0 B8R1.4 C1=C(C=NC=C1Br)Br 5217 [0,0,0,0,0,0|3,0,0]=3 1 B8R1.4 C1=C(C=NC=C1Br)F 5671 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.4 C1=C(C=NC=C1Br)O 10431 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.4 C1=C(C=NC=C1Cl)Cl 10175 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.4 C1=C(C=NC=C1Cl)F 8265 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.4 C1=C(C=NC=C1F)F 5685 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.4 C1=C(C=NC=C1F)N 6698 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.4 C1=C(N=C(C=N1)Cl)Cl 6123 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.4 C1=CC(=CC(=C1)Br)Br 5153 [0,0,0,0,0,0|2,0,0]=2 9 B8R1.4 C1=CC(=CC(=C1)Br)N 8582 [0,0,0,0,0,0|2,0,0]=2 10 B8R1.4 C1=CC(=CC(=C1)Br)N 8583 [0,0,0,0,0,0|2,0,0]=2 11 B8R1.4 C1=CC(=CC(=C1)Br)S 5283 [0,0,0,0,0,0|1,1,0]=2 12 B8R1.4 C1=CC(=CC(=C1)Cl)O 10156 [0,0,0,0,0,0|1,0,0]=1 13 B8R1.4 C1=CC(=CC(=C1)F)F 6015 [0,0,0,0,0,0|2,0,0]=2 14 B8R1.4 C1=CC(=CC(=C1)I)Br 5550 [0,0,0,0,0,0|2,0,0]=2 15 B8R1.4 C1=CC(=CC(=C1)I)F 8911 [0,0,0,0,0,0|2,0,0]=2 16 B8R1.4 C1=CC(=CC(=C1)I)O 9915 [0,0,0,0,0,0|1,0,0]=1 17 B8R1.4 C1=CC(=NC(=C1)Br)Br 5221 [0,0,0,0,0,0|3,0,0]=3 18 B8R1.4 C1=CC(=NC(=C1)Br)Cl 8069 [0,0,0,0,0,0|3,0,0]=3 19 B8R1.4 C1=CC(=NC(=C1)Cl)F 5672 [0,0,0,0,0,0|3,0,0]=3 20 B8R1.4 C1=CC(=NC(=C1)Cl)N 5316 [0,0,0,0,0,0|3,0,0]=3 21 B8R1.4 C1=CC(=NC(=C1)F)F 10361 [0,0,0,0,0,0|3,0,0]=3 22 B8R1.4 C1=CC(=NC(=C1)F)N 5229 [0,0,0,0,0,0|3,0,0]=3 23 B8R1.4 C1=CC(=NC(=C1)N)N 6752 [0,0,0,0,0,0|3,0,0]=3 24 B8R1.4 C1=CC(=O)NC(=C1)Cl 10464 [0,0,0,0,0,0|2,0,1]=3 25 B8R1.4 C1=CC(=O)NC(=C1)F 6665 [0,0,0,0,0,0|2,0,1]=3 26 B8R1.4 C1=CN=C(C=C1Br)Br 5241 [0,0,0,0,0,0|3,0,0]=3 27 B8R1.4 C1=CN=C(C=C1Br)Cl 8808 [0,0,0,0,0,0|3,0,0]=3 28 B8R1.4 C1=CN=C(C=C1Br)F 6500 [0,0,0,0,0,0|3,0,0]=3 29 B8R1.4 C1=CN=C(C=C1Br)N 8459 [0,0,0,0,0,0|3,0,0]=3 30 B8R1.4 C1=CN=C(C=C1Cl)Cl 5661 [0,0,0,0,0,0|3,0,0]=3 31 B8R1.4 C1=CN=C(C=C1I)F 8362 [0,0,0,0,0,0|3,0,0]=3 32 B8R1.4 C1=CN=C(C=C1N)Br 9320 [0,0,0,0,0,0|3,0,0]=3 33 B8R1.4 C1=CN=C(C=C1N)Cl 5451 [0,0,0,0,0,0|3,0,0]=3 34 B8R1.4 C1=CN=C(N=C1N)Cl 6711 [0,0,0,0,0,0|4,0,0]=4 35 B8R1.4 C1=CN=C(N=C1N)N 9571 [0,0,0,0,0,0|4,0,0]=4 36 B8R1.4 C1=CNC(=O)C=C1O 10547 [0,0,0,0,0,0|2,0,0]=2 37 B8R1.4 CC1=CC(=CC=C1)Br 9432 [0,0,0,0,0,0|1,0,0]=1 38 B8R1.4 CC1=CC(=CC=C1)I 8771 [0,0,0,0,0,0|1,0,0]=1 39 B8R1.4 CC1=CC(=CN=C1)N 8645 [0,0,0,0,0,0|2,0,0]=2 40 B8R1.4 CC1=CC(=NC=C1)Br 9012 [0,0,0,0,0,0|2,0,0]=2 41 B8R1.4 CC1=CC(=NC=C1)Cl 5069 [0,0,0,0,0,0|2,0,0]=2 42 B8R1.4 CC1=CC(=NC=C1)F 5561 [0,0,0,0,0,0|2,0,0]=2 43 B8R1.4 CC1=CC(=NC=C1)F 6308 [0,0,0,0,0,0|2,0,0]=2 44 B8R1.4 CC1=NC(=CC=C1)Br 5660 [0,0,0,0,0,0|2,0,0]=2 45 B8R1.4 CC1=NC(=CC=C1)Cl 5070 [0,0,0,0,0,0|2,0,0]=2 46 B8R1.4 CC1=NC(=CC=C1)F 9658 [0,0,0,0,0,0|2,0,0]=2 47 B8R1.4 CC1=NC(=NC=C1)Br B1240 [0,0,0,0,0,0|3,0,0]=3 48 B8R1.4 CC1=NC(=NC=C1)Cl 5673 [0,0,0,0,0,0|3,0,0]=3 49 B8R1.4 CC1=NC=CC(=C1)N 6613 [0,0,0,0,0,0|2,0,0]=2 50 B8R1.4 Cc1ccnc(n1)N A0244 [0,0,0,0,0,0|3,0,0]=3 51 B8R1.4 Cc1ccnc(n1)O H0124 [0,0,0,0,0,0|2,0,0]=2 52 B8R1.4 c1c(ncnc1O)O D0129 [0,0,0,0,0,0|3,0,0]=3 53 B8R1.4 c1cc(cc(c1)Br)F B0235 [0,0,0,0,0,0|2,0,0]=2 54 B7R1.3 C1=C(C=NC=N1)Br 5441 [1,0,0,0,0,0|3,0,0]=4 55 B7R1.3 C1=C(C=NC=N1)N 10659 [1,0,0,0,0,0|3,0,0]=4 56 B7R1.3 C1=CC(=CN=C1)N 9511 [1,0,0,0,0,0|2,0,0]=3 57 B7R1.3 C1=CC(=CN=C1)O 6695 [1,0,0,0,0,0|1,0,0]=2 58 B7R1.3 C1=CC(=CN=C1)O 6696 [1,0,0,0,0,0|1,0,0]=2 59 B7R1.3 C1=CC=C(C=C1)F 5387 [1,0,0,0,0,0|1,0,0]=2 60 B7R1.3 C1=CC=C(C=C1)O 5847 [1,0,0,0,0,0|0,0,0]=1 61 B7R1.3 C1=CC=NC(=C1)Br 6647 [1,0,0,0,0,0|2,0,0]=3 62 B7R1.3 C1=CC=[N+](C=C1)[O-] 9065 [1,0,0,0,0,0|1,0,1]=3 63 B7R1.3 C1=CN=C(C=N1)Cl 5278 [1,0,0,0,0,0|3,0,0]=4 64 B7R1.3 C1=CN=C(C=N1)N 6677 [1,0,0,0,0,0|3,0,0]=4 65 B7R1.3 C1=CN=CN=C1N 6491 [1,0,0,0,0,0|3,0,0]=4 66 B7R1.3 CC1=CN=CC=C1 8633 [1,0,0,0,0,0|1,0,0]=2 67 B7R1.3 c1c(cncn1)Br B0314 [1,0,0,0,0,0|3,0,0]=4 68 B7R1.3 c1ccc(cc1)F B0042 [1,0,0,0,0,0|1,0,0]=2 69 B7R1.3 c1ccnc(c1)Br B0025 [1,0,0,0,0,0|2,0,0]=3 70 B7R1.3 c1cnc(nc1)N A0006 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.2 C1=C(C=NC=C1Br)C#N 5232 [0,1,0,0,0,0|2,0,1]=4 72 B9R1.2 C1=C(C=NC=C1Br)C=O 6653 [0,1,0,0,0,0|2,0,1]=4 73 B9R1.2 C1=CC(=CC(=C1)Br)C=O 8210 [0,1,0,0,0,0|1,0,1]=3 74 B9R1.2 C1=CC(=CC(=C1)Br)CN 9996 [0,1,0,0,0,0|1,0,0]=2 75 B9R1.2 C1=CC(=CC(=C1)Br)NN 10008 [0,1,0,0,0,0|2,0,0]=3 76 B9R1.2 C1=CC(=CC(=C1)Cl)NN 9850 [0,1,0,0,0,0|2,0,0]=3 77 B9R1.2 C1=CC(=CC(=C1)F)C#N 8577 [0,1,0,0,0,0|1,0,1]=3 78 B9R1.2 C1=CC(=CC(=C1)F)C=O 9272 [0,1,0,0,0,0|1,0,1]=3 79 B9R1.2 C1=CC(=CC(=C1)F)CO 6086 [0,1,0,0,0,0|1,0,0]=2 80 B9R1.2 C1=CC(=CC(=C1)F)NN 5986 [0,1,0,0,0,0|2,0,0]=3 81 B9R1.2 C1=CC(=CC(=C1)I)C#N 9764 [0,1,0,0,0,0|1,0,1]=3 82 B9R1.2 C1=CC(=CC(=C1)I)C=O 9442 [0,1,0,0,0,0|1,0,1]=3 83 B9R1.2 C1=CC(=CC(=C1)N)C#N 6460 [0,1,0,0,0,0|1,0,1]=3 84 B9R1.2 C1=CC(=NC(=C1)Br)C=O 8472 [0,1,0,0,0,0|2,0,1]=4 85 B9R1.2 C1=CC(=NC(=C1)Cl)NN 9591 [0,1,0,0,0,0|3,0,0]=4 86 B9R1.2 C1=CN=C(C=C1C#N)Cl 6435 [0,1,0,0,0,0|2,0,1]=4 87 B9R1.2 C1=CN=C(C=C1CO)Br 8980 [0,1,0,0,0,0|2,0,0]=3 88 B9R1.2 C1=CN=C(C=C1Cl)CO 9975 [0,1,0,0,0,0|2,0,0]=3 89 B9R1.2 CC1=CC(=CC=C1)CBr 8441 [0,1,0,0,0,0|1,0,0]=2 90 B9R1.2 CC1=CC=CC(=C1)C=O 8187 [0,1,0,0,0,0|0,0,1]=2 91 B9R1.2 CC1=CC=CC(=N1)C#N 10417 [0,1,0,0,0,0|2,0,0]=3 92 B9R1.2 CC1=CC=CC(=N1)C=O 10415 [0,1,0,0,0,0|1,0,1]=3 93 B9R1.2 CC1=NC(=NC=C1)SC 8077 [0,1,0,0,0,0|2,1,0]=4 94 B9R1.2 COC1=CC(=CC=C1)F 5384 [0,1,0,0,0,0|1,0,0]=2 95 B9R1.2 COC1=CC(=CC=C1)S 5358 [0,1,0,0,0,0|0,1,0]=2 96 B9R1.2 COC1=CC(=CN=C1)Br 10627 [0,1,0,0,0,0|2,0,0]=3 97 B9R1.2 COC1=CC(=CN=C1)Br 5648 [0,1,0,0,0,0|2,0,0]=3 98 B9R1.2 COC1=CC=CC(=C1)N 9172 [0,1,0,0,0,0|1,0,0]=2 99 B9R1.2 COC1=NC(=CC=C1)Br 6692 [0,1,0,0,0,0|2,0,0]=3 100 B9R1.2 COC1=NC(=CC=C1)Cl 8886 [0,1,0,0,0,0|2,0,0]=3 101 B9R1.2 COC1=NC(=NC=C1)Cl 8785 [0,1,0,0,0,0|3,0,0]=4 102 B9R1.2 COc1cccc(c1)Br B0420 [0,1,0,0,0,0|1,0,0]=2 103 B9R1.2 COc1cccc(c1)Cl C0028 [0,1,0,0,0,0|1,0,0]=2 104 B9R1.2 CSC1=CC(=CC=C1)Cl 5596 [0,1,0,0,0,0|1,0,0]=2 105 B9R1.2 CSC1=CC=CC(=C1)F 9504 [0,1,0,0,0,0|1,0,0]=2 106 B9R1.2 CSC1=CC=CC(=C1)N 6516 [0,1,0,0,0,0|1,0,0]=2 107 B9R1.3 C1=C(C(=C(C=N1)Cl)Br)Cl 8892 [0,1,0,0,0,0|3,0,0]=4 108 B9R1.3 C1=C(C(=C(C=N1)Cl)N)Cl 5218 [0,1,0,0,0,0|3,0,0]=4 109 B9R1.3 C1=C(C(=O)C(=CN1)Br)Br 8526 [0,1,0,0,0,0|3,0,0]=4 110 B9R1.3 C1=CC(=C(C(=C1)Br)Cl)F 5658 [0,1,0,0,0,0|2,0,0]=3 111 B9R1.3 C1=CC(=C(C(=C1)Br)F)Cl 5208 [0,1,0,0,0,0|2,0,0]=3 112 B9R1.3 C1=CC(=C(C(=C1)Br)F)F 5097 [0,1,0,0,0,0|2,0,0]=3 113 B9R1.3 C1=CC(=C(C(=C1)Br)I)Cl B0109 [0,1,0,0,0,0|2,0,0]=3 114 B9R1.3 C1=CC(=C(C(=C1)Br)N)F 8782 [0,1,0,0,0,0|2,0,0]=3 115 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)F 8207 [0,1,0,0,0,0|2,0,0]=3 116 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)S 5293 [0,1,0,0,0,0|1,1,0]=3 117 B9R1.3 C1=CC(=C(C(=C1)Cl)F)Cl 6165 [0,1,0,0,0,0|2,0,0]=3 118 B9R1.3 C1=CC(=C(C(=C1)Cl)F)N 5333 [0,1,0,0,0,0|2,0,0]=3 119 B9R1.3 C1=CC(=C(C(=C1)Cl)F)N 6188 [0,1,0,0,0,0|2,0,0]=3 120 B9R1.3 C1=CC(=C(C(=C1)Cl)F)O 5115 [0,1,0,0,0,0|1,0,0]=2 121 B9R1.3 C1=CC(=C(C(=C1)Cl)N)Cl 5390 [0,1,0,0,0,0|2,0,0]=3 122 B9R1.3 C1=CC(=C(C(=C1)Cl)O)F 5578 [0,1,0,0,0,0|2,0,0]=3 123 B9R1.3 C1=CC(=C(C(=C1)F)Br)F 5329 [0,1,0,0,0,0|2,0,0]=3 124 B9R1.3 C1=CC(=C(C(=C1)F)F)F 9474 [0,1,0,0,0,0|2,0,0]=3 125 B9R1.3 C1=CC(=C(C(=C1)F)F)N 6062 [0,1,0,0,0,0|2,0,0]=3 126 B9R1.3 C1=CC(=C(C(=C1)F)I)F 9527 [0,1,0,0,0,0|2,0,0]=3 127 B9R1.3 C1=CC(=C(C(=C1)F)O)F 5418 [0,1,0,0,0,0|2,0,0]=3 128 B9R1.3 C1=CC(=C(C(=C1)F)O)O 6478 [0,1,0,0,0,0|1,0,0]=2 129 B9R1.3 C1=CC(=C(C(=C1)O)O)O 6821 [0,1,0,0,0,0|1,0,0]=2 130 B9R1.3 C1=CN=C(C(=C1N)Br)Cl 10232 [0,1,0,0,0,0|3,0,0]=4 131 B9R1.3 CC1=C(C(=CC=C1)Br)F 8654 [0,1,0,0,0,0|1,0,0]=2 132 B9R1.3 CC1=C(C(=CC=C1)C)Br 8575 [0,1,0,0,0,0|1,0,0]=2 133 B9R1.3 CC1=C(C(=CC=C1)C)O 5710 [0,1,0,0,0,0|1,0,0]=2 134 B9R1.3 CC1=C(C(=CC=C1)F)Br 10618 [0,1,0,0,0,0|1,0,0]=2 135 B9R1.3 CC1=C(C(=CC=C1)F)C 6112 [0,1,0,0,0,0|1,0,0]=2 136 B9R1.3 CC1=C(C(=CC=C1)F)F 9232 [0,1,0,0,0,0|1,0,0]=2 137 B9R1.3 CC1=C(C(=CC=C1)N)F 5245 [0,1,0,0,0,0|1,0,0]=2 138 B9R1.3 CC1=C(C(=NC=C1)Cl)N 5231 [0,1,0,0,0,0|2,0,0]=3 139 B9R1.3 CC1=C(C(=O)C=CO1)O 5716 [0,1,0,0,0,0|1,0,1]=3 140 B9R1.3 CC1=C(C=CC=C1Br)Cl 5544 [0,1,0,0,0,0|2,0,0]=3 141 B9R1.3 CC1=C(C=CC=C1Br)F 6229 [0,1,0,0,0,0|2,0,0]=3 142 B9R1.3 CC1=C(C=CC=C1Cl)O 8169 [0,1,0,0,0,0|1,0,0]=2 143 B9R1.3 CC1=C(C=CC=C1F)N 10395 [0,1,0,0,0,0|2,0,0]=3 144 B9R1.3 CC1=C(C=CC=C1F)O 9587 [0,1,0,0,0,0|1,0,0]=2 145 B9R1.3 CC1=C(C=CC=C1I)Cl 8102 [0,1,0,0,0,0|2,0,0]=3 146 B9R1.3 c1cc(c(c(c1)Cl)I)F C0095 [0,1,0,0,0,0|2,0,0]=3 147 B9R1.34 C1=C(C=C(C=C1Br)Br)O 8530 [0,1,0,0,0,0|1,0,0]=2 148 B9R1.34 C1=C(C=C(C=C1Cl)Cl)F 5622 [0,1,0,0,0,0|2,0,0]=3 149 B9R1.34 C1=C(C=C(C=C1F)Br)F 9223 [0,1,0,0,0,0|2,0,0]=3 150 B9R1.34 C1=C(C=C(C=C1F)Cl)N 8294 [0,1,0,0,0,0|2,0,0]=3 151 B9R1.34 C1=C(C=C(C=C1F)F)F 6040 [0,1,0,0,0,0|2,0,0]=3 152 B9R1.34 C1=C(C=C(C=C1F)F)O 5292 [0,1,0,0,0,0|1,0,0]=2 153 B9R1.34 C1=C(C=C(C=C1F)I)F 5458 [0,1,0,0,0,0|2,0,0]=3 154 B9R1.34 C1=C(C=C(N=C1Cl)Cl)N 6593 [0,1,0,0,0,0|3,0,0]=4 155 B9R1.34 CC1=CC(=CC(=C1)Br)Br 10173 [0,1,0,0,0,0|1,0,0]=2 156 B9R1.34 CC1=CC(=CC(=C1)Br)C 6396 [0,1,0,0,0,0|1,0,0]=2 157 B9R1.34 CC1=CC(=CC(=C1)Br)C 8945 [0,1,0,0,0,0|1,0,0]=2 158 B9R1.34 CC1=CC(=CC(=C1)C)C 5777 [0,1,0,0,0,0|1,0,0]=2 159 B9R1.34 CC1=CC(=CC(=C1)I)C 9209 [0,1,0,0,0,0|1,0,0]=2 160 B9R1.34 CC1=CC(=NC(=N1)Cl)C 9808 [0,1,0,0,0,0|3,0,0]=4 161 B9R1.34 CC1=CC(=NC(=N1)Cl)Cl 8104 [0,1,0,0,0,0|3,0,0]=4 162 B9R1.34 CC1=CC(=NC(=S)N1)C 6651 [0,1,0,0,0,0|2,1,0]=4 163 B9R1.34 CC1=CC(=NC(=S)N1)C 8595 [0,1,0,0,0,0|2,1,0]=4 164 B9R1.34 CC1=CC(=O)C=C(N1)C 6464 [0,1,0,0,0,0|1,0,1]=3 165 B9R1.34 CC1=CC(=O)NC(=O)N1 6750 [0,1,0,0,0,0|2,0,1]=4 166 B9R1.34 CC1=CC(=O)NC(=S)N1 10005 [0,1,0,0,0,0|2,0,1]=4 167 B9R1.34 CC1=CC(=O)NC(=S)N1 9420 [0,1,0,0,0,0|2,0,1]=4 168 B9R1.69 C1=C(C(=NC=C1Br)Cl)Cl 8489 [0,1,0,0,0,0|3,0,0]=4 169 B9R1.69 C1=C(C(=NC=C1Br)Cl)F 6501 [0,1,0,0,0,0|3,0,0]=4 170 B9R1.69 C1=C(C(=NC=C1Br)Cl)N 9545 [0,1,0,0,0,0|3,0,0]=4 171 B9R1.69 C1=C(C(=NC=C1Br)F)F 8605 [0,1,0,0,0,0|3,0,0]=4 172 B9R1.69 C1=C(C(=NC=C1Cl)Cl)N 9721 [0,1,0,0,0,0|3,0,0]=4 173 B9R1.69 C1=C(C(=NC=C1Cl)F)F 5021 [0,1,0,0,0,0|3,0,0]=4 174 B9R1.69 C1=C(C=NC(=C1Br)Cl)Br 10691 [0,1,0,0,0,0|3,0,0]=4 175 B9R1.69 C1=C(C=NC(=C1Br)Cl)Cl 6691 [0,1,0,0,0,0|3,0,0]=4 176 B9R1.69 C1=C(C=NC(=C1Br)N)Cl 6631 [0,1,0,0,0,0|3,0,0]=4 177 B9R1.69 C1=C(C=NC(=C1Cl)Br)Cl 10512 [0,1,0,0,0,0|3,0,0]=4 178 B9R1.69 C1=C(C=NC(=C1Cl)F)Cl 10235 [0,1,0,0,0,0|3,0,0]=4 179 B9R1.69 C1=C(C=NC(=C1Cl)N)Cl 8490 [0,1,0,0,0,0|3,0,0]=4 180 B9R1.69 C1=C(C=NC(=C1F)N)F 6681 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.69 C1=C(C=NC(=C1I)N)Br 9030 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.69 C1=CC(=C(C=C1Br)Br)F 6201 [0,1,0,0,0,0|2,0,0]=3 183 B9R1.69 C1=CC(=C(C=C1Br)Br)N 6160 [0,1,0,0,0,0|2,0,0]=3 184 B9R1.69 C1=CC(=C(C=C1Br)Cl)Cl 5098 [0,1,0,0,0,0|2,0,0]=3 185 B9R1.69 C1=CC(=C(C=C1Br)Cl)F 5541 [0,1,0,0,0,0|2,0,0]=3 186 B9R1.69 C1=CC(=C(C=C1Br)Cl)I 8228 [0,1,0,0,0,0|2,0,0]=3 187 B9R1.69 C1=CC(=C(C=C1Br)F)Br 5609 [0,1,0,0,0,0|2,0,0]=3 188 B9R1.69 C1=CC(=C(C=C1Br)F)Cl 5073 [0,1,0,0,0,0|2,0,0]=3 189 B9R1.69 C1=CC(=C(C=C1Br)F)Cl 6178 [0,1,0,0,0,0|2,0,0]=3 190 B9R1.69 C1=CC(=C(C=C1Br)F)F 6000 [0,1,0,0,0,0|2,0,0]=3 191 B9R1.69 C1=CC(=C(C=C1Br)F)I 5546 [0,1,0,0,0,0|2,0,0]=3 192 B9R1.69 C1=CC(=C(C=C1Br)F)N 5271 [0,1,0,0,0,0|2,0,0]=3 193 B9R1.69 C1=CC(=C(C=C1Br)F)N 5547 [0,1,0,0,0,0|2,0,0]=3 194 B9R1.69 C1=CC(=C(C=C1Br)F)O 5337 [0,1,0,0,0,0|2,0,0]=3 195 B9R1.69 C1=CC(=C(C=C1Br)N)N 5041 [0,1,0,0,0,0|2,0,0]=3 196 B9R1.69 C1=CC(=C(C=C1Br)N)O 8620 [0,1,0,0,0,0|2,0,0]=3 197 B9R1.69 C1=CC(=C(C=C1Cl)Br)F 6484 [0,1,0,0,0,0|2,0,0]=3 198 B9R1.69 C1=CC(=C(C=C1Cl)Br)N 8533 [0,1,0,0,0,0|2,0,0]=3 199 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Br 6522 [0,1,0,0,0,0|2,0,0]=3 200 B9R1.69 C1=CC(=C(C=C1Cl)Cl)F 5400 [0,1,0,0,0,0|2,0,0]=3 201 B9R1.69 C1=CC(=C(C=C1Cl)Cl)S 6151 [0,1,0,0,0,0|2,0,0]=3 202 B9R1.69 C1=CC(=C(C=C1Cl)F)Br 6177 [0,1,0,0,0,0|2,0,0]=3 203 B9R1.69 C1=CC(=C(C=C1Cl)F)I 9921 [0,1,0,0,0,0|2,0,0]=3 204 B9R1.69 C1=CC(=C(C=C1Cl)F)N 5025 [0,1,0,0,0,0|2,0,0]=3 205 B9R1.69 C1=CC(=C(C=C1Cl)F)O 8240 [0,1,0,0,0,0|2,0,0]=3 206 B9R1.69 C1=CC(=C(C=C1Cl)I)N 5011 [0,1,0,0,0,0|2,0,0]=3 207 B9R1.69 C1=CC(=C(C=C1Cl)N)Br 10527 [0,1,0,0,0,0|2,0,0]=3 208 B9R1.69 C1=CC(=C(C=C1Cl)N)F 5788 [0,1,0,0,0,0|2,0,0]=3 209 B9R1.69 C1=CC(=C(C=C1Cl)N)N 10655 [0,1,0,0,0,0|2,0,0]=3 210 B9R1.69 C1=CC(=C(C=C1F)Cl)Br 9301 [0,1,0,0,0,0|2,0,0]=3 211 B9R1.69 C1=CC(=C(C=C1F)Cl)N 6049 [0,1,0,0,0,0|2,0,0]=3 212 B9R1.69 C1=CC(=C(C=C1F)Cl)S 6413 [0,1,0,0,0,0|2,0,0]=3 213 B9R1.69 C1=CC(=C(C=C1F)F)Cl 6187 [0,1,0,0,0,0|2,0,0]=3 214 B9R1.69 C1=CC(=C(C=C1F)F)I 8762 [0,1,0,0,0,0|2,0,0]=3 215 B9R1.69 C1=CC(=C(C=C1F)F)N 5063 [0,1,0,0,0,0|2,0,0]=3 216 B9R1.69 C1=CC(=C(C=C1F)F)O 10593 [0,1,0,0,0,0|2,0,0]=3 217 B9R1.69 C1=CC(=C(C=C1F)I)N 6566 [0,1,0,0,0,0|2,0,0]=3 218 B9R1.69 C1=CC(=C(C=C1F)N)Br 5466 [0,1,0,0,0,0|2,0,0]=3 219 B9R1.69 C1=CC(=C(C=C1F)N)Cl 8573 [0,1,0,0,0,0|2,0,0]=3 220 B9R1.69 C1=CC(=C(C=C1F)N)F 5391 [0,1,0,0,0,0|2,0,0]=3 221 B9R1.69 C1=CC(=C(C=C1F)N)N 8159 [0,1,0,0,0,0|2,0,0]=3 222 B9R1.69 C1=CC(=C(C=C1F)N)O 9491 [0,1,0,0,0,0|2,0,0]=3 223 B9R1.69 C1=CC(=C(C=C1F)O)Br 6182 [0,1,0,0,0,0|1,0,0]=2 224 B9R1.69 C1=CC(=C(C=C1F)O)N 5456 [0,1,0,0,0,0|1,0,0]=2 225 B9R1.69 C1=CC(=C(C=C1I)Cl)Br 9399 [0,1,0,0,0,0|2,0,0]=3 226 B9R1.69 C1=CC(=C(C=C1I)Cl)F 8917 [0,1,0,0,0,0|2,0,0]=3 227 B9R1.69 C1=CC(=C(C=C1I)Cl)N 5567 [0,1,0,0,0,0|2,0,0]=3 228 B9R1.69 C1=CC(=C(C=C1I)F)Br 6412 [0,1,0,0,0,0|2,0,0]=3 229 B9R1.69 C1=CC(=C(C=C1I)F)F 8933 [0,1,0,0,0,0|2,0,0]=3 230 B9R1.69 C1=CC(=C(C=C1I)F)I 8788 [0,1,0,0,0,0|2,0,0]=3 231 B9R1.69 C1=CC(=C(C=C1I)F)N 5568 [0,1,0,0,0,0|2,0,0]=3 232 B9R1.69 C1=CC(=C(C=C1N)Br)Cl 8804 [0,1,0,0,0,0|2,0,0]=3 233 B9R1.69 C1=CC(=C(C=C1N)Br)F 9837 [0,1,0,0,0,0|2,0,0]=3 234 B9R1.69 C1=CC(=C(C=C1N)Cl)Cl 6584 [0,1,0,0,0,0|2,0,0]=3 235 B9R1.69 C1=CC(=C(C=C1N)Cl)F 6046 [0,1,0,0,0,0|2,0,0]=3 236 B9R1.69 C1=CC(=C(C=C1N)Cl)F 9805 [0,1,0,0,0,0|2,0,0]=3 237 B9R1.69 C1=CC(=C(C=C1N)F)F 6033 [0,1,0,0,0,0|2,0,0]=3 238 B9R1.69 C1=CC(=C(C=C1N)F)O 6473 [0,1,0,0,0,0|2,0,0]=3 239 B9R1.69 C1=CC(=C(C=C1O)F)Cl 6195 [0,1,0,0,0,0|1,0,0]=2 240 B9R1.69 C1=CC(=C(C=C1O)F)F 10058 [0,1,0,0,0,0|1,0,0]=2 241 B9R1.69 C1=CC(=C(C=C1O)N)F 8132 [0,1,0,0,0,0|1,0,0]=2 242 B9R1.69 C1=CC(=NC(=C1Cl)Cl)Cl 8065 [0,1,0,0,0,0|3,0,0]=4 243 B9R1.69 C1=CC(=NC(=C1F)F)F 8652 [0,1,0,0,0,0|3,0,0]=4 244 B9R1.69 CC1=C(C=C(C=C1)Br)Br 8117 [0,1,0,0,0,0|2,0,0]=3 245 B9R1.69 CC1=C(C=C(C=C1)Br)F 5338 [0,1,0,0,0,0|2,0,0]=3 246 B9R1.69 CC1=C(C=C(C=C1)Br)O 8476 [0,1,0,0,0,0|1,0,0]=2 247 B9R1.69 CC1=C(C=C(C=C1)Cl)Br 10285 [0,1,0,0,0,0|2,0,0]=3 248 B9R1.69 CC1=C(C=C(C=C1)Cl)I 8997 [0,1,0,0,0,0|2,0,0]=3 249 B9R1.69 CC1=C(C=C(C=C1)Cl)S 9802 [0,1,0,0,0,0|1,1,0]=3 250 B9R1.69 CC1=C(C=C(C=C1)F)Br 9373 [0,1,0,0,0,0|2,0,0]=3 251 B9R1.69 CC1=C(C=C(C=C1)F)C 6113 [0,1,0,0,0,0|1,0,0]=2 252 B9R1.69 CC1=C(C=C(C=C1)F)N 6050 [0,1,0,0,0,0|2,0,0]=3 253 B9R1.69 CC1=C(C=C(C=C1)N)F 6047 [0,1,0,0,0,0|2,0,0]=3 254 B9R1.69 CC1=C(C=C(C=C1)N)O 10159 [0,1,0,0,0,0|1,0,0]=2 255 B9R1.69 CC1=C(C=CC(=C1)Br)Br 8391 [0,1,0,0,0,0|1,0,0]=2 256 B9R1.69 CC1=C(C=CC(=C1)Br)Cl 5543 [0,1,0,0,0,0|1,0,0]=2 257 B9R1.69 CC1=C(C=CC(=C1)Br)F 6043 [0,1,0,0,0,0|1,0,0]=2 258 B9R1.69 CC1=C(C=CC(=C1)Br)I 10304 [0,1,0,0,0,0|1,0,0]=2 259 B9R1.69 CC1=C(C=CC(=C1)Br)I 6526 [0,1,0,0,0,0|1,0,0]=2 260 B9R1.69 CC1=C(C=CC(=C1)Br)N 9725 [0,1,0,0,0,0|1,0,0]=2 261 B9R1.69 CC1=C(C=CC(=C1)Br)O 5111 [0,1,0,0,0,0|1,0,0]=2 262 B9R1.69 CC1=C(C=CC(=C1)Cl)Br 9792 [0,1,0,0,0,0|1,0,0]=2 263 B9R1.69 CC1=C(C=CC(=C1)Cl)I 8729 [0,1,0,0,0,0|1,0,0]=2 264 B9R1.69 CC1=C(C=CC(=C1)F)Br 5273 [0,1,0,0,0,0|1,0,0]=2 265 B9R1.69 CC1=C(C=CC(=C1)F)Br 6041 [0,1,0,0,0,0|1,0,0]=2 266 B9R1.69 CC1=C(C=CC(=C1)F)F 5294 [0,1,0,0,0,0|1,0,0]=2 267 B9R1.69 CC1=C(C=CC(=C1)F)F 8711 [0,1,0,0,0,0|1,0,0]=2 268 B9R1.69 CC1=C(C=CC(=C1)F)I 5554 [0,1,0,0,0,0|1,0,0]=2 269 B9R1.69 CC1=C(C=CC(=C1)F)N 5346 [0,1,0,0,0,0|1,0,0]=2 270 B9R1.69 CC1=C(C=CC(=C1)I)F 6231 [0,1,0,0,0,0|1,0,0]=2 271 B9R1.69 CC1=C(C=CC(=C1)I)N 5381 [0,1,0,0,0,0|1,0,0]=2 272 B9R1.69 CC1=C(C=CC(=C1)N)Br 10225 [0,1,0,0,0,0|1,0,0]=2 273 B9R1.69 CC1=C(C=CC(=C1)N)F 5275 [0,1,0,0,0,0|1,0,0]=2 274 B9R1.69 CC1=C(C=CC(=C1)O)Br 10033 [0,1,0,0,0,0|0,0,0]=1 275 B9R1.69 CC1=C(C=CC(=C1)O)F 6307 [0,1,0,0,0,0|0,0,0]=1 276 B9R1.69 CC1=C(C=CC(=C1)O)N 10166 [0,1,0,0,0,0|0,0,0]=1 277 B9R1.69 CC1=C(C=CC(=N1)Br)Br 10157 [0,1,0,0,0,0|2,0,0]=3 278 B9R1.69 CC1=C(C=CC(=N1)Cl)Br 5242 [0,1,0,0,0,0|2,0,0]=3 279 B9R1.69 CC1=C(C=CC(=N1)Cl)F 5081 [0,1,0,0,0,0|2,0,0]=3 280 B9R1.69 CC1=C(C=CC(=N1)Cl)N 10002 [0,1,0,0,0,0|2,0,0]=3 281 B9R1.69 CC1=C(C=CC(=N1)F)Br 5681 [0,1,0,0,0,0|2,0,0]=3 282 B9R1.69 CC1=C(C=CC(=N1)F)N 8257 [0,1,0,0,0,0|2,0,0]=3 283 B9R1.69 CC1=C(C=CC(=N1)N)Br 5101 [0,1,0,0,0,0|2,0,0]=3 284 B9R1.69 CC1=C(C=CC(=N1)N)Cl C2896 [0,1,0,0,0,0|2,0,0]=3 285 B9R1.69 CC1=CC(=C(C=C1)Br)Cl 8156 [0,1,0,0,0,0|1,0,0]=2 286 B9R1.69 CC1=CC(=C(C=C1)Br)F 6101 [0,1,0,0,0,0|1,0,0]=2 287 B9R1.69 CC1=CC(=C(C=C1)C)Br 8829 [0,1,0,0,0,0|1,0,0]=2 288 B9R1.69 CC1=CC(=C(C=C1)C)I 8028 [0,1,0,0,0,0|1,0,0]=2 289 B9R1.69 CC1=CC(=C(C=C1)C)N 5322 [0,1,0,0,0,0|1,0,0]=2 290 B9R1.69 CC1=CC(=C(C=C1)C)O 6763 [0,1,0,0,0,0|0,0,0]=1 291 B9R1.69 CC1=CC(=C(C=C1)Cl)Br 5106 [0,1,0,0,0,0|1,0,0]=2 292 B9R1.69 CC1=CC(=C(C=C1)F)Br 6183 [0,1,0,0,0,0|1,0,0]=2 293 B9R1.69 CC1=CC(=C(C=C1)F)Cl 6423 [0,1,0,0,0,0|1,0,0]=2 294 B9R1.69 CC1=CC(=C(C=C1)F)I 6427 [0,1,0,0,0,0|1,0,0]=2 295 B9R1.69 CC1=CC(=C(C=C1)F)N 6577 [0,1,0,0,0,0|1,0,0]=2 296 B9R1.69 CC1=CC(=C(C=C1)F)O 5573 [0,1,0,0,0,0|0,0,0]=1 297 B9R1.69 CC1=CC(=C(C=C1)I)Br 5051 [0,1,0,0,0,0|1,0,0]=2 298 B9R1.69 CC1=CC(=C(C=C1)I)C 9318 [0,1,0,0,0,0|1,0,0]=2 299 B9R1.69 CC1=CC(=C(C=C1)N)F 6048 [0,1,0,0,0,0|1,0,0]=2 300 B9R1.69 CC1=CC(=C(C=C1)N)N 6659 [0,1,0,0,0,0|1,0,0]=2 301 B9R1.69 CC1=CC(=C(C=C1)O)Cl 10579 [0,1,0,0,0,0|1,0,0]=2 302 B9R1.69 CC1=CC(=C(C=C1)O)N 8098 [0,1,0,0,0,0|1,0,0]=2 303 B9R1.69 CC1=CC(=C(N=C1)Br)N 8112 [0,1,0,0,0,0|2,0,0]=3 304 B9R1.69 CC1=CC(=C(N=C1)Cl)Br 8055 [0,1,0,0,0,0|2,0,0]=3 305 B9R1.69 CC1=CC(=C(N=C1)Cl)F 10553 [0,1,0,0,0,0|2,0,0]=3 306 B9R1.69 CC1=CC(=C(N=C1)Cl)N 8400 [0,1,0,0,0,0|2,0,0]=3 307 B9R1.69 CC1=CC(=C(N=C1)F)Br 9709 [0,1,0,0,0,0|2,0,0]=3 308 B9R1.69 CC1=CC(=CN=C1Br)Br 5235 [0,1,0,0,0,0|2,0,0]=3 309 B9R1.69 CC1=CC(=CN=C1Cl)N 9387 [0,1,0,0,0,0|2,0,0]=3 310 B9R1.69 CC1=CC(=CN=C1F)Br 5236 [0,1,0,0,0,0|2,0,0]=3 311 B9R1.69 CC1=CC(=CN=C1N)Br 5024 [0,1,0,0,0,0|2,0,0]=3 312 B9R1.69 CC1=CC(=CN=C1N)I 6628 [0,1,0,0,0,0|2,0,0]=3 313 B9R1.69 CC1=CC(=NC=C1Br)Br 8455 [0,1,0,0,0,0|2,0,0]=3 314 B9R1.69 CC1=CC(=NN=C1Cl)Cl 6504 [0,1,0,0,0,0|3,0,0]=4 315 B9R1.69 CC1=NC(=C(C=C1)Br)C 6834 [0,1,0,0,0,0|2,0,0]=3 316 B9R1.69 CC1=NC(=C(C=C1)N)Br 6720 [0,1,0,0,0,0|2,0,0]=3 317 B9R1.69 CC1=NC(=C(C=C1)N)Cl 8825 [0,1,0,0,0,0|2,0,0]=3 318 B9R1.69 Cc1ccc(c(c1)O)N A0481 [0,1,0,0,0,0|0,0,0]=1 319 B9R1.69 c1cc(c(cc1Cl)N)N C0263 [0,1,0,0,0,0|2,0,0]=3 320 B7R1.2 C1=C(SC(=C1)Cl)Cl 6132 [0,0,0,0,1,0|3,0,0]=4 321 B7R1.2 CC1=CC(=NN1)C 10496 [0,0,0,0,1,0|3,0,0]=4 322 B7R1.2 CC1=CC(=NO1)C 9870 [0,0,0,0,1,0|3,0,0]=4 323 B7R1.2 CC1=CC(=O)NO1 9631 [0,0,0,0,1,0|2,0,1]=4 324 B7R1.2 CC1=CC=C(S1)Br 6601 [0,0,0,0,1,0|2,0,0]=3 325 B7R1.2 CC1=CSC(=N1)C 6124 [0,0,0,0,1,0|3,0,0]=4 326 B7R1.2 CC1=CSC(=N1)N 9596 [0,0,0,0,1,0|3,0,0]=4 327 B7R1.2 CN1C=CC(=N1)N 6616 [0,0,0,0,1,0|3,0,0]=4 328 B7R1.2 CN1C=CC(=N1)N 9450 [0,0,0,0,1,0|3,0,0]=4 329 B7R1.2 Cc1cc(n[nH]1)C D0196 [0,0,0,0,1,0|3,0,0]=4 330 B7R1.2 Cc1csc(n1)C D0198 [0,0,0,0,1,0|3,0,0]=4 331 B7R1.4 C1=C(C(=CS1)Br)Br 5997 [0,0,0,0,1,0|3,0,0]=4 332 B7R1.4 CC1=C(C=NN1)Br 6719 [0,0,0,0,1,0|3,0,0]=4 333 B7R1.4 CC1=C(SC=C1)Br 5664 [0,0,0,0,1,0|2,0,0]=3 334 B7R1.4 CC1=C(SC=N1)C 5281 [0,0,0,0,1,0|3,0,0]=4 335 B7R1.4 CC1=CC=NN1C 5243 [0,0,0,0,1,0|3,0,0]=4 336 B6R0.2 CC(=CC(=O)O)C 9276 [1,0,1,0,0,0|1,0,1]=4 337 B6R1.1 C1=CC=NC=C1 8793 [2,0,0,0,0,0|1,0,0]=3 338 B6R1.1 C1=CC=NN=C1 6802 [2,0,0,0,0,0|2,0,0]=4 339 B6R1.1 C1=CN=CC=N1 6118 [2,0,0,0,0,0|2,0,0]=4 340 B6R1.1 C1=CN=CC=N1 8999 [2,0,0,0,0,0|2,0,0]=4 341 B8R1.2 C1=CC(=CN=C1)CCl 5990 [1,1,0,0,0,0|1,0,0]=3 342 B8R1.2 C1=CC(=CN=C1)CN 10146 [1,1,0,0,0,0|1,0,0]=3 343 B8R1.2 C1=CC(=CN=C1)CO 8600 [1,1,0,0,0,0|1,0,0]=3 344 B8R1.2 C1=CC=C(C=C1)NN 6820 [1,1,0,0,0,0|1,0,0]=3 345 B8R1.2 C1=CC=NC(=C1)CCl 10463 [1,1,0,0,0,0|1,0,0]=3 346 B8R1.2 C1=CC=NC(=C1)CN 5496 [1,1,0,0,0,0|1,0,0]=3 347 B8R1.2 C1=CN=CC=C1CCl 8451 [1,1,0,0,0,0|1,0,0]=3 348 B8R1.2 COC1=CC=CC=N1 9619 [1,1,0,0,0,0|1,0,0]=3 349 B8R1.2 COC1=CC=NC=C1 10117 [1,1,0,0,0,0|1,0,0]=3 350 B8R1.2 c1ccnc(c1)C=O P0092 [1,1,0,0,0,0|1,0,1]=4 351 B8R1.2 c1cnccc1C=O P0128 [1,1,0,0,0,0|1,0,1]=4 352 B8R1.2 c1cnccc1C=O P0128 [1,1,0,0,0,0|1,0,1]=4 353 B8R1.3 C1=CC(=CC=C1F)Br 6014 [1,1,0,0,0,0|1,0,0]=3 354 B8R1.3 C1=CC(=CC=C1F)Cl 9763 [1,1,0,0,0,0|1,0,0]=3 355 B8R1.3 C1=CC(=CC=C1F)F 10591 [1,1,0,0,0,0|1,0,0]=3 356 B8R1.3 C1=CC(=CC=C1N)Cl 6700 [1,1,0,0,0,0|1,0,0]=3 357 B8R1.3 C1=CC(=CC=C1N)F 5032 [1,1,0,0,0,0|1,0,0]=3 358 B8R1.3 C1=CC(=CC=C1N)I 8418 [1,1,0,0,0,0|1,0,0]=3 359 B8R1.3 C1=CC(=NC=C1Br)Br 5443 [1,1,0,0,0,0|2,0,0]=4 360 B8R1.3 C1=CC(=NC=C1Br)Cl 9228 [1,1,0,0,0,0|2,0,0]=4 361 B8R1.3 C1=CC(=NC=C1Br)I 9334 [1,1,0,0,0,0|2,0,0]=4 362 B8R1.3 C1=CC(=NC=C1Br)N 10514 [1,1,0,0,0,0|2,0,0]=4 363 B8R1.3 C1=CC(=NC=C1Cl)Br 6467 [1,1,0,0,0,0|2,0,0]=4 364 B8R1.3 C1=CC(=NC=C1Cl)N 8218 [1,1,0,0,0,0|2,0,0]=4 365 B8R1.3 C1=CC(=NC=C1F)Br 10006 [1,1,0,0,0,0|2,0,0]=4 366 B8R1.3 C1=CC(=NC=C1F)Br 6615 [1,1,0,0,0,0|2,0,0]=4 367 B8R1.3 C1=CC(=NC=C1F)Cl 9957 [1,1,0,0,0,0|2,0,0]=4 368 B8R1.3 C1=CC(=NC=C1F)F 5247 [1,1,0,0,0,0|2,0,0]=4 369 B8R1.3 C1=CC(=NC=C1F)N 10320 [1,1,0,0,0,0|2,0,0]=4 370 B8R1.3 C1=CC(=NC=C1I)Br 9940 [1,1,0,0,0,0|2,0,0]=4 371 B8R1.3 C1=CC(=NC=C1I)Cl 5225 [1,1,0,0,0,0|2,0,0]=4 372 B8R1.3 C1=CC(=NC=C1I)N 5110 [1,1,0,0,0,0|2,0,0]=4 373 B8R1.3 C1=CC(=NC=C1O)Br 10436 [1,1,0,0,0,0|1,0,0]=3 374 B8R1.3 C1=CC(=NC=C1O)Cl 9958 [1,1,0,0,0,0|1,0,0]=3 375 B8R1.3 C1=CC(=O)NC=C1Br 8266 [1,1,0,0,0,0|1,0,1]=4 376 B8R1.3 C1=CC(=O)NC=C1Cl 10450 [1,1,0,0,0,0|1,0,1]=4 377 B8R1.3 C1=CC(=O)NC=C1F 8617 [1,1,0,0,0,0|1,0,1]=4 378 B8R1.3 CC1=CN=C(C=C1)Br 9393 [1,1,0,0,0,0|1,0,0]=3 379 B8R1.3 CC1=CN=C(C=C1)F 5449 [1,1,0,0,0,0|1,0,0]=3 380 B8R1.3 CC1=CNC(=O)C=C1 9951 [1,1,0,0,0,0|1,0,0]=3 381 B8R1.3 CC1=NC=C(C=C1)Br 5076 [1,1,0,0,0,0|1,0,0]=3 382 B8R1.3 CC1=NC=C(C=C1)N 10240 [1,1,0,0,0,0|1,0,0]=3 383 B8R1.3 c1cc(ccc1F)Br B0238 [1,1,0,0,0,0|1,0,0]=3 384 B8R1.3 c1cc(ccc1N)F F0045 [1,1,0,0,0,0|1,0,0]=3 385 B8R1.5 C1=CC(=C(N=C1)Br)Br 9457 [1,1,0,0,0,0|2,0,0]=4 386 B8R1.5 C1=CC(=C(N=C1)Cl)Br 9039 [1,1,0,0,0,0|2,0,0]=4 387 B8R1.5 C1=CC(=C(N=C1)Cl)Cl 5463 [1,1,0,0,0,0|2,0,0]=4 388 B8R1.5 C1=CC(=C(N=C1)Cl)Cl 6656 [1,1,0,0,0,0|2,0,0]=4 389 B8R1.5 C1=CC(=C(N=C1)Cl)F 5206 [1,1,0,0,0,0|2,0,0]=4 390 B8R1.5 C1=CC(=C(N=C1)Cl)I 8613 [1,1,0,0,0,0|2,0,0]=4 391 B8R1.5 C1=CC(=C(N=C1)Cl)N 6694 [1,1,0,0,0,0|2,0,0]=4 392 B8R1.5 C1=CC(=C(N=C1)Cl)O 6690 [1,1,0,0,0,0|1,0,0]=3 393 B8R1.5 C1=CC(=C(N=C1)F)Cl 8500 [1,1,0,0,0,0|2,0,0]=4 394 B8R1.5 C1=CC(=C(N=C1)F)F 5471 [1,1,0,0,0,0|2,0,0]=4 395 B8R1.5 C1=CC(=C(N=C1)N)Br 6715 [1,1,0,0,0,0|2,0,0]=4 396 B8R1.5 C1=CC(=C(N=C1)N)Cl 10389 [1,1,0,0,0,0|2,0,0]=4 397 B8R1.5 C1=CC(=C(N=C1)N)F 10619 [1,1,0,0,0,0|2,0,0]=4 398 B8R1.5 C1=CC(=C(N=C1)N)N 9712 [1,1,0,0,0,0|2,0,0]=4 399 B8R1.5 C1=CC=C(C(=C1)Br)Br 5382 [1,1,0,0,0,0|1,0,0]=3 400 B8R1.5 C1=CC=C(C(=C1)Br)I 6003 [1,1,0,0,0,0|1,0,0]=3 401 B8R1.5 C1=CC=C(C(=C1)Cl)Br 9010 [1,1,0,0,0,0|1,0,0]=3 402 B8R1.5 C1=CC=C(C(=C1)Cl)Cl 5752 [1,1,0,0,0,0|1,0,0]=3 403 B8R1.5 C1=CC=C(C(=C1)F)Br 6002 [1,1,0,0,0,0|1,0,0]=3 404 B8R1.5 C1=CC=C(C(=C1)F)Cl 10274 [1,1,0,0,0,0|1,0,0]=3 405 B8R1.5 C1=CC=C(C(=C1)F)Cl 6006 [1,1,0,0,0,0|1,0,0]=3 406 B8R1.5 C1=CC=C(C(=C1)F)F 6007 [1,1,0,0,0,0|1,0,0]=3 407 B8R1.5 C1=CC=C(C(=C1)F)F 8369 [1,1,0,0,0,0|1,0,0]=3 408 B8R1.5 C1=CC=C(C(=C1)N)Br 5510 [1,1,0,0,0,0|1,0,0]=3 409 B8R1.5 C1=CC=C(C(=C1)N)F 6030 [1,1,0,0,0,0|1,0,0]=3 410 B8R1.5 C1=CC=C(C(=C1)N)I 9774 [1,1,0,0,0,0|1,0,0]=3 411 B8R1.5 C1=CC=C(C(=C1)O)Br 8498 [1,1,0,0,0,0|0,0,0]=2 412 B8R1.5 C1=CN=CC(=C1Br)Cl 6714 [1,1,0,0,0,0|2,0,0]=4 413 B8R1.5 C1=CN=CC(=C1Cl)Cl 6626 [1,1,0,0,0,0|2,0,0]=4 414 B8R1.5 C1=CN=CC(=C1Cl)F 6867 [1,1,0,0,0,0|2,0,0]=4 415 B8R1.5 C1=CN=CC(=C1I)F 8281 [1,1,0,0,0,0|2,0,0]=4 416 B8R1.5 C1=CN=CC(=C1N)Br 9751 [1,1,0,0,0,0|2,0,0]=4 417 B8R1.5 C1=CN=CC(=C1N)N 9425 [1,1,0,0,0,0|2,0,0]=4 418 B8R1.5 C1=CNC=C(C1=O)N 9533 [1,1,0,0,0,0|1,0,1]=4 419 B8R1.5 CC1=C(C=CC=N1)Br 5675 [1,1,0,0,0,0|1,0,0]=3 420 B8R1.5 CC1=C(C=CC=N1)N 10626 [1,1,0,0,0,0|1,0,0]=3 421 B8R1.5 CC1=C(C=CN=C1)Cl 9936 [1,1,0,0,0,0|1,0,0]=3 422 B8R1.5 CC1=C(C=NC=C1)Br 10003 [1,1,0,0,0,0|1,0,0]=3 423 B8R1.5 CC1=C(N=CC=C1)Br 8086 [1,1,0,0,0,0|1,0,0]=3 424 B8R1.5 CC1=CC=CC=C1Cl 5808 [1,1,0,0,0,0|0,0,0]=2 425 B8R1.5 CC1=CC=CC=C1I 5298 [1,1,0,0,0,0|0,0,0]=2 426 B8R1.5 CC1=NC=CN=C1C 10470 [1,1,0,0,0,0|2,0,0]=4 427 B8R1.5 c1ccc(c(c1)N)F F0011 [1,1,0,0,0,0|1,0,0]=3 428 B8R1.1 CC1=NC(=CS1)CO M0721 [0,1,0,0,1,0|2,0,0]=4 429 B8R1.1 CC1=NOC(=C1)CO M0741 [0,1,0,0,1,0|2,0,0]=4 430 B8R1.11 CN1C=CN=C1CO 10537 [0,1,0,0,1,0|2,0,0]=4 431 B10R1.2 C1=CC(=C(C(=C1)Br)F)C#N 10090 [0,2,0,0,0,0|1,0,1]=4 432 B10R1.2 C1=CC(=C(C(=C1)Cl)Cl)C=O 6819 [0,2,0,0,0,0|1,0,1]=4 433 B10R1.2 C1=CC(=C(C(=C1)Cl)F)C#N 10487 [0,2,0,0,0,0|1,0,1]=4 434 B10R1.2 C1=CC(=C(C(=C1)Cl)F)C=O 5345 [0,2,0,0,0,0|1,0,1]=4 435 B10R1.2 C1=CC(=C(C(=C1)Cl)F)C=O 6249 [0,2,0,0,0,0|1,0,1]=4 436 B10R1.2 C1=CC(=C(C(=C1)Cl)F)CN 6252 [0,2,0,0,0,0|1,0,0]=3 437 B10R1.2 C1=CC(=C(C(=C1)F)Cl)C#N 6689 [0,2,0,0,0,0|1,0,1]=4 438 B10R1.2 C1=CC(=C(C(=C1)F)F)C#N 6064 [0,2,0,0,0,0|1,0,1]=4 439 B10R1.2 C1=CC(=C(C(=C1)F)F)C=O 6063 [0,2,0,0,0,0|1,0,1]=4 440 B10R1.2 C1=CC(=C(C(=C1)F)F)CBr 9909 [0,2,0,0,0,0|1,0,0]=3 441 B10R1.2 CC1=C(C(=CC=C1)CN)C 6546 [0,2,0,0,0,0|1,0,0]=3 442 B10R1.2 CC1=C(C=CC=C1Br)C#N 6769 [0,2,0,0,0,0|1,0,1]=4 443 B10R1.2 CC1=C(C=CC=C1Cl)C#N 5120 [0,2,0,0,0,0|1,0,1]=4 444 B10R1.2 CC1=C(C=CC=C1Cl)CN 6533 [0,2,0,0,0,0|1,0,0]=3 445 B10R1.2 CC1=C(C=CC=C1F)C=O 9593 [0,2,0,0,0,0|1,0,1]=4 446 B10R1.2 CC1=CC=CC(=C1C)C#N 5505 [0,2,0,0,0,0|1,0,0]=3 447 B10R1.2 CC1=CC=CC(=C1C)C=O 9617 [0,2,0,0,0,0|0,0,1]=3 448 B10R1.2 CC1=CC=CC(=C1F)C#N 9385 [0,2,0,0,0,0|1,0,0]=3 449 B10R1.2 COC1=C(C(=CC=C1)Cl)F 9762 [0,2,0,0,0,0|1,0,0]=3 450 B10R1.2 COC1=C(C(=CC=C1)F)Br 9813 [0,2,0,0,0,0|1,0,0]=3 451 B10R1.2 COC1=C(C(=CC=C1)F)F 5984 [0,2,0,0,0,0|1,0,0]=3 452 B10R1.8 C1=C(C=C(C=C1Br)Br)C#N 8392 [0,2,0,0,0,0|1,0,1]=4 453 B10R1.8 C1=C(C=C(C=C1Cl)Cl)C#N 9291 [0,2,0,0,0,0|1,0,1]=4 454 B10R1.8 C1=C(C=C(C=C1Cl)Cl)C=O 5160 [0,2,0,0,0,0|1,0,1]=4 455 B10R1.8 C1=C(C=C(C=C1F)Br)C#N 6488 [0,2,0,0,0,0|1,0,1]=4 456 B10R1.8 C1=C(C=C(C=C1F)Br)C=O 6486 [0,2,0,0,0,0|1,0,1]=4 457 B10R1.8 C1=C(C=C(C=C1F)F)C#N 5396 [0,2,0,0,0,0|1,0,1]=4 458 B10R1.8 C1=C(C=C(C=C1F)F)C=O 10353 [0,2,0,0,0,0|1,0,1]=4 459 B10R1.8 C1=C(C=C(C=C1F)F)CN 5621 [0,2,0,0,0,0|1,0,0]=3 460 B10R1.8 C1=C(C=C(C=C1F)F)CO 5620 [0,2,0,0,0,0|1,0,0]=3 461 B10R1.8 C1=C(C=C(C=C1N)F)C#N 10089 [0,2,0,0,0,0|1,0,1]=4 462 B10R1.8 CC1=CC(=CC(=C1)C=O)Br 9180 [0,2,0,0,0,0|0,0,1]=3 463 B10R1.8 CCC1=CC(=CC(=C1)F)F 8659 [0,2,0,0,0,0|1,0,0]=3 464 B10R1.8 COC1=CC(=CC(=C1)F)F 5612 [0,2,0,0,0,0|1,0,0]=3 465 B10R1.8 COC1=CC(=CC(=C1)F)F 6102 [0,2,0,0,0,0|1,0,0]=3 466 B10R1.8 COc1cc(cc(c1)Br)N B0462 [0,2,0,0,0,0|1,0,0]=3 467 B10R1.8 CSC1=CC(=CC(=C1)Cl)Cl 8512 [0,2,0,0,0,0|1,0,0]=3 468 B10R1.8 c1c(cc(cc1F)F)C=O D0345 [0,2,0,0,0,0|1,0,1]=4 469 B10R1.10 C1=CC(=CC(=C1)Br)CCN 8847 [0,2,0,0,0,0|1,0,0]=3 470 B10R1.10 C1=CC(=CC(=C1)Cl)CCN 8166 [0,2,0,0,0,0|1,0,0]=3 471 B10R1.10 C1=CC(=CC(=C1)Cl)N=C=O 8145 [0,2,0,0,0,0|1,0,1]=4 472 B10R1.10 C1=CC(=CC(=C1)F)CC#N 9476 [0,2,0,0,0,0|1,0,0]=3 473 B10R1.10 CC1=CC(=CC=C1)CCO 8299 [0,2,0,0,0,0|0,0,0]=2 474 B10R1.10 CC1=CC(=CC=C1)N=C=S 8382 [0,2,0,0,0,0|0,1,0]=3 475 B10R1.30 C1=CC(=C(C=C1Br)C#N)Cl 8108 [0,2,0,0,0,0|1,0,1]=4 476 B10R1.30 C1=CC(=C(C=C1Br)C#N)N 5314 [0,2,0,0,0,0|1,0,1]=4 477 B10R1.30 C1=CC(=C(C=C1Cl)C#N)Br 5321 [0,2,0,0,0,0|1,0,1]=4 478 B10R1.30 C1=CC(=C(C=C1Cl)C#N)F 6250 [0,2,0,0,0,0|1,0,1]=4 479 B10R1.30 C1=CC(=C(C=C1Cl)C=O)Br 10177 [0,2,0,0,0,0|1,0,1]=4 480 B10R1.30 C1=CC(=C(C=C1Cl)C=O)O 6718 [0,2,0,0,0,0|1,0,1]=4 481 B10R1.30 C1=CC(=C(C=C1Cl)CN)F 9760 [0,2,0,0,0,0|1,0,0]=3 482 B10R1.30 C1=CC(=C(C=C1F)C#N)Br 6487 [0,2,0,0,0,0|1,0,1]=4 483 B10R1.30 C1=CC(=C(C=C1F)C#N)F 9298 [0,2,0,0,0,0|1,0,1]=4 484 B10R1.30 C1=CC(=C(C=C1F)C=O)O 10080 [0,2,0,0,0,0|1,0,1]=4 485 B10R1.30 C1=CC(=C(C=C1F)CBr)Br 9632 [0,2,0,0,0,0|1,0,0]=3 486 B10R1.30 C1=CC(=C(C=C1F)CBr)F 8216 [0,2,0,0,0,0|1,0,0]=3 487 B10R1.30 C1=CC(=C(C=C1F)CCl)F 9199 [0,2,0,0,0,0|1,0,0]=3 488 B10R1.30 C1=CC(=C(C=C1F)CN)F 6209 [0,2,0,0,0,0|1,0,0]=3 489 B10R1.30 C1=CC(=C(C=C1F)CO)Br 8036 [0,2,0,0,0,0|1,0,0]=3 490 B10R1.30 C1=CC(=C(C=C1F)CO)F 6070 [0,2,0,0,0,0|1,0,0]=3 491 B10R1.30 C1=CC(=C(C=C1I)C=O)F 9372 [0,2,0,0,0,0|1,0,1]=4 492 B10R1.30 C1=CC(=C(C=C1N)C#N)F 5450 [0,2,0,0,0,0|1,0,1]=4 493 B10R1.30 C1=CC(=C(C=C1O)C=O)Br 8805 [0,2,0,0,0,0|0,0,1]=3 494 B10R1.30 CC1=C(C=C(C=C1)Cl)CN 6534 [0,2,0,0,0,0|1,0,0]=3 495 B10R1.30 CC1=C(C=C(C=C1)F)CBr 8570 [0,2,0,0,0,0|1,0,0]=3 496 B10R1.30 CC1=C(C=C(C=C1)N)C#N 9614 [0,2,0,0,0,0|1,0,1]=4 497 B10R1.30 CC1=CC(=C(C=C1)C)C#N 6545 [0,2,0,0,0,0|1,0,0]=3 498 B10R1.30 CC1=CC(=C(C=C1)F)C#N 6447 [0,2,0,0,0,0|1,0,0]=3 499 B10R1.30 COC1=C(C=CC(=C1)Br)Cl 9742 [0,2,0,0,0,0|1,0,0]=3 500 B10R1.30 COC1=C(C=CC(=C1)Br)F 5237 [0,2,0,0,0,0|1,0,0]=3 501 B10R1.30 COC1=C(C=CC(=C1)Br)N 5264 [0,2,0,0,0,0|1,0,0]=3 502 B10R1.30 COC1=C(C=CC(=C1)Br)O 6868 [0,2,0,0,0,0|1,0,0]=3 503 B10R1.30 COC1=C(C=CC(=C1)F)F 8359 [0,2,0,0,0,0|1,0,0]=3 504 B10R1.30 c1cc(c(cc1F)CBr)Cl C0029 [0,2,0,0,0,0|1,0,0]=3 505 B10R1.113 B(C1=CC(=CC=C1)Br)(O)O 10119 [0,2,0,0,0,0|1,0,0]=3 506 B10R1.113 B(C1=CC(=CC=C1)F)(O)O 5003 [0,2,0,0,0,0|1,0,0]=3 507 B10R1.113 B(C1=CC(=NC=C1)Cl)(O)O 9355 [0,2,0,0,0,0|2,0,0]=4 508 B10R1.113 C1=C(C=C(C=C1)I)[N+](=O)[O-] 10012 [0,2,0,0,0,0|1,0,1]=4 509 B10R1.113 C1=C(C=NC=C1Cl)C(=O)O 10525 [0,2,0,0,0,0|2,0,0]=4 510 B10R1.113 C1=C(C=NC=C1N)C(=O)O 9365 [0,2,0,0,0,0|2,0,0]=4 511 B10R1.113 C1=C(C=NC=C1O)C(=O)O 5442 [0,2,0,0,0,0|1,0,1]=4 512 B10R1.113 C1=CC(=CC(=C1)Br)C(F)F 8828 [0,2,0,0,0,0|1,0,0]=3 513 B10R1.113 C1=CC(=CC(=C1)F)C(=O)Cl 8192 [0,2,0,0,0,0|1,0,1]=4 514 B10R1.113 C1=CC(=CC(=C1)F)C(=O)O 6085 [0,2,0,0,0,0|1,0,0]=3 515 B10R1.113 C1=CC(=CC(=C1)F)[N+](=O)[O-] 5276 [0,2,0,0,0,0|1,0,1]=4 516 B10R1.113 C1=CC(=CC(=C1)I)C(=O)O 8319 [0,2,0,0,0,0|1,0,0]=3 517 B10R1.113 C1=CC(=NC(=C1)Cl)C(=O)O 5646 [0,2,0,0,0,0|2,0,0]=4 518 B10R1.113 C1=CC(=NC(=C1)Cl)C(=O)O 5677 [0,2,0,0,0,0|2,0,0]=4 519 B10R1.113 C1=CC(=NC(=C1)N)C(=O)O 5464 [0,2,0,0,0,0|2,0,0]=4 520 B10R1.113 C1=CC(=O)NC(=C1)C(=O)O 6697 [0,2,0,0,0,0|2,0,0]=4 521 B10R1.113 C1=CN=C(C=C1Br)C(=O)O 5698 [0,2,0,0,0,0|2,0,0]=4 522 B10R1.113 C1=CN=C(C=C1C(=O)O)Cl 6443 [0,2,0,0,0,0|2,0,0]=4 523 B10R1.113 C1=CN=C(C=C1Cl)C(=O)O 9386 [0,2,0,0,0,0|2,0,0]=4 524 B10R1.113 C1=CNC(=O)C=C1C(=O)O 5040 [0,2,0,0,0,0|2,0,0]=4 525 B10R1.113 C1=CNC(=O)C=C1C(=O)O 8855 [0,2,0,0,0,0|2,0,0]=4 526 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl 10105 [0,2,0,0,0,0|1,0,0]=3 527 B10R1.113 CC(=O)C1=CC(=CC=C1)F 8337 [0,2,0,0,0,0|1,0,0]=3 528 B10R1.113 CC(=O)C1=CC(=CC=C1)I 6861 [0,2,0,0,0,0|1,0,0]=3 529 B10R1.113 CC(=O)C1=CC(=CC=C1)O 5263 [0,2,0,0,0,0|0,0,0]=2 530 B10R1.113 CC(=O)C1=NC(=CC=C1)Br 10007 [0,2,0,0,0,0|2,0,0]=4 531 B10R1.113 CC1=CN=CC(=C1)C(=O)O 9194 [0,2,0,0,0,0|1,0,0]=3 532 B10R1.113 CC1=NC=CC(=C1)[N+](=O)[O-] 8373 [0,2,0,0,0,0|1,0,1]=4 533 B10R1.172 C1=CC(=CC(=C1)C=O)C=O 6830 [0,2,0,0,0,0|0,0,2]=4 534 B10R1.172 COC1=CC(=CC=C1)SC 6568 [0,2,0,0,0,0|0,0,0]=2 535 B10R1.172 COC1=CC=CC(=C1)C#N 8238 [0,2,0,0,0,0|0,0,1]=3 536 B10R1.172 COC1=CC=CC(=C1)CCl 8952 [0,2,0,0,0,0|0,0,0]=2 537 B10R1.172 COC1=CC=CC(=N1)C=O 8456 [0,2,0,0,0,0|1,0,1]=4 538 B10R1.172 COC1=CN=CC(=N1)OC 9384 [0,2,0,0,0,0|2,0,0]=4 539 B10R1.176 C1=CC(=C(C=C1C#N)Br)Cl 6640 [0,2,0,0,0,0|1,0,1]=4 540 B10R1.176 C1=CC(=C(C=C1C#N)Cl)Br 6661 [0,2,0,0,0,0|1,0,1]=4 541 B10R1.176 C1=CC(=C(C=C1C#N)Cl)F 6192 [0,2,0,0,0,0|1,0,1]=4 542 B10R1.176 C1=CC(=C(C=C1C#N)Cl)N 6638 [0,2,0,0,0,0|1,0,1]=4 543 B10R1.176 C1=CC(=C(C=C1C#N)F)Cl 6471 [0,2,0,0,0,0|1,0,1]=4 544 B10R1.176 C1=CC(=C(C=C1C#N)F)F 6081 [0,2,0,0,0,0|1,0,1]=4 545 B10R1.176 C1=CC(=C(C=C1C#N)F)I 9562 [0,2,0,0,0,0|1,0,1]=4 546 B10R1.176 C1=CC(=C(C=C1C#N)F)N 5472 [0,2,0,0,0,0|1,0,1]=4 547 B10R1.176 C1=CC(=C(C=C1C#N)I)N 5523 [0,2,0,0,0,0|1,0,1]=4 548 B10R1.176 C1=CC(=C(C=C1C#N)N)Cl 8642 [0,2,0,0,0,0|1,0,1]=4 549 B10R1.176 C1=CC(=C(C=C1C#N)N)F 10652 [0,2,0,0,0,0|1,0,1]=4 550 B10R1.176 C1=CC(=C(C=C1C=O)Br)F 5548 [0,2,0,0,0,0|1,0,1]=4 551 B10R1.176 C1=CC(=C(C=C1C=O)Cl)Br 9404 [0,2,0,0,0,0|1,0,1]=4 552 B10R1.176 C1=CC(=C(C=C1C=O)Cl)F 8322 [0,2,0,0,0,0|1,0,1]=4 553 B10R1.176 C1=CC(=C(C=C1C=O)F)Br 9383 [0,2,0,0,0,0|1,0,1]=4 554 B10R1.176 C1=CC(=C(C=C1C=O)F)F 5614 [0,2,0,0,0,0|1,0,1]=4 555 B10R1.176 C1=CC(=C(C=C1C=O)F)O 9932 [0,2,0,0,0,0|1,0,1]=4 556 B10R1.176 C1=CC(=C(C=C1C=O)O)O 6767 [0,2,0,0,0,0|0,0,1]=3 557 B10R1.176 C1=CC(=C(C=C1CBr)Cl)Cl 6739 [0,2,0,0,0,0|1,0,0]=3 558 B10R1.176 C1=CC(=C(C=C1CBr)F)Cl 6576 [0,2,0,0,0,0|1,0,0]=3 559 B10R1.176 C1=CC(=C(C=C1CCl)F)F 5398 [0,2,0,0,0,0|1,0,0]=3 560 B10R1.176 C1=CC(=C(C=C1CN)Cl)F 8697 [0,2,0,0,0,0|1,0,0]=3 561 B10R1.176 C1=CC(=C(C=C1CO)Br)O 9541 [0,2,0,0,0,0|1,0,0]=3 562 B10R1.176 C1=CC(=C(C=C1CO)Cl)F 5350 [0,2,0,0,0,0|1,0,0]=3 563 B10R1.176 C1=CC(=C(C=C1CO)F)Cl 6586 [0,2,0,0,0,0|1,0,0]=3 564 B10R1.176 C1=CC(=C(C=C1CO)F)F 5618 [0,2,0,0,0,0|1,0,0]=3 565 B10R1.176 CC1=C(C=C(C=C1)C#N)Br 6755 [0,2,0,0,0,0|1,0,1]=4 566 B10R1.176 CC1=C(C=C(C=C1)C#N)F 9664 [0,2,0,0,0,0|1,0,1]=4 567 B10R1.176 CC1=C(C=C(C=C1)C#N)N 8423 [0,2,0,0,0,0|1,0,1]=4 568 B10R1.176 CC1=C(C=C(C=C1)C=O)F 6278 [0,2,0,0,0,0|1,0,1]=4 569 B10R1.176 CC1=C(C=C(C=C1)C=O)F 6279 [0,2,0,0,0,0|1,0,1]=4 570 B10R1.176 CC1=C(C=C(C=C1)CBr)F 8915 [0,2,0,0,0,0|1,0,0]=3 571 B10R1.176 CC1=C(C=C(C=C1)CN)C 6547 [0,2,0,0,0,0|1,0,0]=3 572 B10R1.176 CC1=C(C=C(C=C1)CN)F 8324 [0,2,0,0,0,0|1,0,0]=3 573 B10R1.176 CC1=C(C=C(C=C1)CO)F 8904 [0,2,0,0,0,0|1,0,0]=3 574 B10R1.176 CC1=C(C=C(C=C1)OC)Cl 8676 [0,2,0,0,0,0|1,0,0]=3 575 B10R1.176 CC1=C(C=CC(=C1)C#N)F 6655 [0,2,0,0,0,0|1,0,0]=3 576 B10R1.176 CC1=C(C=CC(=C1)CBr)F 9893 [0,2,0,0,0,0|1,0,0]=3 577 B10R1.176 CC1=C(C=CC(=C1)CN)F 8722 [0,2,0,0,0,0|1,0,0]=3 578 B10R1.176 CC1=C(C=CC(=N1)OC)Br 5248 [0,2,0,0,0,0|1,0,0]=3 579 B10R1.176 CC1=CC(=NC=C1N)OC 5687 [0,2,0,0,0,0|1,0,0]=3 580 B10R1.176 COC1=CC(=C(C=C1)Br)F 5203 [0,2,0,0,0,0|1,0,0]=3 581 B10R1.176 COC1=CC(=C(C=C1)Cl)Br 8084 [0,2,0,0,0,0|1,0,0]=3 582 B10R1.176 COC1=CC(=C(C=C1)F)F 5159 [0,2,0,0,0,0|1,0,0]=3 583 B10R1.176 COC1=CC(=C(C=C1)O)Br 8831 [0,2,0,0,0,0|1,0,0]=3 584 B10R1.176 c1cc(c(cc1CN)F)Cl C0229 [0,2,0,0,0,0|1,0,0]=3 585 B10R1.22 C1=C(C=C(C(=C1Br)Cl)F)Cl 8902 [0,2,0,0,0,0|2,0,0]=4 586 B10R1.22 C1=C(C=C(C(=C1Br)I)Br)F 8585 [0,2,0,0,0,0|2,0,0]=4 587 B10R1.22 C1=C(C=C(C(=C1Br)I)F)Cl 6612 [0,2,0,0,0,0|2,0,0]=4 588 B10R1.22 C1=C(C=C(C(=C1Cl)F)Cl)N 8435 [0,2,0,0,0,0|2,0,0]=4 589 B10R1.22 C1=C(C=C(C(=C1Cl)O)F)Br 10302 [0,2,0,0,0,0|2,0,0]=4 590 B10R1.22 C1=C(C=C(C(=C1F)Br)F)Cl 9364 [0,2,0,0,0,0|2,0,0]=4 591 B10R1.22 C1=C(C=C(C(=C1F)Br)F)F 6056 [0,2,0,0,0,0|2,0,0]=4 592 B10R1.22 C1=C(C=C(C(=C1F)Br)F)I 10292 [0,2,0,0,0,0|2,0,0]=4 593 B10R1.22 C1=C(C=C(C(=C1F)Br)F)N 10112 [0,2,0,0,0,0|2,0,0]=4 594 B10R1.22 C1=C(C=C(C(=C1F)F)F)Br 5965 [0,2,0,0,0,0|2,0,0]=4 595 B10R1.22 C1=C(C=C(C(=C1F)F)F)N 5140 [0,2,0,0,0,0|2,0,0]=4 596 B10R1.22 C1=C(C=C(C(=C1F)F)F)O 5145 [0,2,0,0,0,0|1,0,0]=3 597 B10R1.22 C1=C(C=C(C(=C1F)F)O)Br 8561 [0,2,0,0,0,0|1,0,0]=3 598 B10R1.22 C1=C(C=C(C(=C1F)I)F)Br 9280 [0,2,0,0,0,0|2,0,0]=4 599 B10R1.22 C1=C(C=C(C(=C1F)I)F)N 8249 [0,2,0,0,0,0|2,0,0]=4 600 B10R1.22 C1=C(C=C(C(=C1F)N)F)Br 8942 [0,2,0,0,0,0|2,0,0]=4 601 B10R1.22 C1=C(C=C(C(=C1F)N)N)F 8463 [0,2,0,0,0,0|2,0,0]=4 602 B10R1.22 C1=C(C=C(C(=C1F)O)Br)F 5969 [0,2,0,0,0,0|2,0,0]=4 603 B10R1.22 C1=C(C=C(C(=C1F)O)F)Br 6378 [0,2,0,0,0,0|2,0,0]=4 604 B10R1.22 C1=C(C=C(C(=C1F)O)F)F 5591 [0,2,0,0,0,0|2,0,0]=4 605 B10R1.22 CC1=CC(=C(C(=C1)Br)N)Br 6657 [0,2,0,0,0,0|1,0,0]=3 606 B10R1.22 CC1=CC(=C(C(=C1)C)I)C 5640 [0,2,0,0,0,0|1,0,0]=3 607 B10R1.22 CC1=CC(=C(C(=C1)O)C)C 9036 [0,2,0,0,0,0|0,0,0]=2 608 B10R1.22 CC1=CC(=CC(=C1F)C)Br 8749 [0,2,0,0,0,0|1,0,0]=3 609 B10R1.22 CC1=CC(=CC(=C1I)C)Br 6527 [0,2,0,0,0,0|1,0,0]=3 610 B10R1.22 CC1=CC(=CC(=C1N)C)Br 8071 [0,2,0,0,0,0|1,0,0]=3 611 B10R1.22 CC1=CC(=CC(=C1O)Cl)Br 10541 [0,2,0,0,0,0|1,0,0]=3 612 B10R1.22 CC1=CC(=O)NC(=C1C)O 6842 [0,2,0,0,0,0|1,0,0]=3 613 B10R1.22 c1c(cc(c(c1F)Br)Cl)Br D1021 [0,2,0,0,0,0|2,0,0]=4 614 B10R1.119 C1=CC(=C(C(=C1F)F)F)F 5280 [0,2,0,0,0,0|2,0,0]=4 615 B10R1.119 C1=CC(=C(C(=C1F)F)F)I 6573 [0,2,0,0,0,0|2,0,0]=4 616 B10R1.119 C1=CC(=C(C(=C1F)N)F)F 6061 [0,2,0,0,0,0|2,0,0]=4 617 B10R1.119 C1=CC(=C(C(=C1F)O)Cl)F 9245 [0,2,0,0,0,0|1,0,0]=3 618 B10R1.119 C1=CC(=C(C(=C1F)O)F)Cl 6248 [0,2,0,0,0,0|1,0,0]=3 619 B10R1.119 C1=CC(=C(C(=C1F)O)F)F 5590 [0,2,0,0,0,0|1,0,0]=3 620 B10R1.119 C1=CC(=C(C(=C1N)F)Cl)Br 9702 [0,2,0,0,0,0|2,0,0]=4 621 B10R1.119 C1=CC(=C(C(=C1N)F)F)F 6057 [0,2,0,0,0,0|2,0,0]=4 622 B10R1.119 C1=CC(=C(C(=C1O)F)F)Br 9998 [0,2,0,0,0,0|1,0,0]=3 623 B10R1.119 C1=CC(=C(C(=C1O)F)F)F 6059 [0,2,0,0,0,0|1,0,0]=3 624 B10R1.119 C1=CC(=C(C(=C1O)F)F)F 6060 [0,2,0,0,0,0|1,0,0]=3 625 B10R1.119 CC1=C(C(=C(C=C1)Cl)O)F 6260 [0,2,0,0,0,0|0,0,0]=2 626 B10R1.119 CC1=C(C(=C(C=C1)F)O)Cl 6259 [0,2,0,0,0,0|0,0,0]=2 627 B10R1.119 CC1=C(C(=C(C=C1)F)O)F 6277 [0,2,0,0,0,0|0,0,0]=2 628 B10R1.119 CC1=C(C(=C(C=C1)O)F)F 6276 [0,2,0,0,0,0|1,0,0]=3 629 B10R1.119 CC1=C(C(=NC=C1Br)N)Br 9508 [0,2,0,0,0,0|2,0,0]=4 630 B10R1.119 CC1=C(C=CC(=C1C)O)O 10027 [0,2,0,0,0,0|0,0,0]=2 631 B10R1.245 C1=CC(=C(C(=C1)Br)C#N)N 10485 [0,2,0,0,0,0|2,0,0]=4 632 B10R1.245 C1=CC(=C(C(=C1)Br)C=O)F 8811 [0,2,0,0,0,0|2,0,0]=4 633 B10R1.245 C1=CC(=C(C(=C1)Cl)C#N)Cl 8090 [0,2,0,0,0,0|2,0,0]=4 634 B10R1.245 C1=CC(=C(C(=C1)Cl)C#N)F 6235 [0,2,0,0,0,0|2,0,0]=4 635 B10R1.245 C1=CC(=C(C(=C1)Cl)C=O)F 8182 [0,2,0,0,0,0|2,0,0]=4 636 B10R1.245 C1=CC(=C(C(=C1)Cl)CBr)F 5354 [0,2,0,0,0,0|2,0,0]=4 637 B10R1.245 C1=CC(=C(C(=C1)Cl)CCl)F 5130 [0,2,0,0,0,0|2,0,0]=4 638 B10R1.245 C1=CC(=C(C(=C1)Cl)CN)F 8913 [0,2,0,0,0,0|2,0,0]=4 639 B10R1.245 C1=CC(=C(C(=C1)F)C#N)F 6071 [0,2,0,0,0,0|2,0,0]=4 640 B10R1.245 C1=CC(=C(C(=C1)F)C#N)N 6171 [0,2,0,0,0,0|2,0,0]=4 641 B10R1.245 C1=CC(=C(C(=C1)F)C#N)O 5655 [0,2,0,0,0,0|1,0,0]=3 642 B10R1.245 C1=CC(=C(C(=C1)F)C=O)F 5392 [0,2,0,0,0,0|2,0,0]=4 643 B10R1.245 C1=CC(=C(C(=C1)F)CBr)F 5163 [0,2,0,0,0,0|2,0,0]=4 644 B10R1.245 C1=CC(=C(C(=C1)F)CN)F 5399 [0,2,0,0,0,0|2,0,0]=4 645 B10R1.245 C1=CC(=C(C(=C1)F)CN)N 10115 [0,2,0,0,0,0|2,0,0]=4 646 B10R1.245 C1=CC(=C(C(=C1)F)CO)F 6072 [0,2,0,0,0,0|2,0,0]=4 647 B10R1.245 C1=CC(=C(C(=C1)I)C#N)F 6301 [0,2,0,0,0,0|2,0,0]=4 648 B10R1.245 CC1=C(C(=CC=C1)C)C=O 8504 [0,2,0,0,0,0|1,0,0]=3 649 B10R1.245 CC1=C(C(=CC=C1)C)CCl 6548 [0,2,0,0,0,0|1,0,0]=3 650 B10R1.245 CC1=C(C(=CC=C1)Cl)C=O 9501 [0,2,0,0,0,0|1,0,0]=3 651 B10R1.245 COC1=C(C=CC=C1Cl)F 5577 [0,2,0,0,0,0|2,0,0]=4 652 B10R1.245 COC1=C(C=CC=C1F)F 10315 [0,2,0,0,0,0|2,0,0]=4 653 B10R1.25 C1=CC(=C(C=C1Br)Cl)C#N 8523 [0,2,0,0,0,0|2,0,0]=4 654 B10R1.25 C1=CC(=C(C=C1Br)F)C#N 5335 [0,2,0,0,0,0|2,0,0]=4 655 B10R1.25 C1=CC(=C(C=C1Br)F)CBr 6181 [0,2,0,0,0,0|2,0,0]=4 656 B10R1.25 C1=CC(=C(C=C1Br)F)CN 8039 [0,2,0,0,0,0|2,0,0]=4 657 B10R1.25 C1=CC(=C(C=C1Br)N)C#N 10495 [0,2,0,0,0,0|2,0,0]=4 658 B10R1.25 C1=CC(=C(C=C1Br)O)C#N 8623 [0,2,0,0,0,0|1,0,0]=3 659 B10R1.25 C1=CC(=C(C=C1Cl)Br)C#N 9719 [0,2,0,0,0,0|2,0,0]=4 660 B10R1.25 C1=CC(=C(C=C1Cl)Cl)NN 9013 [0,2,0,0,0,0|2,0,0]=4 661 B10R1.25 C1=CC(=C(C=C1Cl)F)CBr 5211 [0,2,0,0,0,0|2,0,0]=4 662 B10R1.25 C1=CC(=C(C=C1Cl)F)CO 9790 [0,2,0,0,0,0|2,0,0]=4 663 B10R1.25 C1=CC(=C(C=C1Cl)F)NN 5309 [0,2,0,0,0,0|2,0,0]=4 664 B10R1.25 C1=CC(=C(C=C1F)Br)C=O 5308 [0,2,0,0,0,0|2,0,0]=4 665 B10R1.25 C1=CC(=C(C=C1F)Cl)C#N 8906 [0,2,0,0,0,0|2,0,0]=4 666 B10R1.25 C1=CC(=C(C=C1F)Cl)C#N 9254 [0,2,0,0,0,0|2,0,0]=4 667 B10R1.25 C1=CC(=C(C=C1F)Cl)CN 6194 [0,2,0,0,0,0|2,0,0]=4 668 B10R1.25 C1=CC(=C(C=C1F)F)C#N 5162 [0,2,0,0,0,0|2,0,0]=4 669 B10R1.25 C1=CC(=C(C=C1F)F)C=O 8215 [0,2,0,0,0,0|2,0,0]=4 670 B10R1.25 C1=CC(=C(C=C1F)F)CBr 10356 [0,2,0,0,0,0|2,0,0]=4 671 B10R1.25 C1=CC(=C(C=C1F)F)CCl 10529 [0,2,0,0,0,0|2,0,0]=4 672 B10R1.25 C1=CC(=C(C=C1F)F)CN 5064 [0,2,0,0,0,0|2,0,0]=4 673 B10R1.25 C1=CC(=C(C=C1F)F)CO 5619 [0,2,0,0,0,0|2,0,0]=4 674 B10R1.25 C1=CC(=C(C=C1F)F)NN 5631 [0,2,0,0,0,0|2,0,0]=4 675 B10R1.25 C1=CC(=C(C=C1N)Br)C#N 10552 [0,2,0,0,0,0|2,0,0]=4 676 B10R1.25 C1=CC(=C(C=C1N)Cl)C#N 5725 [0,2,0,0,0,0|2,0,0]=4 677 B10R1.25 C1=CC(=C(C=C1N)F)C#N 8878 [0,2,0,0,0,0|2,0,0]=4 678 B10R1.25 C1=CC(=C(C=C1O)F)C#N 5126 [0,2,0,0,0,0|1,0,0]=3 679 B10R1.25 C1=CC(=C(C=C1O)O)C=O 10275 [0,2,0,0,0,0|1,0,0]=3 680 B10R1.25 CC1=C(C=CC(=C1)Br)C#N 9732 [0,2,0,0,0,0|1,0,0]=3 681 B10R1.25 CC1=C(C=CC(=C1)Br)C=O 9443 [0,2,0,0,0,0|1,0,0]=3 682 B10R1.25 CC1=C(C=CC(=C1)F)C#N 8797 [0,2,0,0,0,0|1,0,0]=3 683 B10R1.25 CC1=CC(=C(C=C1)C#N)F 6654 [0,2,0,0,0,0|1,0,0]=3 684 B10R1.25 CC1=CC(=C(C=C1)OC)I 6862 [0,2,0,0,0,0|1,0,0]=3 685 B10R1.25 COC1=C(C=C(C=C1)Br)O 6683 [0,2,0,0,0,0|1,0,0]=3 686 B10R1.25 COC1=C(C=C(C=C1)Cl)Br 6521 [0,2,0,0,0,0|2,0,0]=4 687 B10R1.25 COC1=C(C=C(C=C1)Cl)I 6532 [0,2,0,0,0,0|2,0,0]=4 688 B10R1.25 COC1=C(C=C(C=C1)F)Br 6127 [0,2,0,0,0,0|2,0,0]=4 689 B10R1.25 COC1=C(C=C(C=C1)F)Cl 9547 [0,2,0,0,0,0|2,0,0]=4 690 B10R1.25 COC1=C(C=C(C=C1)F)F 5613 [0,2,0,0,0,0|2,0,0]=4 691 B10R1.25 COC1=C(C=C(C=C1)F)O 6489 [0,2,0,0,0,0|1,0,0]=3 692 B10R1.25 COC1=C(C=C(C=C1)N)Br 9331 [0,2,0,0,0,0|2,0,0]=4 693 B10R1.25 COC1=C(C=C(C=C1)N)F 5654 [0,2,0,0,0,0|2,0,0]=4 694 B10R1.25 COC1=C(C=C(C=C1)N)I 10230 [0,2,0,0,0,0|2,0,0]=4 695 B10R1.25 Cc1cc(ccc1CN)F F0029 [0,2,0,0,0,0|1,0,0]=3 696 B10R1.25 c1cc(c(cc1F)F)C=O D0156 [0,2,0,0,0,0|2,0,0]=4 697 B10R1.118 C1=C(C(=CC(=C1Br)Br)F)F 10349 [0,2,0,0,0,0|2,0,0]=4 698 B10R1.118 C1=C(C(=CC(=C1Br)F)Br)F 8349 [0,2,0,0,0,0|2,0,0]=4 699 B10R1.118 C1=C(C(=CC(=C1Br)F)F)N 6462 [0,2,0,0,0,0|2,0,0]=4 700 B10R1.118 C1=C(C(=CC(=C1Cl)Cl)Cl)O 6798 [0,2,0,0,0,0|1,0,0]=3 701 B10R1.118 C1=C(C(=CC(=C1F)Br)F)F 8303 [0,2,0,0,0,0|2,0,0]=4 702 B10R1.118 C1=C(C(=CC(=C1F)F)Br)N 6678 [0,2,0,0,0,0|2,0,0]=4 703 B10R1.118 C1=C(C(=CC(=C1F)F)F)N 9901 [0,2,0,0,0,0|2,0,0]=4 704 B10R1.118 CC1=CC(=C(C=C1Br)C)N 8537 [0,2,0,0,0,0|1,0,0]=3 705 B10R1.118 CC1=CC(=C(C=C1Cl)C)N 6620 [0,2,0,0,0,0|1,0,0]=3 706 B10R1.118 CC1=CC(=C(C=C1Cl)Cl)F 6167 [0,2,0,0,0,0|1,0,0]=3 707 B10R1.118 CC1=CC(=C(C=C1N)Cl)Br 6611 [0,2,0,0,0,0|1,0,0]=3 708 B10R1.118 CC1=NC(=C(C=C1Br)Br)N 6440 [0,2,0,0,0,0|2,0,0]=4 709 B8R1.7 C1=CNC(=C1)C(=O)O 8130 [0,0,1,1,0,0|2,0,0]=4 710 B8R1.7 C1=CSC(=C1)C(=O)O 5487 [0,0,1,1,0,0|2,0,0]=4 711 B8R1.7 CC(=O)C1=CC=CS1 8482 [0,0,1,1,0,0|1,1,0]=4 712 B8R1.7 CC(=O)C1=CC=CS1 8660 [0,0,1,1,0,0|1,1,0]=4 713 B6R1.2 C1=CSC(=C1)Br 5377 [1,0,0,0,1,0|2,0,0]=4 714 B6R1.2 C1=CSC(=C1)Cl 9477 [1,0,0,0,1,0|2,0,0]=4 715 B6R1.2 C1=CSC(=C1)I 9486 [1,0,0,0,1,0|2,0,0]=4 716 B6R1.2 C1=CSC=C1Cl 9478 [1,0,0,0,1,0|2,0,0]=4 717 B6R1.2 CC1=CC=CS1 8742 [1,0,0,0,1,0|1,0,0]=3 718 B6R1.2 CC1=CC=NN1 8083 [1,0,0,0,1,0|2,0,0]=4 719 B6R1.2 CC1=CN=CN1 9563 [1,0,0,0,1,0|2,0,0]=4 720 B6R1.2 CC1=CSC=N1 8929 [1,0,0,0,1,0|2,0,0]=4 721 B6R1.2 Cc1cccs1 M0049 [1,0,0,0,1,0|1,0,0]=3