [0,2,0,0,0,0|1,0,0]=3 461 B11R1.72 CC1=C(C(=C(C=C1)F)OC)Cl 8179 [0,2,0,0,0,0|1,0,0]=3 462 B11R1.159 C1=CC(=C(C(=C1)F)O)[N+](=O)[O-] 6434 [0,2,0,0,0,0|2,0,0]=4 463 B11R1.159 CC(=O)C1=C(C(=CC=C1)F)F 9780 [0,2,0,0,0,0|2,0,0]=4 464 B11R1.159 CC(=O)C1=C(C(=CC=C1)N)O 6667 [0,2,0,0,0,0|1,0,0]=3 465 B11R1.159 CC1=C(C(=CC=C1)[N+](=O)[O-])N 8996 [0,2,0,0,0,0|2,0,0]=4 466 B11R1.159 CC1=CC=CC(=C1Br)C(=O)O 5552 [0,2,0,0,0,0|1,0,1]=4 467 B11R1.159 CC1=CC=CC(=C1Cl)C(=O)O 9214 [0,2,0,0,0,0|1,0,1]=4 468 B11R1.159 CC1=CC=CC(=C1I)C(=O)O 6863 [0,2,0,0,0,0|1,0,1]=4 469 B11R1.159 CC1=CC=CC(=C1N)C(=O)O 6598 [0,2,0,0,0,0|1,0,1]=4 470 B11R1.265 COC1=C(C(=CC=C1)F)C#N 6305 [0,2,0,0,0,0|2,0,0]=4 471 B11R1.265 COC1=C(C(=CC=C1)F)C=O 9347 [0,2,0,0,0,0|1,0,1]=4 472 B11R1.278 C1=CC(=C(C(=C1CBr)F)F)F 5588 [0,2,0,0,0,0|2,0,0]=4 473 B11R1.278 C1=CC(=C(C(=C1CO)F)F)F 6353 [0,2,0,0,0,0|2,0,0]=4 474 B11R1.278 CC1=C(C(=C(C=C1)C=O)F)F 5389 [0,2,0,0,0,0|2,0,0]=4 475 B11R1.278 CC1=C(C(=C(C=C1)OC)F)F 6272 [0,2,0,0,0,0|2,0,0]=4 476 B11R1.14 C1=C(C=C(C(=C1Cl)O)Cl)C#N 6663 [0,2,0,0,0,0|2,0,0]=4 477 B11R1.32 C1=C(C(=C(C(=C1F)Cl)O)Cl)F 6444 [0,2,0,0,0,0|2,0,0]=4 478 B11R1.32 C1=C(C(=C(C(=C1F)F)O)F)F 5364 [0,2,0,0,0,0|2,0,0]=4 479 B11R1.32 CC1=CC(=C(C(=C1Cl)Br)N)Br 6531 [0,2,0,0,0,0|2,0,0]=4 480 B11R1.464 CC1=CC(=C(C(=C1)C)C=O)C 9200 [0,2,0,0,0,0|0,0,1]=3 481 B11R1.464 CC1=CC(=CC(=C1C=O)C)O 10609 [0,2,0,0,0,0|0,0,1]=3 482 B11R1.464 COC1=C(C=C(C=C1Br)F)F 6485 [0,2,0,0,0,0|2,0,0]=4 483 B11R1.464 COC1=C(C=C(C=C1F)Br)F 5533 [0,2,0,0,0,0|2,0,0]=4 484 B11R1.464 COC1=C(C=C(C=C1F)F)F 8305 [0,2,0,0,0,0|2,0,0]=4 485 B11R1.156 B(C1=C(C=CC=C1Cl)Cl)(O)O 6456 [0,2,0,0,0,0|2,0,0]=4 486 B11R1.156 B(C1=C(C=CC=C1F)F)(O)O 10494 [0,2,0,0,0,0|2,0,0]=4 487 B11R1.156 C1=CC(=C(C(=C1)Br)C(=O)O)Cl 6567 [0,2,0,0,0,0|2,0,0]=4 488 B11R1.156 C1=CC(=C(C(=C1)Br)C(=O)O)F 6241 [0,2,0,0,0,0|2,0,0]=4 489 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)O)Cl 5394 [0,2,0,0,0,0|2,0,0]=4 490 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)O)F 5099 [0,2,0,0,0,0|2,0,0]=4 491 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)O)F 5353 [0,2,0,0,0,0|2,0,0]=4 492 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)O)N 5048 [0,2,0,0,0,0|2,0,0]=4 493 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)O)O 6300 [0,2,0,0,0,0|2,0,0]=4 494 B11R1.156 CC1=C(C(=CC=C1)Cl)C(=O)N 6850 [0,2,0,0,0,0|1,0,1]=4 495 B11R1.156 CC1=C(C(=CC=C1)Cl)C(=O)O 9895 [0,2,0,0,0,0|1,0,0]=3 496 B11R1.156 CC1=C(C(=CC=C1)N)C(=O)O 10650 [0,2,0,0,0,0|1,0,0]=3 497 B9R1.41 Cc1ccoc1C(=O)O M0024 [0,0,1,1,0,0|2,0,0]=4 498 B7R1.2 CC1=CC(=NN1)C 10496 [1,0,0,0,1,0|2,0,0]=4 499 B7R1.2 CC1=CC(=NO1)C 9870 [1,0,0,0,1,0|2,0,0]=4 500 B7R1.2 CC1=CC=C(S1)Br 6601 [1,0,0,0,1,0|2,0,0]=4 501 B7R1.2 CC1=CSC(=N1)C 6124 [1,0,0,0,1,0|2,0,0]=4 502 B7R1.2 Cc1cc(n[nH]1)C D0196 [1,0,0,0,1,0|2,0,0]=4 503 B7R1.2 Cc1csc(n1)C D0198 [1,0,0,0,1,0|2,0,0]=4 504 B7R1.4 CC1=C(SC=C1)Br 5664 [1,0,0,0,1,0|2,0,0]=4 505 B7R1.4 CC1=C(SC=N1)C 5281 [1,0,0,0,1,0|2,0,0]=4 506 B7R1.4 CC1=CC=NN1C 5243 [1,0,0,0,1,0|2,0,0]=4