0 B8R1.3 C1=CC(=CC=C1F)Br R0010P [0,0,0,0,0,0|2,0,0]=2 1 B8R1.3 C1=CC(=CC=C1F)S R001A6 [0,0,0,0,0,0|1,1,0]=2 2 B8R1.3 C1=CC(=NC=C1Br)Br R0014P [0,0,0,0,0,0|3,0,0]=3 3 B8R1.3 C1=CC(=NC=C1Br)N R0014N [0,0,0,0,0,0|3,0,0]=3 4 B8R1.3 C1=CC(=NC=C1Cl)N R0014O [0,0,0,0,0,0|3,0,0]=3 5 B8R1.3 C1=CC(=NC=C1F)N R0017T [0,0,0,0,0,0|3,0,0]=3 6 B8R1.3 CC1=CN=C(C=C1)Br R00124 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.3 CC1=CN=C(C=C1)Cl R00129 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.3 CC1=CN=C(C=C1)F R0015W [0,0,0,0,0,0|3,0,0]=3 9 B8R1.3 CC1=CN=C(C=C1)N R0011Z [0,0,0,0,0,0|3,0,0]=3 10 B8R1.3 CC1=NC=C(C=C1)Br R00108 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.3 CC1=NC=C(C=C1)Br R001C3 [0,0,0,0,0,0|3,0,0]=3 12 B7R1.3 C1=CC(=CN=C1)Br R0016G [1,0,0,0,0,0|2,0,0]=3 13 B7R1.3 C1=CC(=CN=C1)N R0016C [1,0,0,0,0,0|2,0,0]=3 14 B7R1.3 C1=CC(=CN=C1)O R0016E [1,0,0,0,0,0|1,0,0]=2 15 B7R1.3 C1=CC=C(C=C1)Br R0018D [1,0,0,0,0,0|1,0,0]=2 16 B7R1.3 C1=CC=NC(=C1)Br R0014G [1,0,0,0,0,0|2,0,0]=3 17 B7R1.3 C1=CC=NC(=C1)F R0014K [1,0,0,0,0,0|2,0,0]=3 18 B7R1.3 C1=CC=NC(=C1)N R0014J [1,0,0,0,0,0|2,0,0]=3 19 B7R1.3 C1=CN=C(N=C1)Cl R000RX [1,0,0,0,0,0|3,0,0]=4 20 B7R1.3 C1=CN=CC=C1Br R00187 [1,0,0,0,0,0|2,0,0]=3 21 B7R1.3 C1=CN=CC=C1N R00183 [1,0,0,0,0,0|2,0,0]=3 22 B7R1.3 C1=CNC=CC1=O R00185 [1,0,0,0,0,0|1,0,1]=3 23 B7R1.3 CC1=CC=CC=N1 R000XX [1,0,0,0,0,0|2,0,0]=3 24 B7R1.3 CC1=CC=NC=C1 R00184 [1,0,0,0,0,0|2,0,0]=3 25 B7R1.3 CC1=CN=CC=C1 R0016F [1,0,0,0,0,0|2,0,0]=3 26 B9R1.1 C#CC1=CC=C(C=C1)Br R0017K [0,1,0,0,0,0|2,0,0]=3 27 B9R1.1 C#CC1=CC=C(C=C1)N R00144 [0,1,0,0,0,0|2,0,0]=3 28 B9R1.1 C1=CC(=CC=C1CO)Cl R001B3 [0,1,0,0,0,0|1,0,0]=2 29 B9R1.1 C1=CC(=NC=C1Br)CO R001C1 [0,1,0,0,0,0|2,0,0]=3 30 B9R1.1 C1=CC(=NC=C1C#N)Cl R001BU [0,1,0,0,0,0|3,0,0]=4 31 B9R1.1 C1=CC(=NC=C1C=O)Cl R001BR [0,1,0,0,0,0|2,0,1]=4 32 B9R1.1 CC1=CN=C(C=C1)C#N R00115 [0,1,0,0,0,0|3,0,0]=4 33 B9R1.1 CNC1=CC=C(C=C1)Br R000T0 [0,1,0,0,0,0|2,0,0]=3 34 B9R1.1 COC1=CC=C(C=C1)N R000UY [0,1,0,0,0,0|1,0,0]=2 35 B9R1.69 C1=CC(=C(C=C1Br)F)Cl R0010D [0,1,0,0,0,0|2,0,0]=3 36 B9R1.69 C1=CC(=NC(=C1O)Cl)I R0017P [0,1,0,0,0,0|2,0,0]=3 37 B9R1.69 CC1=CC(=C(C=C1)C)Br R000V7 [0,1,0,0,0,0|2,0,0]=3 38 B9R1.69 CC1=CC(=NC=C1Br)N R0014M [0,1,0,0,0,0|3,0,0]=4 39 B9R1.69 CC1=NC(=C(C=C1)N)Cl R0010H [0,1,0,0,0,0|3,0,0]=4 40 B6R1.1 C1=CC=CC=C1 R00190 [2,0,0,0,0,0|0,0,0]=2 41 B6R1.1 C1=CC=NC=C1 R00192 [2,0,0,0,0,0|1,0,0]=3 42 B8R1.2 C1=CC(=CN=C1)C#N R0016D [1,1,0,0,0,0|2,0,0]=4 43 B8R1.2 C1=CC(=CN=C1)CCl R00167 [1,1,0,0,0,0|2,0,0]=4 44 B8R1.2 C1=CC=NC(=C1)C#N R000WD [1,1,0,0,0,0|2,0,0]=4 45 B8R1.2 C1=CC=NC(=C1)C=O R000XZ [1,1,0,0,0,0|1,0,1]=4 46 B8R1.2 C1=CC=NC(=C1)CCl R0011I [1,1,0,0,0,0|2,0,0]=4 47 B8R1.2 C1=CC=NC(=C1)CO R000W3 [1,1,0,0,0,0|1,0,0]=3 48 B8R1.2 C1=CN=CC=C1C#N R00182 [1,1,0,0,0,0|2,0,0]=4 49 B8R1.2 C1=CN=CC=C1CCl R00181 [1,1,0,0,0,0|2,0,0]=4 50 B8R1.2 C1=CN=CC=C1CO R00180 [1,1,0,0,0,0|1,0,0]=3 51 B8R1.2 COC1=CC=CC=N1 R0011W [1,1,0,0,0,0|1,0,0]=3 52 B8R1.4 C1=CC(=CC(=C1)O)N R000V9 [1,1,0,0,0,0|0,0,0]=2 53 B8R1.4 C1=CC(=NC(=C1)Br)F R0010F [1,1,0,0,0,0|2,0,0]=4 54 B8R1.4 C1=CC(=NC(=C1)F)F R000UD [1,1,0,0,0,0|2,0,0]=4 55 B8R1.4 C1=CC(=NC(=C1)N)N R0012I [1,1,0,0,0,0|2,0,0]=4 56 B8R1.4 C1=CN=C(C=C1Cl)N R0017L [1,1,0,0,0,0|2,0,0]=4 57 B8R1.4 CC1=CC(=CN=C1)C R0016B [1,1,0,0,0,0|2,0,0]=4 58 B8R1.4 CC1=CC(=NC=C1)Br R00123 [1,1,0,0,0,0|2,0,0]=4 59 B8R1.4 CC1=CC(=NC=C1)Cl R00119 [1,1,0,0,0,0|2,0,0]=4 60 B8R1.4 CC1=CC(=NC=C1)Cl R00128 [1,1,0,0,0,0|2,0,0]=4 61 B8R1.4 CC1=CC(=NC=C1)F R0015V [1,1,0,0,0,0|2,0,0]=4 62 B8R1.4 CC1=CC(=NC=C1)N R00120 [1,1,0,0,0,0|2,0,0]=4 63 B8R1.4 CC1=CC(=O)NC=C1 R0011U [1,1,0,0,0,0|1,0,1]=4 64 B8R1.4 CC1=CC=CC(=O)N1 R0011V [1,1,0,0,0,0|1,0,1]=4 65 B8R1.4 CC1=C[N+](=CC=C1)[O-] R00165 [1,1,0,0,0,0|1,0,1]=4 66 B8R1.4 CC1=NC(=CC=C1)Br R00125 [1,1,0,0,0,0|2,0,0]=4 67 B8R1.4 CC1=NC(=CC=C1)C R0012C [1,1,0,0,0,0|2,0,0]=4 68 B8R1.4 CC1=NC(=CC=C1)Cl R0012A [1,1,0,0,0,0|2,0,0]=4 69 B8R1.4 CC1=NC(=CC=C1)F R0015X [1,1,0,0,0,0|2,0,0]=4 70 B8R1.4 CC1=NC(=CC=C1)N R0011Y [1,1,0,0,0,0|2,0,0]=4 71 B8R1.4 CC1=NC=CC(=C1)Br R0011Q [1,1,0,0,0,0|2,0,0]=4 72 B8R1.4 CC1=NC=CC(=C1)Cl R0011S [1,1,0,0,0,0|2,0,0]=4 73 B8R1.4 CC1=NC=CC(=C1)F R0011T [1,1,0,0,0,0|2,0,0]=4 74 B8R1.4 CC1=NC=CC(=C1)N R0011P [1,1,0,0,0,0|2,0,0]=4 75 B8R1.5 C1=CC(=C(N=C1)Cl)Cl R0012G [1,1,0,0,0,0|2,0,0]=4 76 B8R1.5 C1=CC(=C(N=C1)Cl)O R00149 [1,1,0,0,0,0|1,0,0]=3 77 B8R1.5 C1=CC=C(C(=C1)N)F R0010S [1,1,0,0,0,0|1,0,0]=3 78 B8R1.5 C1=CC=C(C(=C1)N)N R00198 [1,1,0,0,0,0|1,0,0]=3 79 B8R1.5 CC1=C(C=CC=N1)O R0017W [1,1,0,0,0,0|1,0,0]=3 80 B8R1.5 CC1=C(C=NC=C1)Br R0016S [1,1,0,0,0,0|2,0,0]=4 81 B8R1.5 CC1=C(N=CC=C1)Br R00122 [1,1,0,0,0,0|2,0,0]=4 82 B8R1.5 CC1=C(N=CC=C1)Cl R00127 [1,1,0,0,0,0|2,0,0]=4 83 B8R1.5 CC1=C(N=CC=C1)F R0015U [1,1,0,0,0,0|2,0,0]=4 84 B8R1.5 CC1=C(N=CC=C1)N R00121 [1,1,0,0,0,0|2,0,0]=4 85 B8R1.5 CC1=CC=CC=[N+]1[O-] R0011M [1,1,0,0,0,0|1,0,1]=4 86 B10R1.1 C1=CC(=CC=C1CC#N)Cl R001AU [0,2,0,0,0,0|2,0,0]=4 87 B10R1.1 C1=CC(=CC=C1CCO)Cl R001AV [0,2,0,0,0,0|1,0,0]=3 88 B10R1.3 C#CC1=CC=C(C=C1)C#C R00178 [0,2,0,0,0,0|2,0,0]=4 89 B10R1.3 C#CC1=CC=C(C=C1)CO R0011D [0,2,0,0,0,0|1,0,0]=3 90 B10R1.3 COC1=CN=C(C=C1)OC R0017C [0,2,0,0,0,0|1,0,0]=3 91 B10R1.13 B(C1=CC=C(C=C1)Br)(O)O R000WF [0,2,0,0,0,0|1,0,0]=3 92 B10R1.13 B(C1=CC=C(C=C1)C)(O)O R000VD [0,2,0,0,0,0|1,0,0]=3 93 B10R1.13 B(C1=CC=C(C=C1)Cl)(O)O R000WB [0,2,0,0,0,0|1,0,0]=3 94 B10R1.13 B(C1=CC=C(C=C1)F)(O)O R000VM [0,2,0,0,0,0|1,0,0]=3 95 B10R1.13 B(C1=CC=C(C=C1)O)(O)O R000W0 [0,2,0,0,0,0|0,0,0]=2 96 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])Cl R000UZ [0,2,0,0,0,0|1,0,1]=4 97 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])O R000VY [0,2,0,0,0,0|0,0,1]=3 98 B10R1.13 C1=CC(=NC=C1Br)C(=O)O R001C2 [0,2,0,0,0,0|2,0,0]=4 99 B10R1.13 C1=CC(=NC=C1C(=O)O)Br R001BJ [0,2,0,0,0,0|2,0,0]=4 100 B10R1.13 C1=CC(=NC=C1C(=O)O)Cl R001BI [0,2,0,0,0,0|2,0,0]=4 101 B10R1.13 C1=CC(=O)C=CC1=C(N)S R000SY [0,2,0,0,0,0|0,1,1]=4 102 B10R1.13 C1=CC(=O)NC=C1C(=O)O R001BX [0,2,0,0,0,0|1,0,1]=4 103 B10R1.13 CC1=NC=C(C=C1)C(=O)O R001BL [0,2,0,0,0,0|2,0,0]=4 104 B10R1.25 C1=CC(=C(C=C1F)Cl)C=O R00107 [0,2,0,0,0,0|1,0,1]=4 105 B10R1.176 CC1=C(C=C(C=C1)C#N)F R000SH [0,2,0,0,0,0|2,0,0]=4