0 B8R1.2 BrCC1=CN=CN=C1 O11299 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.2 BrCC1=NC=CN=C1 31757 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.2 BrCC1=NC=NC=C1 Y10744 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.2 BrCC1=NN=CC=C1 27114 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.2 C#CC1=CN=CN=C1 25642 [0,0,0,0,0,0|3,0,1]=4 5 B8R1.2 C#CC1=NC=CN=C1 P11646 [0,0,0,0,0,0|3,0,1]=4 6 B8R1.2 CCC1=NC=NC=C1 F17281 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.2 CNC1=CN=CN=C1 Y10181 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.2 CNC1=CN=NC=C1 A10648 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.2 CNC1=NC=NC=C1 W10133 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.2 COC1=NC=NC=C1 T72699 [0,0,0,0,0,0|2,1,0]=3 11 B8R1.2 ClCC1=NC=CN=C1 37060 [0,0,0,0,0,0|4,0,0]=4 12 B8R1.2 ClCC1=NN=CC=C1 37063 [0,0,0,0,0,0|4,0,0]=4 13 B8R1.2 N#CC1=CN=NC=C1 37055 [0,0,0,0,0,0|4,0,0]=4 14 B8R1.2 N#CC1=NC=CC=C1 D77869 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.2 N#CC1=NN=CC=C1 82702 [0,0,0,0,0,0|4,0,0]=4 16 B8R1.2 NCC1=CC=CC=C1 RB3068 [0,0,0,0,0,0|2,0,0]=2 17 B8R1.2 NCC1=CC=CN=N1 36976 [0,0,0,0,0,0|4,0,0]=4 18 B8R1.2 NCC1=CC=CN=N1 AT13034 [0,0,0,0,0,0|4,0,0]=4 19 B8R1.2 NCC1=CC=CN=N1 P15536 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.2 NCC1=CC=NC=C1 35876 [0,0,0,0,0,0|3,0,0]=3 21 B8R1.2 NCC1=CN=CN=C1 26963 [0,0,0,0,0,0|4,0,0]=4 22 B8R1.2 NCC1=CN=NC=C1 27223 [0,0,0,0,0,0|4,0,0]=4 23 B8R1.2 NCC1=CN=NC=C1 36975 [0,0,0,0,0,0|4,0,0]=4 24 B8R1.2 NCC1=NC=CN=C1 67569 [0,0,0,0,0,0|4,0,0]=4 25 B8R1.2 NNC1=CC=CN=C1 S12141 [0,0,0,0,0,0|3,0,0]=3 26 B8R1.2 NNC1=CN=CN=C1 AT18412 [0,0,0,0,0,0|4,0,0]=4 27 B8R1.2 NNC1=NC=NC=C1 N12626 [0,0,0,0,0,0|4,0,0]=4 28 B8R1.2 O=CC1=NC=NC=C1 26359 [0,0,0,0,0,0|4,0,0]=4 29 B8R1.2 OCC1=CN=NC=C1 37054 [0,0,0,0,0,0|4,0,0]=4 30 B8R1.2 SCC1=CC=NC=C1 F18336 [0,0,0,0,0,0|3,0,0]=3 31 B8R1.2 SCC1=CN=CC=C1 F18343 [0,0,0,0,0,0|3,0,0]=3 32 B8R1.2 SCC1=NC=CC=C1 Y10072 [0,0,0,0,0,0|3,0,0]=3 33 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [0,0,0,0,0,0|1,0,1]=2 34 B7R1.3 BrC1=CN=NC=C1 85151 [1,0,0,0,0,0|3,0,0]=4 35 B7R1.3 BrC1=NC=NC=C1 54642 [1,0,0,0,0,0|3,0,0]=4 36 B7R1.3 BrC1=NC=NC=C1 54644 [1,0,0,0,0,0|3,0,0]=4 37 B7R1.3 CC1=NC=CN=N1 C74235 [1,0,0,0,0,0|3,0,0]=4 38 B7R1.3 ClC1=CN=CC=C1 P19758 [1,0,0,0,0,0|2,0,0]=3 39 B7R1.3 ClC1=NN=CC=C1 57588 [1,0,0,0,0,0|3,0,0]=4 40 B7R1.3 NC1=CC=CC=C1 T70935 [1,0,0,0,0,0|1,0,0]=2 41 B7R1.3 NC1=CC=CC=C1 T71037 [1,0,0,0,0,0|1,0,0]=2 42 B7R1.3 O=C1C=CNN=C1 D87946 [1,0,0,0,0,0|2,1,0]=4 43 B7R1.3 SC1=NC=CN=C1 F16108 [1,0,0,0,0,0|2,0,0]=3 44 B7R1.3 [O-][N+]1=CC=NC=C1 O12055 [1,0,0,0,0,0|2,1,0]=4 45 B9R1.1 BrCC1=NC=C(Br)C=C1 28859 [0,1,0,0,0,0|3,0,0]=4 46 B9R1.1 C#CC1=CC=C(I)C=C1 F21257 [0,1,0,0,0,0|1,0,1]=3 47 B9R1.1 C#CC1=CN=C(Br)C=C1 68603 [0,1,0,0,0,0|2,0,1]=4 48 B9R1.1 C#CC1=CN=C(Cl)C=C1 83979 [0,1,0,0,0,0|2,0,1]=4 49 B9R1.1 C#CC1=CN=C(O)C=C1 O11429 [0,1,0,0,0,0|2,0,1]=4 50 B9R1.1 C#CC1=NC=C(Br)C=C1 84355 [0,1,0,0,0,0|2,0,1]=4 51 B9R1.1 C#CC1=NC=C(Cl)C=C1 84384 [0,1,0,0,0,0|2,0,1]=4 52 B9R1.1 C#CC1=NC=C(Cl)C=C1 N13106 [0,1,0,0,0,0|2,0,1]=4 53 B9R1.1 C#CC1=NC=C(N)C=C1 D83980 [0,1,0,0,0,0|2,0,1]=4 54 B9R1.1 C=CC1=CN=C(Cl)C=C1 F13416 [0,1,0,0,0,0|2,0,1]=4 55 B9R1.1 C=CC1=NC=C(Cl)C=C1 P17531 [0,1,0,0,0,0|2,0,1]=4 56 B9R1.1 CC1=CN=C(CCl)C=C1 A10650 [0,1,0,0,0,0|3,0,0]=4 57 B9R1.1 CC1=CN=C(CCl)C=C1 C16351 [0,1,0,0,0,0|3,0,0]=4 58 B9R1.1 CC1=CN=C(NN)C=C1 BL010291 [0,1,0,0,0,0|3,0,0]=4 59 B9R1.1 CC1=NC=C(CCl)C=C1 CL0057 [0,1,0,0,0,0|3,0,0]=4 60 B9R1.1 CC1=NC=C(CN)C=C1 72232 [0,1,0,0,0,0|3,0,0]=4 61 B9R1.1 CCC1=CN=C(Br)C=C1 CS1557 [0,1,0,0,0,0|2,0,0]=3 62 B9R1.1 CCC1=CN=C(Cl)C=C1 72594 [0,1,0,0,0,0|2,0,0]=3 63 B9R1.1 CCC1=CN=C(N)C=N1 27455 [0,1,0,0,0,0|3,0,0]=4 64 B9R1.1 CCC1=CN=C(O)C=C1 25325 [0,1,0,0,0,0|2,0,0]=3 65 B9R1.1 CCC1=NC=C(Br)C=C1 26547 [0,1,0,0,0,0|2,0,0]=3 66 B9R1.1 CCC1=NC=C(Br)C=N1 27600 [0,1,0,0,0,0|3,0,0]=4 67 B9R1.1 CCC1=NC=C(Cl)C=C1 C71513 [0,1,0,0,0,0|2,0,0]=3 68 B9R1.1 CCC1=NC=C(N)C=C1 C72111 [0,1,0,0,0,0|2,0,0]=3 69 B9R1.1 CCC1=NC=C(N)C=N1 81903 [0,1,0,0,0,0|3,0,0]=4 70 B9R1.1 CCC1=NN=C(Cl)C=C1 59639 [0,1,0,0,0,0|3,0,0]=4 71 B9R1.1 CCC1=NNC(=O)C=C1 65671 [0,1,0,0,0,0|3,0,0]=4 72 B9R1.1 CNC1=CC=C(O)C=C1 D77985 [0,1,0,0,0,0|1,0,0]=2 73 B9R1.1 CNC1=CN=C(Br)C=C1 D86940 [0,1,0,0,0,0|2,0,0]=3 74 B9R1.1 CNC1=CN=C(C)C=C1 D83365 [0,1,0,0,0,0|2,0,0]=3 75 B9R1.1 CNC1=NC=C(C)N=C1 AC2495 [0,1,0,0,0,0|3,0,0]=4 76 B9R1.1 CNC1=NC=C(N)C=C1 C74450 [0,1,0,0,0,0|2,0,0]=3 77 B9R1.1 CNC1=NC=C(N)C=N1 AT18272 [0,1,0,0,0,0|3,0,0]=4 78 B9R1.1 CNC1=NN=C(Br)C=C1 C10836 [0,1,0,0,0,0|3,0,0]=4 79 B9R1.1 COC1=CN=C(F)C=C1 98092 [0,1,0,0,0,0|1,1,0]=3 80 B9R1.1 COC1=CN=C(N)N=C1 11206 [0,1,0,0,0,0|2,1,0]=4 81 B9R1.1 COC1=NC=C(I)C=N1 W11580 [0,1,0,0,0,0|2,1,0]=4 82 B9R1.1 COC1=NC=C(N)C=N1 35336 [0,1,0,0,0,0|2,1,0]=4 83 B9R1.1 COC1=NC=C(N)N=C1 24331 [0,1,0,0,0,0|2,1,0]=4 84 B9R1.1 COC1=NC=C(O)C=N1 C16680 [0,1,0,0,0,0|2,1,0]=4 85 B9R1.1 COC1=NN=C(I)C=C1 C15088 [0,1,0,0,0,0|2,1,0]=4 86 B9R1.1 CSC1=CN=C(Cl)N=C1 W16220 [0,1,0,0,0,0|2,0,0]=3 87 B9R1.1 CSC1=NC=C(Cl)C=N1 63237 [0,1,0,0,0,0|2,0,0]=3 88 B9R1.1 CSC1=NC=C(N)C=N1 31929 [0,1,0,0,0,0|2,0,0]=3 89 B9R1.1 C[N+]1=CC=C(C=O)C=C1 D95156 [0,1,0,0,0,0|3,0,0]=4 90 B9R1.1 ClCC1=CC=C(I)C=C1 AB8901 [0,1,0,0,0,0|2,0,0]=3 91 B9R1.1 ClCC1=CN=C(Br)C=C1 C71417 [0,1,0,0,0,0|3,0,0]=4 92 B9R1.1 ClCC1=CN=C(Br)C=C1 C73235 [0,1,0,0,0,0|3,0,0]=4 93 B9R1.1 ClCC1=NC=C(Br)C=C1 12269 [0,1,0,0,0,0|3,0,0]=4 94 B9R1.1 ClCC1=NC=C(Br)C=C1 C77222 [0,1,0,0,0,0|3,0,0]=4 95 B9R1.1 FCC1=CC=C(Br)C=C1 W10394 [0,1,0,0,0,0|2,0,0]=3 96 B9R1.1 N#CC1=CC=C(S)C=C1 F31167 [0,1,0,0,0,0|2,0,0]=3 97 B9R1.1 N#CC1=NC=C(I)C=C1 78743 [0,1,0,0,0,0|3,0,0]=4 98 B9R1.1 N#CC1=NC=C(O)C=C1 24955 [0,1,0,0,0,0|3,0,0]=4 99 B9R1.1 NC1=CN=C(C=O)C=C1 D77164 [0,1,0,0,0,0|3,0,0]=4 100 B9R1.1 NCC1=CC=C(O)C=C1 AC1832 [0,1,0,0,0,0|2,0,0]=3 101 B9R1.1 NCC1=CN=C(Br)C=C1 68600 [0,1,0,0,0,0|3,0,0]=4 102 B9R1.1 NCC1=CN=C(N)C=C1 F13784 [0,1,0,0,0,0|3,0,0]=4 103 B9R1.1 NCC1=CN=C(N)C=C1 P19117 [0,1,0,0,0,0|3,0,0]=4 104 B9R1.1 NCC1=NC=C(Br)C=C1 32062 [0,1,0,0,0,0|3,0,0]=4 105 B9R1.1 NCC1=NC=C(Cl)C=C1 W13681 [0,1,0,0,0,0|3,0,0]=4 106 B9R1.1 NCC1=NC=C(F)C=C1 70856 [0,1,0,0,0,0|3,0,0]=4 107 B9R1.1 NCC1=NC=C(N)C=C1 O11499 [0,1,0,0,0,0|3,0,0]=4 108 B9R1.1 NCC1=NC=C(N)C=C1 W11510 [0,1,0,0,0,0|3,0,0]=4 109 B9R1.1 NCC1=NC=C(O)C=C1 24338 [0,1,0,0,0,0|3,0,0]=4 110 B9R1.1 NNC1=CN=C(Cl)C=C1 H10944 [0,1,0,0,0,0|3,0,0]=4 111 B9R1.1 NNC1=CN=C(F)C=C1 73802 [0,1,0,0,0,0|3,0,0]=4 112 B9R1.1 NNC1=NC=C(F)C=C1 W17746 [0,1,0,0,0,0|3,0,0]=4 113 B9R1.1 OCC1=CC=C(S)C=C1 Y11017 [0,1,0,0,0,0|2,0,0]=3 114 B9R1.2 C#CC1=CC(=N)NC=C1 W17094 [0,1,0,0,0,0|2,0,1]=4 115 B9R1.2 C#CC1=CC(Br)=CN=C1 50294 [0,1,0,0,0,0|2,0,1]=4 116 B9R1.2 C#CC1=CC(Br)=NC=C1 D82593 [0,1,0,0,0,0|2,0,1]=4 117 B9R1.2 C#CC1=CC(Cl)=CN=C1 C77589 [0,1,0,0,0,0|2,0,1]=4 118 B9R1.2 C#CC1=CC=CC(=O)N1 N11855 [0,1,0,0,0,0|2,0,1]=4 119 B9R1.2 C#CC1=CC=CC(Br)=N1 D82337 [0,1,0,0,0,0|2,0,1]=4 120 B9R1.2 C#CC1=CC=CC(Cl)=N1 AT12436 [0,1,0,0,0,0|2,0,1]=4 121 B9R1.2 C#CC1=CC=CC(F)=N1 C71915 [0,1,0,0,0,0|2,0,1]=4 122 B9R1.2 C#CC1=NC=CC(N)=C1 72871 [0,1,0,0,0,0|2,0,1]=4 123 B9R1.2 C#CC1=NC=CC(N)=C1 C76101 [0,1,0,0,0,0|2,0,1]=4 124 B9R1.2 C=CC1=CC(Br)=CN=C1 50995 [0,1,0,0,0,0|2,0,1]=4 125 B9R1.2 C=CC1=CC(Br)=NC=C1 60113 [0,1,0,0,0,0|2,0,1]=4 126 B9R1.2 C=CC1=CC(C)=CC=C1 F16162 [0,1,0,0,0,0|1,0,1]=3 127 B9R1.2 C=CC1=CC(C)=CN=C1 79122 [0,1,0,0,0,0|2,0,1]=4 128 B9R1.2 C=CC1=CC=CC(Br)=N1 27481 [0,1,0,0,0,0|2,0,1]=4 129 B9R1.2 C=CC1=NC(C)=CC=C1 C71408 [0,1,0,0,0,0|2,0,1]=4 130 B9R1.2 C=CC1=NC=CC(Br)=C1 C75345 [0,1,0,0,0,0|2,0,1]=4 131 B9R1.2 C=CC1=NC=CC(Cl)=C1 C77362 [0,1,0,0,0,0|2,0,1]=4 132 B9R1.2 C=CC1=NC=CC(N)=C1 D82535 [0,1,0,0,0,0|2,0,1]=4 133 B9R1.2 CC1=CC(C#N)=CN=C1 71242 [0,1,0,0,0,0|3,0,0]=4 134 B9R1.2 CC1=CC(CCl)=NC=C1 25774 [0,1,0,0,0,0|3,0,0]=4 135 B9R1.2 CC1=CC(CN)=NC=C1 72801 [0,1,0,0,0,0|3,0,0]=4 136 B9R1.2 CC1=CC(CN)=NC=C1 78899 [0,1,0,0,0,0|3,0,0]=4 137 B9R1.2 CC1=CC(NN)=NC=C1 BL010278 [0,1,0,0,0,0|3,0,0]=4 138 B9R1.2 CC1=CC=CC(CN)=N1 W10146 [0,1,0,0,0,0|3,0,0]=4 139 B9R1.2 CC1=CC=CC(NN)=N1 W17082 [0,1,0,0,0,0|3,0,0]=4 140 B9R1.2 CC1=CN=CC(CN)=C1 72799 [0,1,0,0,0,0|3,0,0]=4 141 B9R1.2 CC1=NC=CC(CBr)=C1 D80184 [0,1,0,0,0,0|3,0,0]=4 142 B9R1.2 CC1=NC=CC(CN)=C1 72809 [0,1,0,0,0,0|3,0,0]=4 143 B9R1.2 CCC1=CC(=O)NC=N1 F13915 [0,1,0,0,0,0|3,0,0]=4 144 B9R1.2 CCC1=CC(=O)NN=C1 S11511 [0,1,0,0,0,0|3,0,0]=4 145 B9R1.2 CCC1=CC(Br)=CN=C1 25835 [0,1,0,0,0,0|2,0,0]=3 146 B9R1.2 CCC1=CC(Cl)=NC=N1 F17302 [0,1,0,0,0,0|3,0,0]=4 147 B9R1.2 CCC1=CC=CC(Br)=N1 O10692 [0,1,0,0,0,0|2,0,0]=3 148 B9R1.2 CCC1=CC=NC(Cl)=N1 30656 [0,1,0,0,0,0|3,0,0]=4 149 B9R1.2 CCC1=NC(C)=CN=C1 D84033 [0,1,0,0,0,0|3,0,0]=4 150 B9R1.2 CCC1=NC=CC(Br)=C1 S10560 [0,1,0,0,0,0|2,0,0]=3 151 B9R1.2 CCC1=NC=CC(O)=N1 W12565 [0,1,0,0,0,0|3,0,0]=4 152 B9R1.2 CNC1=CC(Br)=NC=C1 CS1908 [0,1,0,0,0,0|2,0,0]=3 153 B9R1.2 CNC1=CC(N)=CC=C1 36494 [0,1,0,0,0,0|1,0,0]=2 154 B9R1.2 CNC1=CC=NC(Br)=N1 D80192 [0,1,0,0,0,0|3,0,0]=4 155 B9R1.2 CNC1=NC(C)=CN=C1 74811 [0,1,0,0,0,0|3,0,0]=4 156 B9R1.2 CNC1=NC=CC(Br)=C1 32749 [0,1,0,0,0,0|2,0,0]=3 157 B9R1.2 CNC1=NC=CC(Cl)=N1 24763 [0,1,0,0,0,0|3,0,0]=4 158 B9R1.2 CNC1=NC=CC(N)=C1 27435 [0,1,0,0,0,0|2,0,0]=3 159 B9R1.2 COC1=CC(=O)NC=C1 25837 [0,1,0,0,0,0|1,1,0]=3 160 B9R1.2 COC1=CC(Br)=NC=N1 C76202 [0,1,0,0,0,0|2,1,0]=4 161 B9R1.2 COC1=CC(Cl)=CN=N1 E70128 [0,1,0,0,0,0|2,1,0]=4 162 B9R1.2 COC1=CC(F)=NC=N1 D83389 [0,1,0,0,0,0|2,1,0]=4 163 B9R1.2 COC1=NC(C)=CC=N1 C72586 [0,1,0,0,0,0|2,1,0]=4 164 B9R1.2 COC1=NC(C)=NC=C1 73836 [0,1,0,0,0,0|2,1,0]=4 165 B9R1.2 COC1=NC(N)=CN=C1 24364 [0,1,0,0,0,0|2,1,0]=4 166 B9R1.2 COC1=NC(O)=CC=N1 Y10376 [0,1,0,0,0,0|2,1,0]=4 167 B9R1.2 COC1=NC=CC(Br)=N1 25350 [0,1,0,0,0,0|2,1,0]=4 168 B9R1.2 COC1=NC=NC(C)=C1 H10028 [0,1,0,0,0,0|2,1,0]=4 169 B9R1.2 CSC1=CC(Br)=NC=N1 C71732 [0,1,0,0,0,0|2,0,0]=3 170 B9R1.2 CSC1=CC(F)=CC=C1 A12732 [0,1,0,0,0,0|0,0,0]=1 171 B9R1.2 CSC1=CC(O)=CC=C1 W12966 [0,1,0,0,0,0|0,0,0]=1 172 B9R1.2 CSC1=CC=CC(Cl)=N1 F14554 [0,1,0,0,0,0|1,0,0]=2 173 B9R1.2 CSC1=NC(N)=CC=C1 W18184 [0,1,0,0,0,0|1,0,0]=2 174 B9R1.2 CSC1=NC(N)=CN=C1 W17367 [0,1,0,0,0,0|2,0,0]=3 175 B9R1.2 ClC1=CC=CC(CBr)=N1 55241 [0,1,0,0,0,0|3,0,0]=4 176 B9R1.2 ClC1=NC=CC(CBr)=C1 A10561 [0,1,0,0,0,0|3,0,0]=4 177 B9R1.2 ClCC1=CC=CC(Cl)=N1 F52578 [0,1,0,0,0,0|3,0,0]=4 178 B9R1.2 ClCC1=NC=CC(Cl)=C1 AC1913 [0,1,0,0,0,0|3,0,0]=4 179 B9R1.2 FC1=CC(CBr)=NC=C1 AC8874 [0,1,0,0,0,0|3,0,0]=4 180 B9R1.2 FC1=CC=CC(CBr)=N1 25716 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.2 FC1=CC=CC(CCl)=N1 88353 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.2 N#CC1=CC(F)=CN=C1 82241 [0,1,0,0,0,0|3,0,0]=4 183 B9R1.2 N#CC1=CC=CC(=O)N1 P11008 [0,1,0,0,0,0|3,0,0]=4 184 B9R1.2 N#CC1=NC=CC(O)=C1 C75263 [0,1,0,0,0,0|3,0,0]=4 185 B9R1.2 N#[N+]C1=CC=CC(Br)=C1 98381 [0,1,0,0,0,0|2,0,0]=3 186 B9R1.2 NC1=CC(CO)=CN=C1 20770 [0,1,0,0,0,0|3,0,0]=4 187 B9R1.2 NC1=CC(CO)=NC=C1 AC1095 [0,1,0,0,0,0|3,0,0]=4 188 B9R1.2 NC1=CC=CC(C=O)=C1 CK2096 [0,1,0,0,0,0|2,0,0]=3 189 B9R1.2 NC1=CC=CC(C=O)=N1 D70565 [0,1,0,0,0,0|3,0,0]=4 190 B9R1.2 NC1=CC=CC(CF)=C1 32172 [0,1,0,0,0,0|2,0,0]=3 191 B9R1.2 NC1=NC=CC(CBr)=C1 W11110 [0,1,0,0,0,0|3,0,0]=4 192 B9R1.2 NCC1=CC(Br)=CN=C1 Y14573 [0,1,0,0,0,0|3,0,0]=4 193 B9R1.2 NCC1=CC(Cl)=CN=C1 29807 [0,1,0,0,0,0|3,0,0]=4 194 B9R1.2 NCC1=CC(Cl)=NC=C1 71552 [0,1,0,0,0,0|3,0,0]=4 195 B9R1.2 NCC1=CC(F)=NC=C1 73765 [0,1,0,0,0,0|3,0,0]=4 196 B9R1.2 NCC1=CC=CC(=O)N1 78897 [0,1,0,0,0,0|3,0,0]=4 197 B9R1.2 NCC1=CC=CC(Br)=N1 CS1515 [0,1,0,0,0,0|3,0,0]=4 198 B9R1.2 NCC1=CC=CC(Cl)=N1 C73611 [0,1,0,0,0,0|3,0,0]=4 199 B9R1.2 NCC1=CC=CC(F)=N1 25846 [0,1,0,0,0,0|3,0,0]=4 200 B9R1.2 NCC1=CC=CC(N)=N1 H10329 [0,1,0,0,0,0|3,0,0]=4 201 B9R1.2 NCC1=CC=C[N+]([O-])=C1 W12624 [0,1,0,0,0,0|3,0,0]=4 202 B9R1.2 NCC1=NC=CC(Br)=C1 26881 [0,1,0,0,0,0|3,0,0]=4 203 B9R1.2 NCC1=NC=CC(Br)=C1 P17869 [0,1,0,0,0,0|3,0,0]=4 204 B9R1.2 NCC1=NC=CC(Cl)=C1 P18502 [0,1,0,0,0,0|3,0,0]=4 205 B9R1.2 NCC1=NC=CC(Cl)=C1 Y12031 [0,1,0,0,0,0|3,0,0]=4 206 B9R1.2 NNC1=CC(O)=NC=C1 W16830 [0,1,0,0,0,0|3,0,0]=4 207 B9R1.2 O=C1C=C(CCl)C=CN1 AT18186 [0,1,0,0,0,0|3,0,0]=4 208 B9R1.2 O=C1C=C(CO)C=CN1 37365 [0,1,0,0,0,0|3,0,0]=4 209 B9R1.2 O=CC1=CC=CC(=O)N1 N12900 [0,1,0,0,0,0|3,0,0]=4 210 B9R1.2 O=CC1=C[N+]([O-])=CC=C1 O11007 [0,1,0,0,0,0|3,0,0]=4 211 B9R1.2 O=CC1=NC=CC(O)=C1 W18365 [0,1,0,0,0,0|3,0,0]=4 212 B9R1.2 OCC1=CC(Cl)=CN=C1 26741 [0,1,0,0,0,0|3,0,0]=4 213 B9R1.2 OCC1=NC=CC(I)=C1 W18502 [0,1,0,0,0,0|3,0,0]=4 214 B9R1.2 OCC1=NC=CC(O)=C1 O10524 [0,1,0,0,0,0|3,0,0]=4 215 B9R1.6 C=C(C)C1=NC=CC=C1 W17791 [0,1,0,0,0,0|2,0,0]=3 216 B9R1.6 CC(=O)C1=NN=CC=C1 37064 [0,1,0,0,0,0|3,0,0]=4 217 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13294 [0,1,0,0,0,0|2,0,0]=3 218 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77753 [0,1,0,0,0,0|1,0,0]=2 219 B9R1.6 C[C@H](N)C1=CC=CN=C1 20316 [0,1,0,0,0,0|2,0,0]=3 220 B9R1.6 C[C@H](N)C1=CC=CN=C1 74003 [0,1,0,0,0,0|2,0,0]=3 221 B9R1.6 C[C@H](N)C1=CC=CN=C1 74005 [0,1,0,0,0,0|2,0,0]=3 222 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31031 [0,1,0,0,0,0|2,0,0]=3 223 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31032 [0,1,0,0,0,0|2,0,0]=3 224 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31033 [0,1,0,0,0,0|2,0,0]=3 225 B9R1.6 C[C@H](N)C1=CC=NC=C1 N10538 [0,1,0,0,0,0|2,0,0]=3 226 B9R1.6 C[C@H](N)C1=CN=CN=C1 37059 [0,1,0,0,0,0|3,0,0]=4 227 B9R1.6 C[C@H](N)C1=CN=CN=C1 AT25773 [0,1,0,0,0,0|3,0,0]=4 228 B9R1.6 C[C@H](N)C1=CN=NC=C1 37052 [0,1,0,0,0,0|3,0,0]=4 229 B9R1.6 C[C@H](N)C1=NC=CC=N1 C90214 [0,1,0,0,0,0|3,0,0]=4 230 B9R1.6 C[C@H](N)C1=NC=CC=N1 C90215 [0,1,0,0,0,0|3,0,0]=4 231 B9R1.6 C[C@H](N)C1=NC=CC=N1 C90324 [0,1,0,0,0,0|3,0,0]=4 232 B9R1.6 C[C@H](N)C1=NC=CC=N1 S11170 [0,1,0,0,0,0|3,0,0]=4 233 B9R1.6 C[C@H](N)C1=NC=CN=C1 24931 [0,1,0,0,0,0|3,0,0]=4 234 B9R1.6 C[C@H](O)C1=NC=CC=C1 A11519 [0,1,0,0,0,0|2,0,0]=3 235 B9R1.6 C[C@H](O)C1=NC=CC=C1 C16040 [0,1,0,0,0,0|2,0,0]=3 236 B9R1.6 C[C@H](O)C1=NC=CC=N1 72303 [0,1,0,0,0,0|3,0,0]=4 237 B9R1.6 C[C@H](O)C1=NC=CC=N1 P19373 [0,1,0,0,0,0|3,0,0]=4 238 B9R1.6 C[C@H](O)C1=NC=CC=N1 P20178 [0,1,0,0,0,0|3,0,0]=4 239 B9R1.6 C[C@H](O)C1=NC=CN=C1 D82306 [0,1,0,0,0,0|3,0,0]=4 240 B9R1.6 C[S@](=O)C1=NC=CC=C1 C74099 [0,1,0,0,0,0|1,0,1]=3 241 B9R1.6 N=C(N)C1=NC=CC=C1 71518 [0,1,0,0,0,0|3,0,0]=4 242 B9R1.6 O=[S@]([O-])C1=NC=CC=C1 AT11818 [0,1,0,0,0,0|2,0,1]=4 243 B9R1.8 BrC#CC1=CC=CC=C1 A51120 [0,1,0,0,0,0|1,0,1]=3 244 B9R1.8 BrCCC1=CC=NC=C1 C71689 [0,1,0,0,0,0|2,0,0]=3 245 B9R1.8 CCNC1=CC=CN=C1 C15578 [0,1,0,0,0,0|2,0,0]=3 246 B9R1.8 CNCC1=CC=NC=C1 AR1712 [0,1,0,0,0,0|2,0,0]=3 247 B9R1.8 CNCC1=CN=NC=C1 P16258 [0,1,0,0,0,0|3,0,0]=4 248 B9R1.8 CNCC1=NC=CC=N1 W11490 [0,1,0,0,0,0|3,0,0]=4 249 B9R1.8 ClCCC1=CC=NC=C1 O11064 [0,1,0,0,0,0|2,0,0]=3 250 B9R1.8 NCCC1=NC=CC=N1 P15951 [0,1,0,0,0,0|3,0,0]=4 251 B9R1.8 NCCC1=NC=CN=C1 AR1061 [0,1,0,0,0,0|3,0,0]=4 252 B9R1.8 NCCC1=NC=NC=C1 P18517 [0,1,0,0,0,0|3,0,0]=4 253 B9R1.8 NNCC1=CC=CN=C1 78930 [0,1,0,0,0,0|3,0,0]=4 254 B9R1.8 NNCC1=CC=NC=C1 37009 [0,1,0,0,0,0|3,0,0]=4 255 B9R1.8 NNCC1=CC=NC=C1 BL009189 [0,1,0,0,0,0|3,0,0]=4 256 B9R1.8 NNCC1=NC=CC=C1 78929 [0,1,0,0,0,0|3,0,0]=4 257 B9R1.8 NOCC1=CN=CC=C1 AC6038 [0,1,0,0,0,0|2,1,0]=4 258 B9R1.8 N\N=C\C1=CC=CC=C1 D81797 [0,1,0,0,0,0|2,0,0]=3 259 B9R1.8 OCCC1=CN=CN=C1 27368 [0,1,0,0,0,0|3,0,0]=4 260 B9R1.8 OCCC1=NC=CC=N1 C14218 [0,1,0,0,0,0|3,0,0]=4 261 B9R1.8 O\N=C/C1=CC=CC=C1 N10040 [0,1,0,0,0,0|2,0,0]=3 262 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 C11398 [0,1,0,0,0,0|1,0,1]=3 263 B9R1.15 BrCC1=C(Br)C=CC=N1 N13045 [0,1,0,0,0,0|3,0,0]=4 264 B9R1.15 C#CC1=C(Cl)C=NC=C1 79083 [0,1,0,0,0,0|2,0,1]=4 265 B9R1.15 C#CC1=C(F)C=CC=N1 F21381 [0,1,0,0,0,0|2,0,1]=4 266 B9R1.15 C#CC1=C(N)C=CN=C1 C71943 [0,1,0,0,0,0|2,0,1]=4 267 B9R1.15 C#CC1=CC=CN=C1F C77200 [0,1,0,0,0,0|2,0,1]=4 268 B9R1.15 C#CC1=CC=CN=C1O CS1686 [0,1,0,0,0,0|2,0,1]=4 269 B9R1.15 C=CC1=C(N)C=CC=C1 25265 [0,1,0,0,0,0|1,0,1]=3 270 B9R1.15 C=CC1=CC=CN=C1Br 83953 [0,1,0,0,0,0|2,0,1]=4 271 B9R1.15 C=CC1=CC=CN=C1C P11579 [0,1,0,0,0,0|2,0,1]=4 272 B9R1.15 CC1=C(C#N)C=CC=N1 AB2931 [0,1,0,0,0,0|3,0,0]=4 273 B9R1.15 CC1=C(C=O)C=CN=C1 AB10090 [0,1,0,0,0,0|3,0,0]=4 274 B9R1.15 CC1=C(CBr)C=CC=N1 F16424 [0,1,0,0,0,0|3,0,0]=4 275 B9R1.15 CC1=C(CCl)C=CC=N1 24248 [0,1,0,0,0,0|3,0,0]=4 276 B9R1.15 CC1=C(CCl)C=NC=C1 C72783 [0,1,0,0,0,0|3,0,0]=4 277 B9R1.15 CC1=C(CO)C=NC=C1 38669 [0,1,0,0,0,0|3,0,0]=4 278 B9R1.15 CC1=C(NN)C=CN=C1 F15970 [0,1,0,0,0,0|3,0,0]=4 279 B9R1.15 CC1=CC=CN=C1CN C72913 [0,1,0,0,0,0|3,0,0]=4 280 B9R1.15 CC1=NC=CC=C1CN 72802 [0,1,0,0,0,0|3,0,0]=4 281 B9R1.15 CC1=NC=CC=C1CN AB7634 [0,1,0,0,0,0|3,0,0]=4 282 B9R1.15 CCC1=C(Br)C=CC=N1 P11641 [0,1,0,0,0,0|2,0,0]=3 283 B9R1.15 CCC1=C(Br)C=CN=C1 38064 [0,1,0,0,0,0|2,0,0]=3 284 B9R1.15 CCC1=C(F)C=CC=C1 F20938 [0,1,0,0,0,0|1,0,0]=2 285 B9R1.15 CCC1=C(O)C=CC=N1 71246 [0,1,0,0,0,0|2,0,0]=3 286 B9R1.15 CCC1=CC=CN=C1Br D80252 [0,1,0,0,0,0|2,0,0]=3 287 B9R1.15 CCC1=CC=CN=C1N 55791 [0,1,0,0,0,0|2,0,0]=3 288 B9R1.15 CCC1=CC=NN=C1Cl S11385 [0,1,0,0,0,0|3,0,0]=4 289 B9R1.15 CCC1=CC=NNC1=O S11452 [0,1,0,0,0,0|3,0,0]=4 290 B9R1.15 CCC1=NC=CN=C1N RB3385 [0,1,0,0,0,0|3,0,0]=4 291 B9R1.15 CCC1=NC=CNC1=O S12194 [0,1,0,0,0,0|3,0,0]=4 292 B9R1.15 CNC1=C(Br)C=NC=N1 27470 [0,1,0,0,0,0|3,0,0]=4 293 B9R1.15 CNC1=C(C)C=CN=C1 C12398 [0,1,0,0,0,0|2,0,0]=3 294 B9R1.15 CNC1=C(I)C=NC=C1 D83398 [0,1,0,0,0,0|2,0,0]=3 295 B9R1.15 CNC1=C(N)C=CN=C1 F51691 [0,1,0,0,0,0|2,0,0]=3 296 B9R1.15 CNC1=C(N)C=NC=C1 C73540 [0,1,0,0,0,0|2,0,0]=3 297 B9R1.15 CNC1=CC=CN=C1N 94808 [0,1,0,0,0,0|2,0,0]=3 298 B9R1.15 CNC1=NC=CC=C1N 72351 [0,1,0,0,0,0|2,0,0]=3 299 B9R1.15 CNC1=NC=CN=C1N 25161 [0,1,0,0,0,0|3,0,0]=4 300 B9R1.15 COC1=C(Br)C=CN=C1 26564 [0,1,0,0,0,0|1,1,0]=3 301 B9R1.15 COC1=C(Br)C=NC=N1 H10144 [0,1,0,0,0,0|2,1,0]=4 302 B9R1.15 COC1=C(I)C=CN=C1 D82954 [0,1,0,0,0,0|1,1,0]=3 303 B9R1.15 COC1=C(I)C=NC=N1 C74109 [0,1,0,0,0,0|2,1,0]=4 304 B9R1.15 COC1=C(N)C=CN=C1 35474 [0,1,0,0,0,0|1,1,0]=3 305 B9R1.15 COC1=C(O)C=NC=C1 79066 [0,1,0,0,0,0|1,1,0]=3 306 B9R1.15 COC1=CNC=NC1=O H10327 [0,1,0,0,0,0|2,1,0]=4 307 B9R1.15 COC1=NC=CC=C1C C73664 [0,1,0,0,0,0|1,1,0]=3 308 B9R1.15 COC1=NC=CN=C1Br 27717 [0,1,0,0,0,0|2,1,0]=4 309 B9R1.15 COC1=NC=NC=C1N 24306 [0,1,0,0,0,0|2,1,0]=4 310 B9R1.15 COC1=NC=NC=C1N 36696 [0,1,0,0,0,0|2,1,0]=4 311 B9R1.15 CSC1=C(F)N=CC=C1 F50785 [0,1,0,0,0,0|1,0,0]=2 312 B9R1.15 CSC1=C(N)C=CN=C1 W16024 [0,1,0,0,0,0|1,0,0]=2 313 B9R1.15 ClCC1=C(Br)C=CC=N1 W15864 [0,1,0,0,0,0|3,0,0]=4 314 B9R1.15 ClCC1=C(Br)C=NC=C1 32531 [0,1,0,0,0,0|3,0,0]=4 315 B9R1.15 ClCC1=C(Cl)C=CC=N1 86866 [0,1,0,0,0,0|3,0,0]=4 316 B9R1.15 ClCC1=C(Cl)C=CC=N1 C71965 [0,1,0,0,0,0|3,0,0]=4 317 B9R1.15 FC1=C(CBr)C=CC=N1 72213 [0,1,0,0,0,0|3,0,0]=4 318 B9R1.15 FC1=C(CCl)C=CN=C1 72889 [0,1,0,0,0,0|3,0,0]=4 319 B9R1.15 FC1=CC=CN=C1CBr 38126 [0,1,0,0,0,0|3,0,0]=4 320 B9R1.15 FC1=CC=CN=C1CCl AC1446 [0,1,0,0,0,0|3,0,0]=4 321 B9R1.15 N#CC1=C(Br)C=CN=C1 55794 [0,1,0,0,0,0|3,0,0]=4 322 B9R1.15 N#CC1=C(I)C=CC=N1 CL0132 [0,1,0,0,0,0|3,0,0]=4 323 B9R1.15 N#CC1=CNC=CC1=O 88910 [0,1,0,0,0,0|3,0,0]=4 324 B9R1.15 NC1=C(CO)C=CN=C1 F13531 [0,1,0,0,0,0|3,0,0]=4 325 B9R1.15 NC1=C(CO)C=NC=C1 28348 [0,1,0,0,0,0|3,0,0]=4 326 B9R1.15 NC1=CC=CN=C1C=O 80155 [0,1,0,0,0,0|3,0,0]=4 327 B9R1.15 NC1=CC=CN=C1CO H10562 [0,1,0,0,0,0|3,0,0]=4 328 B9R1.15 NCC1=C(Br)C=CC=N1 N13373 [0,1,0,0,0,0|3,0,0]=4 329 B9R1.15 NCC1=C(Br)C=CC=N1 Y13366 [0,1,0,0,0,0|3,0,0]=4 330 B9R1.15 NCC1=C(Br)C=CN=C1 F30244 [0,1,0,0,0,0|3,0,0]=4 331 B9R1.15 NCC1=C(Br)C=NC=C1 O10077 [0,1,0,0,0,0|3,0,0]=4 332 B9R1.15 NCC1=C(Cl)C=CC=N1 20194 [0,1,0,0,0,0|3,0,0]=4 333 B9R1.15 NCC1=C(Cl)C=CN=C1 73185 [0,1,0,0,0,0|3,0,0]=4 334 B9R1.15 NCC1=C(Cl)C=NC=C1 D79765 [0,1,0,0,0,0|3,0,0]=4 335 B9R1.15 NCC1=C(Cl)C=NC=C1 F50132 [0,1,0,0,0,0|3,0,0]=4 336 B9R1.15 NCC1=C(F)C=CC=N1 37501 [0,1,0,0,0,0|3,0,0]=4 337 B9R1.15 NCC1=C(F)C=CC=N1 71993 [0,1,0,0,0,0|3,0,0]=4 338 B9R1.15 NCC1=C(F)C=CC=N1 P10857 [0,1,0,0,0,0|3,0,0]=4 339 B9R1.15 NCC1=C(F)C=NC=C1 26837 [0,1,0,0,0,0|3,0,0]=4 340 B9R1.15 NCC1=C(F)C=NC=C1 78901 [0,1,0,0,0,0|3,0,0]=4 341 B9R1.15 NCC1=C(I)C=CC=C1 C75019 [0,1,0,0,0,0|2,0,0]=3 342 B9R1.15 NCC1=CC=CN=C1Br D82416 [0,1,0,0,0,0|3,0,0]=4 343 B9R1.15 NCC1=CC=CN=C1Cl 51113 [0,1,0,0,0,0|3,0,0]=4 344 B9R1.15 NCC1=CC=CN=C1N 89358 [0,1,0,0,0,0|3,0,0]=4 345 B9R1.15 NCC1=CC=CN=C1O 55767 [0,1,0,0,0,0|3,0,0]=4 346 B9R1.15 NCC1=NC=CC=C1N AC4283 [0,1,0,0,0,0|3,0,0]=4 347 B9R1.15 NNC1=C(Br)C=NC=C1 C13755 [0,1,0,0,0,0|3,0,0]=4 348 B9R1.15 NNC1=C(F)C=CC=N1 F20903 [0,1,0,0,0,0|3,0,0]=4 349 B9R1.15 NNC1=C(I)C=CC=C1 C75827 [0,1,0,0,0,0|2,0,0]=3 350 B9R1.15 O=C1NC=CC=C1CO P16012 [0,1,0,0,0,0|3,0,0]=4 351 B9R1.15 O=CC1=C(Br)C=CN=C1 P16584 [0,1,0,0,0,0|3,0,0]=4 352 B9R1.15 O=CC1=C(Cl)C=CC=C1 D77644 [0,1,0,0,0,0|2,0,0]=3 353 B9R1.15 O=CC1=C(O)C=CN=C1 P10968 [0,1,0,0,0,0|3,0,0]=4 354 B9R1.15 O=CC1=C(O)C=NC=C1 25615 [0,1,0,0,0,0|3,0,0]=4 355 B9R1.15 OCC1=C(Br)C=CN=C1 71972 [0,1,0,0,0,0|3,0,0]=4 356 B9R1.15 OCC1=C(F)C=CN=C1 P15839 [0,1,0,0,0,0|3,0,0]=4 357 B9R1.15 OCC1=C(O)C=NC=C1 D84251 [0,1,0,0,0,0|3,0,0]=4 358 B7R1.1 C=CC1=CC=CS1 C10114 [0,0,0,0,1,0|2,0,1]=4 359 B7R1.1 CCC1=CNN=C1 72604 [0,0,0,0,1,0|3,0,0]=4 360 B7R1.1 CNC1=NC=CO1 71780 [0,0,0,0,1,0|3,0,0]=4 361 B7R1.1 CNC1=NC=CS1 26158 [0,0,0,0,1,0|3,0,0]=4 362 B7R1.1 CNC1=NNC=C1 72540 [0,0,0,0,1,0|3,0,0]=4 363 B7R1.1 CNC1=NOC=C1 72015 [0,0,0,0,1,0|3,0,0]=4 364 B7R1.1 CNC1=NOC=C1 72539 [0,0,0,0,1,0|3,0,0]=4 365 B7R1.1 COC1=CNN=C1 79311 [0,0,0,0,1,0|2,1,0]=4 366 B7R1.1 COC1=NNC=C1 D79536 [0,0,0,0,1,0|2,1,0]=4 367 B7R1.1 CSC1=CN=CN1 W17049 [0,0,0,0,1,0|2,0,0]=3 368 B7R1.1 CSC1=CNN=C1 W10958 [0,0,0,0,1,0|2,0,0]=3 369 B7R1.1 CSC1=NC=CN1 AC1458 [0,0,0,0,1,0|2,0,0]=3 370 B7R1.1 CSC1=NC=CO1 O10533 [0,0,0,0,1,0|2,0,0]=3 371 B7R1.1 ClCC1=CC=CS1 79790 [0,0,0,0,1,0|3,0,0]=4 372 B7R1.1 NCC1=CC=CN1 25931 [0,0,0,0,1,0|3,0,0]=4 373 B7R1.1 NCC1=CNC=C1 F12967 [0,0,0,0,1,0|3,0,0]=4 374 B7R1.1 O=CC1=CC=C[Se]1 T72165 [0,0,0,0,1,0|3,0,0]=4 375 B7R1.1 O=CC1=CCC=C1 77835 [0,0,0,0,1,0|2,0,1]=4 376 B6R1.1 C1=CC=CC=C1 78158 [2,0,0,0,0,0|0,0,0]=2 377 B6R1.1 C1=CC=NC=C1 T72767 [2,0,0,0,0,0|1,0,0]=3 378 B6R1.1 C1=CN=NC=C1 C75894 [2,0,0,0,0,0|2,0,0]=4 379 B8R1.3 CC1=CC=C(C)N=N1 S11370 [1,1,0,0,0,0|2,0,0]=4 380 B8R1.3 CC1=CN=C(Br)C=N1 88781 [1,1,0,0,0,0|2,0,0]=4 381 B8R1.3 CC1=CN=C(F)N=C1 F11686 [1,1,0,0,0,0|2,0,0]=4 382 B8R1.3 CC1=CN=C(I)C=N1 W17940 [1,1,0,0,0,0|2,0,0]=4 383 B8R1.3 CC1=CN=C(N)C=N1 52044 [1,1,0,0,0,0|2,0,0]=4 384 B8R1.3 CC1=CN=C(N)N=C1 51196 [1,1,0,0,0,0|2,0,0]=4 385 B8R1.3 CC1=CN=C(O)C=N1 84954 [1,1,0,0,0,0|2,0,0]=4 386 B8R1.3 CC1=NC=C(F)C=N1 O11437 [1,1,0,0,0,0|2,0,0]=4 387 B8R1.3 CC1=NC=C(I)C=C1 C10582 [1,1,0,0,0,0|1,0,0]=3 388 B8R1.3 CC1=NC=C(O)C=N1 25911 [1,1,0,0,0,0|2,0,0]=4 389 B8R1.3 NC1=CC=C(O)C=C1 C75965 [1,1,0,0,0,0|0,1,0]=3 390 B8R1.3 NC1=NC=C(O)C=C1 BL008086 [1,1,0,0,0,0|1,1,0]=4 391 B8R1.3 SC1=CC=C(I)C=C1 F20637 [1,1,0,0,0,0|0,0,0]=2 392 B8R1.3 [O-][N+]1=CC=C(F)C=C1 38173 [1,1,0,0,0,0|1,1,0]=4 393 B8R1.4 CC1=CC(=S)NC=C1 I11274 [1,1,0,0,0,0|1,0,0]=3 394 B8R1.4 CC1=CC(=S)NC=N1 C75430 [1,1,0,0,0,0|2,0,0]=4 395 B8R1.4 CC1=CC=CC(I)=N1 S10876 [1,1,0,0,0,0|1,0,0]=3 396 B8R1.4 CC1=NC=CC(I)=C1 25628 [1,1,0,0,0,0|1,0,0]=3 397 B8R1.4 CC1=NC=CC(N)=N1 25050 [1,1,0,0,0,0|2,0,0]=4 398 B8R1.4 ClC1=CC(I)=CN=C1 C76473 [1,1,0,0,0,0|2,0,0]=4 399 B8R1.4 ClC1=CC(I)=NC=C1 O11208 [1,1,0,0,0,0|2,0,0]=4 400 B8R1.4 IC1=CN=CC(I)=C1 83196 [1,1,0,0,0,0|2,0,0]=4 401 B8R1.4 NC1=CC(N)=NC=C1 25421 [1,1,0,0,0,0|2,0,0]=4 402 B8R1.4 NC1=CC(O)=CN=C1 24928 [1,1,0,0,0,0|1,1,0]=4 403 B8R1.4 NC1=CC(O)=CN=C1 26279 [1,1,0,0,0,0|1,1,0]=4 404 B8R1.4 NC1=CC=CC(I)=N1 76368 [1,1,0,0,0,0|2,0,0]=4 405 B8R1.4 NC1=CN=CC(N)=C1 26714 [1,1,0,0,0,0|2,0,0]=4 406 B8R1.4 OC1=CC(F)=NC=C1 26765 [1,1,0,0,0,0|1,1,0]=4 407 B8R1.4 OC1=NC=CC(F)=C1 22624 [1,1,0,0,0,0|1,1,0]=4 408 B8R1.4 SC1=CC(Br)=CN=C1 AT25650 [1,1,0,0,0,0|1,0,0]=3 409 B8R1.5 BrC1=C(I)C=NC=C1 C76998 [1,1,0,0,0,0|2,0,0]=4 410 B8R1.5 CC1=C(Cl)C=NC=N1 F17326 [1,1,0,0,0,0|2,0,0]=4 411 B8R1.5 CC1=C(F)C=CN=C1 F19730 [1,1,0,0,0,0|1,0,0]=3 412 B8R1.5 CC1=C(I)C=CC=N1 F19761 [1,1,0,0,0,0|1,0,0]=3 413 B8R1.5 CC1=C(I)C=NC=C1 C74973 [1,1,0,0,0,0|1,0,0]=3 414 B8R1.5 CC1=C(I)C=NC=N1 27820 [1,1,0,0,0,0|2,0,0]=4 415 B8R1.5 CC1=CC=NN=C1Br N13316 [1,1,0,0,0,0|2,0,0]=4 416 B8R1.5 CC1=CC=NN=C1Cl 38744 [1,1,0,0,0,0|2,0,0]=4 417 B8R1.5 CC1=CN=CN=C1Br 27819 [1,1,0,0,0,0|2,0,0]=4 418 B8R1.5 CC1=CN=CN=C1O 25833 [1,1,0,0,0,0|2,0,0]=4 419 B8R1.5 CC1=NC=CN=C1Br 26975 [1,1,0,0,0,0|2,0,0]=4 420 B8R1.5 CC1=NC=NC=C1N 25415 [1,1,0,0,0,0|2,0,0]=4 421 B8R1.5 ClC1=CC=CN=C1I 68801 [1,1,0,0,0,0|2,0,0]=4 422 B8R1.5 NC1=C(S)C=CN=C1 AT18151 [1,1,0,0,0,0|1,0,0]=3 423 B8R1.5 NC1=CC=CN=C1I RB1070 [1,1,0,0,0,0|2,0,0]=4 424 B8R1.5 NC1=[N+]([O-])C=CC=C1 T70263 [1,1,0,0,0,0|1,1,0]=4 425 B8R1.5 OC1=C(I)C=CC=N1 CS1389 [1,1,0,0,0,0|1,1,0]=4 426 B8R1.5 OC1=C(I)C=CN=C1 25190 [1,1,0,0,0,0|1,1,0]=4 427 B8R1.5 OC1=C(O)C=NC=C1 C14003 [1,1,0,0,0,0|1,1,0]=4 428 B8R1.5 SC1=C(Br)C=NC=C1 C12894 [1,1,0,0,0,0|1,0,0]=3 429 B8R1.1 CCC1=CC=C(C)O1 A12137 [0,1,0,0,1,0|2,0,0]=4 430 B8R1.1 CSC1=CN=C(N)S1 C77378 [0,1,0,0,1,0|2,0,0]=4 431 B8R1.1 CSC1=NNC(N)=C1 75644 [0,1,0,0,1,0|2,0,0]=4 432 B8R1.7 CC(C)C1=CC=CO1 81450 [0,1,0,0,1,0|2,0,0]=4 433 B8R1.7 C[C@H](N)C1=CC=CO1 Y10899 [0,1,0,0,1,0|2,0,0]=4 434 B8R1.7 C[C@H](N)C1=CC=CO1 Y12106 [0,1,0,0,1,0|2,0,0]=4 435 B8R1.7 C[C@H](N)C1=CC=CS1 82880 [0,1,0,0,1,0|2,0,0]=4 436 B8R1.7 C[C@H](N)C1=CC=CS1 D81260 [0,1,0,0,1,0|2,0,0]=4 437 B8R1.7 C[C@H](N)C1=CC=CS1 N11134 [0,1,0,0,1,0|2,0,0]=4 438 B8R1.7 C[C@H](N)C1=CC=CS1 N12970 [0,1,0,0,1,0|2,0,0]=4 439 B8R1.7 C[C@H](N)C1=CC=CS1 Y10683 [0,1,0,0,1,0|2,0,0]=4 440 B8R1.7 C[C@H](N)C1=CSC=C1 27894 [0,1,0,0,1,0|2,0,0]=4 441 B8R1.7 C[C@H](N)C1=CSC=C1 Y14612 [0,1,0,0,1,0|2,0,0]=4 442 B8R1.7 C[C@H](O)C1=CSC=C1 79116 [0,1,0,0,1,0|2,0,0]=4 443 B8R1.8 BrCCC1=CSC=C1 F20032 [0,1,0,0,1,0|2,0,0]=4 444 B8R1.8 CNCC1=COC=C1 AC5678 [0,1,0,0,1,0|2,0,0]=4 445 B8R1.8 NCCC1=CC=CN1 31556 [0,1,0,0,1,0|2,0,0]=4 446 B8R1.8 NCCC1=CC=CN1 F10331 [0,1,0,0,1,0|2,0,0]=4 447 B8R1.8 NCCC1=CSC=C1 P10092 [0,1,0,0,1,0|2,0,0]=4 448 B8R1.8 OCCC1=CC=CN1 AB10351 [0,1,0,0,1,0|2,0,0]=4 449 B8R1.8 OCCC1=CC=CO1 W10532 [0,1,0,0,1,0|2,0,0]=4 450 B8R1.8 OCCC1=COC=C1 D93026 [0,1,0,0,1,0|2,0,0]=4 451 B10R1.1 C=CCC1=CC=C(O)C=C1 AC1877 [0,2,0,0,0,0|1,0,1]=4 452 B10R1.1 CC1=CC=C(CNN)C=C1 O10109 [0,2,0,0,0,0|2,0,0]=4 453 B10R1.1 CC1=NC=C(CCO)C=C1 54746 [0,2,0,0,0,0|2,0,0]=4 454 B10R1.1 CCNC1=CC=C(F)C=C1 AB11321 [0,2,0,0,0,0|1,0,0]=3 455 B10R1.1 CCOC1=NC=C(Cl)C=C1 F52729 [0,2,0,0,0,0|1,1,0]=4 456 B10R1.1 CCSC1=CC=C(C)C=C1 H10147 [0,2,0,0,0,0|0,0,0]=2 457 B10R1.1 CNCC1=CC=C(O)C=C1 31972 [0,2,0,0,0,0|1,0,0]=3 458 B10R1.1 COCC1=CC=C(O)C=C1 63646 [0,2,0,0,0,0|0,1,0]=3 459 B10R1.1 CSCC1=CC=C(Br)C=C1 W19176 [0,2,0,0,0,0|0,0,0]=2 460 B10R1.1 CSCC1=CC=C(C)C=C1 W19462 [0,2,0,0,0,0|0,0,0]=2 461 B10R1.1 CSCC1=CC=C(F)C=C1 W18716 [0,2,0,0,0,0|0,0,0]=2 462 B10R1.1 NCCC1=CN=C(Cl)C=C1 85004 [0,2,0,0,0,0|2,0,0]=4 463 B10R1.1 NNCC1=CC=C(F)C=C1 36999 [0,2,0,0,0,0|2,0,0]=4 464 B10R1.1 NOCC1=CC=C(Cl)C=C1 78769 [0,2,0,0,0,0|1,1,0]=4 465 B10R1.1 O=CCC1=CC=C(Cl)C=C1 74968 [0,2,0,0,0,0|1,0,1]=4 466 B10R1.1 OCCC1=NC=C(Br)C=C1 37598 [0,2,0,0,0,0|2,0,0]=4 467 B10R1.1 OCCC1=NC=C(F)C=C1 P18353 [0,2,0,0,0,0|2,0,0]=4 468 B10R1.3 C#CC1=CC=C(CBr)C=C1 79956 [0,2,0,0,0,0|1,0,1]=4 469 B10R1.3 C#CC1=CC=C(CCl)C=C1 79958 [0,2,0,0,0,0|1,0,1]=4 470 B10R1.3 C#CC1=NC=C(OC)C=C1 D84302 [0,2,0,0,0,0|1,1,0]=4 471 B10R1.3 C=CC1=CC=C(CO)C=C1 F14590 [0,2,0,0,0,0|1,0,1]=4 472 B10R1.3 CNC1=CC=C(C=O)C=C1 D93507 [0,2,0,0,0,0|1,0,0]=3 473 B10R1.3 CNC1=CC=C(CO)C=C1 20987 [0,2,0,0,0,0|1,0,0]=3 474 B10R1.3 CNC1=CN=C(C#N)C=C1 O11307 [0,2,0,0,0,0|2,0,0]=4 475 B10R1.3 CNC1=NC=C(C#N)C=C1 88567 [0,2,0,0,0,0|2,0,0]=4 476 B10R1.3 CNC1=NC=C(C=O)C=C1 P10732 [0,2,0,0,0,0|2,0,0]=4 477 B10R1.3 COC1=CN=C(CBr)C=C1 O10508 [0,2,0,0,0,0|1,1,0]=4 478 B10R1.3 COC1=CN=C(CCl)C=C1 81763 [0,2,0,0,0,0|1,1,0]=4 479 B10R1.3 COC1=CN=C(CN)C=C1 AC7188 [0,2,0,0,0,0|1,1,0]=4 480 B10R1.3 COC1=NC=C(CCl)C=C1 82159 [0,2,0,0,0,0|1,1,0]=4 481 B10R1.3 COC1=NC=C(CN)C=C1 C73256 [0,2,0,0,0,0|1,1,0]=4 482 B10R1.3 COC1=NC=C(NN)C=C1 F13050 [0,2,0,0,0,0|1,1,0]=4 483 B10R1.3 CSC1=CC=C(NN)C=C1 79686 [0,2,0,0,0,0|0,0,0]=2 484 B10R1.3 CSC1=CN=C(SC)N=C1 W16219 [0,2,0,0,0,0|2,0,0]=4 485 B10R1.3 CSC1=NC=C(C#N)C=N1 C74953 [0,2,0,0,0,0|2,0,0]=4 486 B10R1.3 CSC1=NC=C(C=O)C=N1 P10273 [0,2,0,0,0,0|2,0,0]=4 487 B10R1.3 CSC1=NC=C(CO)C=N1 S10007 [0,2,0,0,0,0|2,0,0]=4 488 B10R1.3 NCC1=CC=C(CBr)C=C1 54465 [0,2,0,0,0,0|2,0,0]=4 489 B10R1.3 NCC1=CC=C(CCl)C=C1 51899 [0,2,0,0,0,0|2,0,0]=4 490 B10R1.3 O=CC1=CC=C(CCl)C=C1 CL9238 [0,2,0,0,0,0|2,0,0]=4 491 B10R1.3 SCC1=CC=C(CS)C=C1 T70041 [0,2,0,0,0,0|2,0,0]=4 492 B10R1.13 C=C(C)C1=CC=C(I)C=C1 AC1339 [0,2,0,0,0,0|1,0,0]=3 493 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 AC7918 [0,2,0,0,0,0|1,0,0]=3 494 B10R1.13 CC(=O)C1=NC=C(N)C=C1 D94999 [0,2,0,0,0,0|2,0,0]=4 495 B10R1.13 CC(=O)C1=NC=C(O)C=C1 53717 [0,2,0,0,0,0|2,0,0]=4 496 B10R1.13 CC(C)C1=CC=C(O)C=C1 D72532 [0,2,0,0,0,0|1,0,0]=3 497 B10R1.13 CC(C)C1=NC=C(Br)C=C1 C71514 [0,2,0,0,0,0|2,0,0]=4 498 B10R1.13 CC(C)C1=NC=C(N)C=C1 D81293 [0,2,0,0,0,0|2,0,0]=4 499 B10R1.13 CC(C)C1=NC=C(N)C=C1 RB1132 [0,2,0,0,0,0|2,0,0]=4 500 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 20068 [0,2,0,0,0,0|1,0,0]=3 501 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 Y14023 [0,2,0,0,0,0|1,0,0]=3 502 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 W19044 [0,2,0,0,0,0|1,0,0]=3 503 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 97006 [0,2,0,0,0,0|1,0,1]=4 504 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 A11173 [0,2,0,0,0,0|1,0,1]=4 505 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 T73083 [0,2,0,0,0,0|0,0,1]=3 506 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10810 [0,2,0,0,0,0|2,0,0]=4 507 B10R1.13 CC1=CN=C([C@H](C)O)C=C1 AB7629 [0,2,0,0,0,0|2,0,0]=4 508 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 F16847 [0,2,0,0,0,0|2,0,0]=4 509 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 Y11095 [0,2,0,0,0,0|2,0,0]=4 510 B10R1.13 CN(C)C1=CN=C(Cl)C=C1 C15764 [0,2,0,0,0,0|2,0,0]=4 511 B10R1.13 CN(C)C1=CN=C(N)C=C1 N10123 [0,2,0,0,0,0|2,0,0]=4 512 B10R1.13 CN(N)C1=CC=C(Br)C=C1 E10129 [0,2,0,0,0,0|1,0,0]=3 513 B10R1.13 C[C@H](Cl)C1=CC=C(F)C=C1 AC6174 [0,2,0,0,0,0|1,0,0]=3 514 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 C16655 [0,2,0,0,0,0|1,0,0]=3 515 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10310 [0,2,0,0,0,0|1,0,0]=3 516 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10311 [0,2,0,0,0,0|1,0,0]=3 517 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20069 [0,2,0,0,0,0|1,0,0]=3 518 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20071 [0,2,0,0,0,0|1,0,0]=3 519 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 O11060 [0,2,0,0,0,0|1,0,0]=3 520 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11752 [0,2,0,0,0,0|1,0,0]=3 521 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11753 [0,2,0,0,0,0|1,0,0]=3 522 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y10879 [0,2,0,0,0,0|1,0,0]=3 523 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y14795 [0,2,0,0,0,0|1,0,0]=3 524 B10R1.13 C[C@H](N)C1=CN=C(Br)C=C1 81501 [0,2,0,0,0,0|2,0,0]=4 525 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 N11108 [0,2,0,0,0,0|2,0,0]=4 526 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 N11223 [0,2,0,0,0,0|2,0,0]=4 527 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 66671 [0,2,0,0,0,0|2,0,0]=4 528 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 74099 [0,2,0,0,0,0|2,0,0]=4 529 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 74101 [0,2,0,0,0,0|2,0,0]=4 530 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 81462 [0,2,0,0,0,0|2,0,0]=4 531 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 D82399 [0,2,0,0,0,0|2,0,0]=4 532 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 N11298 [0,2,0,0,0,0|2,0,0]=4 533 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 Y11564 [0,2,0,0,0,0|2,0,0]=4 534 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 N13196 [0,2,0,0,0,0|2,0,0]=4 535 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 Y12226 [0,2,0,0,0,0|2,0,0]=4 536 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 90530 [0,2,0,0,0,0|2,0,0]=4 537 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F17006 [0,2,0,0,0,0|2,0,0]=4 538 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 N11135 [0,2,0,0,0,0|2,0,0]=4 539 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y10461 [0,2,0,0,0,0|2,0,0]=4 540 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y11597 [0,2,0,0,0,0|2,0,0]=4 541 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y13385 [0,2,0,0,0,0|2,0,0]=4 542 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1272 [0,2,0,0,0,0|1,0,0]=3 543 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1278 [0,2,0,0,0,0|1,0,0]=3 544 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 25877 [0,2,0,0,0,0|1,0,0]=3 545 B10R1.13 C[C@H](O)C1=CN=C(Br)C=C1 AT11876 [0,2,0,0,0,0|2,0,0]=4 546 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Y13723 [0,2,0,0,0,0|2,0,0]=4 547 B10R1.13 FC(F)C1=CC=C(I)C=C1 C71790 [0,2,0,0,0,0|2,0,0]=4 548 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 W16706 [0,2,0,0,0,0|2,0,0]=4 549 B10R1.13 N=C(N)C1=CC=C(N)C=C1 56135 [0,2,0,0,0,0|2,0,0]=4 550 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 A11465 [0,2,0,0,0,0|2,0,0]=4 551 B10R1.25 C#CC1=C(Cl)C=C(N)C=C1 C76583 [0,2,0,0,0,0|1,0,1]=4 552 B10R1.25 C#CC1=C(F)C=C(Cl)C=C1 D94601 [0,2,0,0,0,0|1,0,1]=4 553 B10R1.25 C#CC1=C(F)C=C(N)C=C1 C14426 [0,2,0,0,0,0|1,0,1]=4 554 B10R1.25 C=CC1=C(Br)C=C(F)C=C1 S10822 [0,2,0,0,0,0|1,0,1]=4 555 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 93716 [0,2,0,0,0,0|2,0,0]=4 556 B10R1.25 CC1=C(CCl)C=CC(Br)=C1 AB10222 [0,2,0,0,0,0|2,0,0]=4 557 B10R1.25 CC1=C(CF)C=CC(Br)=C1 C73525 [0,2,0,0,0,0|2,0,0]=4 558 B10R1.25 CC1=C(CN)C=CC(Br)=C1 C71550 [0,2,0,0,0,0|2,0,0]=4 559 B10R1.25 CC1=C(CO)C=CC(N)=C1 F19834 [0,2,0,0,0,0|2,0,0]=4 560 B10R1.25 CC1=CC(Br)=C(CN)C=C1 W19042 [0,2,0,0,0,0|2,0,0]=4 561 B10R1.25 CC1=CC(C)=C(CBr)C=C1 24686 [0,2,0,0,0,0|2,0,0]=4 562 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 N12896 [0,2,0,0,0,0|2,0,0]=4 563 B10R1.25 CC1=CC(F)=C(NN)C=C1 D82866 [0,2,0,0,0,0|2,0,0]=4 564 B10R1.25 CC1=CC(F)=C(NN)C=C1 W17784 [0,2,0,0,0,0|2,0,0]=4 565 B10R1.25 CCC1=C(Br)C=C(N)C=C1 27953 [0,2,0,0,0,0|1,0,0]=3 566 B10R1.25 CCC1=C(Br)C=C(O)C=C1 Y11628 [0,2,0,0,0,0|1,0,0]=3 567 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 W17033 [0,2,0,0,0,0|1,0,0]=3 568 B10R1.25 CCC1=C(F)C=C(Br)C=C1 D82415 [0,2,0,0,0,0|1,0,0]=3 569 B10R1.25 CCC1=C(F)C=C(O)C=C1 C11362 [0,2,0,0,0,0|1,0,0]=3 570 B10R1.25 CCC1=C(N)C=C(Br)C=C1 C72839 [0,2,0,0,0,0|1,0,0]=3 571 B10R1.25 CCC1=C(N)C=C(Cl)C=C1 C74962 [0,2,0,0,0,0|1,0,0]=3 572 B10R1.25 CCC1=NC=C(Br)C=C1N 38360 [0,2,0,0,0,0|2,0,0]=4 573 B10R1.25 CCN1C=CC(Br)=CC1=O P13647 [0,2,0,0,0,0|2,0,0]=4 574 B10R1.25 CNC1=C(Br)C=C(F)C=C1 71883 [0,2,0,0,0,0|1,0,0]=3 575 B10R1.25 CNC1=C(C)C=C(O)C=C1 C16321 [0,2,0,0,0,0|1,0,0]=3 576 B10R1.25 CNC1=NC=C(Br)C=C1N C77013 [0,2,0,0,0,0|2,0,0]=4 577 B10R1.25 COC1=C(Br)C=C(Cl)N=C1 S10226 [0,2,0,0,0,0|1,1,0]=4 578 B10R1.25 COC1=C(C)C=C(O)C=C1 95659 [0,2,0,0,0,0|0,1,0]=3 579 B10R1.25 COC1=C(C)N=C(Br)C=C1 W15448 [0,2,0,0,0,0|1,1,0]=4 580 B10R1.25 COC1=C(Cl)C=C(C)C=N1 C71882 [0,2,0,0,0,0|1,1,0]=4 581 B10R1.25 COC1=C(Cl)C=C(I)C=C1 F15482 [0,2,0,0,0,0|0,1,0]=3 582 B10R1.25 COC1=C(Cl)C=C(N)N=C1 37736 [0,2,0,0,0,0|1,1,0]=4 583 B10R1.25 COC1=C(Cl)N=C(I)C=C1 72074 [0,2,0,0,0,0|1,1,0]=4 584 B10R1.25 COC1=C(F)C=C(N)C=N1 27254 [0,2,0,0,0,0|1,1,0]=4 585 B10R1.25 COC1=C(F)N=C(Br)C=C1 CS1206 [0,2,0,0,0,0|1,1,0]=4 586 B10R1.25 COC1=C(I)C=C(Br)C=N1 C75707 [0,2,0,0,0,0|1,1,0]=4 587 B10R1.25 COC1=C(I)C=C(Cl)N=C1 S10146 [0,2,0,0,0,0|1,1,0]=4 588 B10R1.25 COC1=C(N)N=C(C)C=C1 84162 [0,2,0,0,0,0|1,1,0]=4 589 B10R1.25 COC1=C(N)N=C(F)C=C1 D70935 [0,2,0,0,0,0|1,1,0]=4 590 B10R1.25 COC1=CC=C(Br)N=C1Br 79976 [0,2,0,0,0,0|1,1,0]=4 591 B10R1.25 COC1=CC=C(C)N=C1Cl C73850 [0,2,0,0,0,0|1,1,0]=4 592 B10R1.25 COC1=CC=C(C)N=C1I F30133 [0,2,0,0,0,0|1,1,0]=4 593 B10R1.25 COC1=CC=C(Cl)N=C1Br C72025 [0,2,0,0,0,0|1,1,0]=4 594 B10R1.25 COC1=CC=C(Cl)N=C1Cl 81824 [0,2,0,0,0,0|1,1,0]=4 595 B10R1.25 COC1=CC=C(Cl)N=C1I 82334 [0,2,0,0,0,0|1,1,0]=4 596 B10R1.25 COC1=CC=C(N)N=C1Cl F19661 [0,2,0,0,0,0|1,1,0]=4 597 B10R1.25 COC1=CN=C(Br)C=C1Cl F16734 [0,2,0,0,0,0|1,1,0]=4 598 B10R1.25 COC1=CN=C(Br)C=C1N AC1554 [0,2,0,0,0,0|1,1,0]=4 599 B10R1.25 COC1=CN=C(Br)C=C1O AT23971 [0,2,0,0,0,0|1,1,0]=4 600 B10R1.25 COC1=CN=C(Cl)C=C1N C71879 [0,2,0,0,0,0|1,1,0]=4 601 B10R1.25 COC1=CNC(=O)C=C1Br W15670 [0,2,0,0,0,0|1,1,0]=4 602 B10R1.25 COC1=NC=C(Cl)C=C1N E70381 [0,2,0,0,0,0|1,1,0]=4 603 B10R1.25 COC1=NC=C(F)C=C1C C76918 [0,2,0,0,0,0|1,1,0]=4 604 B10R1.25 COC1=NC=C(F)C=C1N C71761 [0,2,0,0,0,0|1,1,0]=4 605 B10R1.25 COC1=NC=C(F)C=C1O S10276 [0,2,0,0,0,0|1,1,0]=4 606 B10R1.25 CSC1=C(Br)C=C(F)C=C1 69928 [0,2,0,0,0,0|0,0,0]=2 607 B10R1.25 CSC1=C(Cl)C=C(Br)C=C1 Y11168 [0,2,0,0,0,0|0,0,0]=2 608 B10R1.25 CSC1=C(Cl)N=C(Cl)N=C1 P13091 [0,2,0,0,0,0|2,0,0]=4 609 B10R1.25 CSC1=C(F)C=C(N)C=C1 94984 [0,2,0,0,0,0|0,0,0]=2 610 B10R1.25 CSC1=C(F)N=C(F)C=C1 D79861 [0,2,0,0,0,0|1,0,0]=3 611 B10R1.25 CSC1=NC=C(Cl)N=C1Cl 38290 [0,2,0,0,0,0|2,0,0]=4 612 B10R1.25 FC1=C(CBr)C=CC(I)=C1 55991 [0,2,0,0,0,0|2,0,0]=4 613 B10R1.25 FC1=CC(I)=C(CBr)C=C1 56051 [0,2,0,0,0,0|2,0,0]=4 614 B10R1.25 N#CC1=C(Br)C=C(O)C=C1 AC6875 [0,2,0,0,0,0|2,0,0]=4 615 B10R1.25 N#CC1=C(Cl)C=C(I)C=C1 95932 [0,2,0,0,0,0|2,0,0]=4 616 B10R1.25 N#CC1=C(O)C=C(N)C=C1 S10894 [0,2,0,0,0,0|2,0,0]=4 617 B10R1.25 N#CC1=C(O)C=C(O)C=C1 C76016 [0,2,0,0,0,0|2,0,0]=4 618 B10R1.25 NC1=C(C=O)C=CC(F)=C1 34566 [0,2,0,0,0,0|2,0,0]=4 619 B10R1.25 NC1=CC(Br)=C(C=O)C=C1 C16178 [0,2,0,0,0,0|2,0,0]=4 620 B10R1.25 NC1=CC(F)=C(C=O)C=C1 AC6806 [0,2,0,0,0,0|2,0,0]=4 621 B10R1.25 NC1=CC(N)=C(C=O)C=C1 C10737 [0,2,0,0,0,0|2,0,0]=4 622 B10R1.25 NCC1=C(Br)C=C(Cl)C=C1 C73878 [0,2,0,0,0,0|2,0,0]=4 623 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11612 [0,2,0,0,0,0|2,0,0]=4 624 B10R1.25 NCC1=C(Cl)C=C(Br)C=C1 Y12485 [0,2,0,0,0,0|2,0,0]=4 625 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14725 [0,2,0,0,0,0|2,0,0]=4 626 B10R1.25 NCC1=C(O)C=C(Br)C=C1 N13143 [0,2,0,0,0,0|2,0,0]=4 627 B10R1.25 NNC1=C(Cl)C=C(Br)C=C1 D83061 [0,2,0,0,0,0|2,0,0]=4 628 B10R1.25 NNC1=C(Cl)C=C(I)C=C1 27583 [0,2,0,0,0,0|2,0,0]=4 629 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 67919 [0,2,0,0,0,0|2,0,0]=4 630 B10R1.25 O=CC1=C(I)C=C(F)C=C1 CL9496 [0,2,0,0,0,0|2,0,0]=4 631 B10R1.25 OCC1=C(Br)C=C(O)C=C1 98273 [0,2,0,0,0,0|2,0,0]=4 632 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 CL9122 [0,2,0,0,0,0|2,0,0]=4 633 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 95677 [0,2,0,0,0,0|2,0,0]=4 634 B10R1.25 OCC1=C(O)C=C(Br)C=C1 35526 [0,2,0,0,0,0|2,0,0]=4 635 B10R1.176 BrCC1=CC(Br)=C(Br)C=C1 C76015 [0,2,0,0,0,0|2,0,0]=4 636 B10R1.176 C#CC1=CC(F)=C(F)C=C1 F30165 [0,2,0,0,0,0|1,0,1]=4 637 B10R1.176 C=CC1=CC(Cl)=C(Cl)C=C1 C15264 [0,2,0,0,0,0|1,0,1]=4 638 B10R1.176 C=CC1=CC(F)=C(Cl)C=C1 S10073 [0,2,0,0,0,0|1,0,1]=4 639 B10R1.176 C=CC1=CC(I)=C(O)C=C1 D94289 [0,2,0,0,0,0|1,0,1]=4 640 B10R1.176 CC1=C(Br)C=CC(CN)=C1 N12558 [0,2,0,0,0,0|2,0,0]=4 641 B10R1.176 CC1=C(Br)C=CC(CN)=C1 Y12257 [0,2,0,0,0,0|2,0,0]=4 642 B10R1.176 CC1=C(F)C=CC(CBr)=C1 D87871 [0,2,0,0,0,0|2,0,0]=4 643 B10R1.176 CC1=C(O)C=C(C=O)C=C1 W16814 [0,2,0,0,0,0|2,0,0]=4 644 B10R1.176 CC1=C(O)C=CC(C#N)=C1 O11240 [0,2,0,0,0,0|2,0,0]=4 645 B10R1.176 CC1=C(O)C=CC(CN)=C1 N14331 [0,2,0,0,0,0|2,0,0]=4 646 B10R1.176 CC1=C(O)C=CC(CO)=C1 C73536 [0,2,0,0,0,0|2,0,0]=4 647 B10R1.176 CCC1=CC(Br)=C(C)C=C1 D93128 [0,2,0,0,0,0|1,0,0]=3 648 B10R1.176 CCC1=CC(Br)=C(I)C=C1 Y11303 [0,2,0,0,0,0|1,0,0]=3 649 B10R1.176 CCC1=CC(C)=C(C)C=C1 C77212 [0,2,0,0,0,0|1,0,0]=3 650 B10R1.176 CCC1=CC(C)=C(I)C=C1 W17700 [0,2,0,0,0,0|1,0,0]=3 651 B10R1.176 CCC1=CC(F)=C(N)C=C1 N13141 [0,2,0,0,0,0|1,0,0]=3 652 B10R1.176 CCC1=CC(N)=C(N)C=C1 76101 [0,2,0,0,0,0|1,0,0]=3 653 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 O10732 [0,2,0,0,0,0|1,0,0]=3 654 B10R1.176 CCC1=NC(Cl)=C(Br)C=C1 C72403 [0,2,0,0,0,0|2,0,0]=4 655 B10R1.176 COC1=CC(=O)N(C)C=C1 79097 [0,2,0,0,0,0|1,1,0]=4 656 B10R1.176 COC1=CC(Br)=C(C)C=N1 P20929 [0,2,0,0,0,0|1,1,0]=4 657 B10R1.176 COC1=CC(Br)=C(C)N=C1 P12000 [0,2,0,0,0,0|1,1,0]=4 658 B10R1.176 COC1=CC(Br)=C(Cl)C=N1 C71758 [0,2,0,0,0,0|1,1,0]=4 659 B10R1.176 COC1=CC(Br)=C(Cl)N=C1 C14046 [0,2,0,0,0,0|1,1,0]=4 660 B10R1.176 COC1=CC(Br)=C(F)C=N1 F12224 [0,2,0,0,0,0|1,1,0]=4 661 B10R1.176 COC1=CC(Cl)=C(Br)C=N1 25841 [0,2,0,0,0,0|1,1,0]=4 662 B10R1.176 COC1=CC(Cl)=C(I)C=C1 D72033 [0,2,0,0,0,0|0,1,0]=3 663 B10R1.176 COC1=CC(Cl)=C(I)C=N1 W10502 [0,2,0,0,0,0|1,1,0]=4 664 B10R1.176 COC1=CC(F)=C(N)C=N1 D94273 [0,2,0,0,0,0|1,1,0]=4 665 B10R1.176 COC1=CC(F)=C(N)N=C1 C71770 [0,2,0,0,0,0|1,1,0]=4 666 B10R1.176 COC1=CC(I)=C(Cl)C=N1 S10269 [0,2,0,0,0,0|1,1,0]=4 667 B10R1.176 COC1=CC(I)=C(F)C=N1 22601 [0,2,0,0,0,0|1,1,0]=4 668 B10R1.176 COC1=CC(O)=C(F)C=N1 79067 [0,2,0,0,0,0|1,1,0]=4 669 B10R1.176 COC1=CC(O)=C(N)C=C1 20700 [0,2,0,0,0,0|0,1,0]=3 670 B10R1.176 COC1=CC(O)=C(O)C=C1 F18177 [0,2,0,0,0,0|0,1,0]=3 671 B10R1.176 COC1=CC=C(Br)C(Br)=N1 S10112 [0,2,0,0,0,0|1,1,0]=4 672 B10R1.176 COC1=CC=C(Cl)C(Cl)=N1 C76674 [0,2,0,0,0,0|1,1,0]=4 673 B10R1.176 COC1=CN=C(Br)C(F)=C1 D83224 [0,2,0,0,0,0|1,1,0]=4 674 B10R1.176 COC1=CN=C(Br)C(N)=C1 24981 [0,2,0,0,0,0|1,1,0]=4 675 B10R1.176 COC1=CN=C(Cl)C(C)=C1 C76383 [0,2,0,0,0,0|1,1,0]=4 676 B10R1.176 COC1=NC(Cl)=C(Br)C=C1 C76489 [0,2,0,0,0,0|1,1,0]=4 677 B10R1.176 COC1=NC(F)=C(Br)C=C1 S10193 [0,2,0,0,0,0|1,1,0]=4 678 B10R1.176 COC1=NC(N)=C(Br)C=C1 C75397 [0,2,0,0,0,0|1,1,0]=4 679 B10R1.176 COC1=NC(N)=C(Cl)C=C1 O10989 [0,2,0,0,0,0|1,1,0]=4 680 B10R1.176 COC1=NC=C(C)C(N)=C1 C72054 [0,2,0,0,0,0|1,1,0]=4 681 B10R1.176 COC1=NC=C(N)C(N)=C1 29189 [0,2,0,0,0,0|1,1,0]=4 682 B10R1.176 CSC1=CN=C(Br)C(F)=C1 D79863 [0,2,0,0,0,0|1,0,0]=3 683 B10R1.176 CSC1=CN=C(Cl)C(C)=C1 D79862 [0,2,0,0,0,0|1,0,0]=3 684 B10R1.176 CSC1=CN=C(Cl)C(Cl)=N1 38289 [0,2,0,0,0,0|2,0,0]=4 685 B10R1.176 CSC1=NC=C(C)C(Cl)=N1 26737 [0,2,0,0,0,0|2,0,0]=4 686 B10R1.176 CSC1=NC=C(F)C(Cl)=N1 37233 [0,2,0,0,0,0|2,0,0]=4 687 B10R1.176 CSC1=NC=C(I)C(=O)N1 72699 [0,2,0,0,0,0|2,0,0]=4 688 B10R1.176 ClC1=C(Br)C=CC(CBr)=C1 76034 [0,2,0,0,0,0|2,0,0]=4 689 B10R1.176 FC1=C(I)C=CC(CBr)=C1 CL9459 [0,2,0,0,0,0|2,0,0]=4 690 B10R1.176 N#CC1=CC(O)=C(Cl)C=C1 C75425 [0,2,0,0,0,0|2,0,0]=4 691 B10R1.176 N#CC1=CC(O)=C(I)C=C1 35341 [0,2,0,0,0,0|2,0,0]=4 692 B10R1.176 N#CC1=CC(O)=C(N)C=C1 35473 [0,2,0,0,0,0|2,0,0]=4 693 B10R1.176 NC1=C(F)C=C(CO)C=C1 74966 [0,2,0,0,0,0|2,0,0]=4 694 B10R1.176 NC1=C(O)C=CC(CO)=C1 Y13579 [0,2,0,0,0,0|2,0,0]=4 695 B10R1.176 NCC1=CC(F)=C(Br)C=C1 95673 [0,2,0,0,0,0|2,0,0]=4 696 B10R1.176 NCC1=CC(F)=C(Br)C=C1 CS1629 [0,2,0,0,0,0|2,0,0]=4 697 B10R1.176 NCC1=CC(F)=C(N)C=C1 C90556 [0,2,0,0,0,0|2,0,0]=4 698 B10R1.176 NCC1=CC(O)=C(Cl)C=C1 Y11334 [0,2,0,0,0,0|2,0,0]=4 699 B10R1.176 NCC1=CC(O)=C(F)C=C1 D71055 [0,2,0,0,0,0|2,0,0]=4 700 B10R1.176 NCC1=CC(O)=C(O)C=C1 S11863 [0,2,0,0,0,0|2,0,0]=4 701 B10R1.176 NNC1=CC(Cl)=C(Br)C=C1 F17062 [0,2,0,0,0,0|2,0,0]=4 702 B10R1.176 NNC1=CC(F)=C(Br)C=C1 H10006 [0,2,0,0,0,0|2,0,0]=4 703 B10R1.176 NNC1=CC(F)=C(Br)C=C1 H11440 [0,2,0,0,0,0|2,0,0]=4 704 B10R1.176 O=CC1=CC(F)=C(I)C=C1 23742 [0,2,0,0,0,0|2,0,0]=4 705 B10R1.176 O=CC1=CC(I)=C(F)C=C1 34606 [0,2,0,0,0,0|2,0,0]=4 706 B10R1.176 O=CC1=CC(O)=C(Br)C=C1 34572 [0,2,0,0,0,0|2,0,0]=4 707 B10R1.176 O=CC1=CC(O)=C(I)C=C1 62940 [0,2,0,0,0,0|2,0,0]=4 708 B10R1.176 OC1=C(F)C=CC(CCl)=C1 D79295 [0,2,0,0,0,0|2,0,0]=4 709 B10R1.176 OCC1=CC(O)=C(F)C=C1 C77207 [0,2,0,0,0,0|2,0,0]=4 710 B10R1.2 BrCC1=CC=CC(I)=C1Br CL8690 [0,2,0,0,0,0|2,0,0]=4 711 B10R1.2 CC1=C(Br)C=CC=C1CBr 54940 [0,2,0,0,0,0|2,0,0]=4 712 B10R1.2 CC1=C(Br)C=CC=C1CN 98269 [0,2,0,0,0,0|2,0,0]=4 713 B10R1.2 CC1=C(C#N)C=CC=C1N 51688 [0,2,0,0,0,0|2,0,0]=4 714 B10R1.2 CC1=C(I)C=CC=C1CBr CL9688 [0,2,0,0,0,0|2,0,0]=4 715 B10R1.2 CC1=C(I)C=CC=C1CO CL9687 [0,2,0,0,0,0|2,0,0]=4 716 B10R1.2 CC1=C(O)C=CC=C1C#N 26569 [0,2,0,0,0,0|2,0,0]=4 717 B10R1.2 CC1=CC=CC(C#N)=C1O F20100 [0,2,0,0,0,0|2,0,0]=4 718 B10R1.2 CC1=CC=CC(CN)=C1F CL9718 [0,2,0,0,0,0|2,0,0]=4 719 B10R1.2 CC1=CC=CC(CN)=C1O Y10488 [0,2,0,0,0,0|2,0,0]=4 720 B10R1.2 CC1=CC=CC(CO)=C1Br 74396 [0,2,0,0,0,0|2,0,0]=4 721 B10R1.2 CC1=CC=CC(CO)=C1O F20046 [0,2,0,0,0,0|2,0,0]=4 722 B10R1.2 CC1=CC=CC(NN)=C1C A11966 [0,2,0,0,0,0|2,0,0]=4 723 B10R1.2 CCC1=CC=CC(O)=C1O C77203 [0,2,0,0,0,0|1,0,0]=3 724 B10R1.2 CCC1=CC=NC(N)=C1Br F50948 [0,2,0,0,0,0|2,0,0]=4 725 B10R1.2 CNC1=C(N)C(Br)=NC=C1 79198 [0,2,0,0,0,0|2,0,0]=4 726 B10R1.2 CNC1=CC=CC(Br)=C1N 79197 [0,2,0,0,0,0|1,0,0]=3 727 B10R1.2 COC1=C(Br)C(N)=CC=N1 38420 [0,2,0,0,0,0|1,1,0]=4 728 B10R1.2 COC1=C(C)C(Br)=NC=C1 D83215 [0,2,0,0,0,0|1,1,0]=4 729 B10R1.2 COC1=C(C)C(Cl)=NC=C1 D84336 [0,2,0,0,0,0|1,1,0]=4 730 B10R1.2 COC1=C(C)C(N)=CN=C1 N13054 [0,2,0,0,0,0|1,1,0]=4 731 B10R1.2 COC1=C(Cl)C(Cl)=CC=N1 D83251 [0,2,0,0,0,0|1,1,0]=4 732 B10R1.2 COC1=C(Cl)C(Cl)=NC=C1 P17363 [0,2,0,0,0,0|1,1,0]=4 733 B10R1.2 COC1=C(Cl)C(N)=CC=C1 C12073 [0,2,0,0,0,0|0,1,0]=3 734 B10R1.2 COC1=C(F)C(Br)=NC=C1 H11794 [0,2,0,0,0,0|1,1,0]=4 735 B10R1.2 COC1=C(I)C(N)=CC=C1 34421 [0,2,0,0,0,0|0,1,0]=3 736 B10R1.2 COC1=C(N)C(N)=CC=C1 35991 [0,2,0,0,0,0|0,1,0]=3 737 B10R1.2 COC1=C(N)C(N)=CC=C1 Y10418 [0,2,0,0,0,0|0,1,0]=3 738 B10R1.2 COC1=C(O)C(N)=CC=C1 O10656 [0,2,0,0,0,0|0,1,0]=3 739 B10R1.2 COC1=CC=CC(Br)=C1Br CL8946 [0,2,0,0,0,0|0,1,0]=3 740 B10R1.2 COC1=CC=CC(Cl)=C1Br F20980 [0,2,0,0,0,0|0,1,0]=3 741 B10R1.2 COC1=CC=CC(Cl)=C1O O10746 [0,2,0,0,0,0|0,1,0]=3 742 B10R1.2 COC1=CC=CC(F)=C1I 34512 [0,2,0,0,0,0|0,1,0]=3 743 B10R1.2 COC1=CC=CC(I)=C1N S10846 [0,2,0,0,0,0|0,1,0]=3 744 B10R1.2 COC1=CC=CC(I)=C1O 84030 [0,2,0,0,0,0|0,1,0]=3 745 B10R1.2 COC1=CN=CC(Br)=C1C CS1899 [0,2,0,0,0,0|1,1,0]=4 746 B10R1.2 COC1=NC=CC(Br)=C1C C71404 [0,2,0,0,0,0|1,1,0]=4 747 B10R1.2 COC1=NC=CC(C)=C1N 34938 [0,2,0,0,0,0|1,1,0]=4 748 B10R1.2 COC1=NC=CC(I)=C1C 96428 [0,2,0,0,0,0|1,1,0]=4 749 B10R1.2 COC1=NC=CC(I)=C1Cl 92374 [0,2,0,0,0,0|1,1,0]=4 750 B10R1.2 COC1=NC=CC(N)=C1N 24240 [0,2,0,0,0,0|1,1,0]=4 751 B10R1.2 CSC1=C(C)C(Cl)=NC=N1 W16885 [0,2,0,0,0,0|2,0,0]=4 752 B10R1.2 CSC1=CC=CC(Cl)=C1C F14681 [0,2,0,0,0,0|0,0,0]=2 753 B10R1.2 N#CC1=C(N)C(N)=CC=C1 CL9178 [0,2,0,0,0,0|2,0,0]=4 754 B10R1.2 N#CC1=CC=CC(Cl)=C1Br AC1543 [0,2,0,0,0,0|2,0,0]=4 755 B10R1.2 N#CC1=CC=CC(F)=C1I 35314 [0,2,0,0,0,0|2,0,0]=4 756 B10R1.2 N#CC1=CC=CC(F)=C1O 75820 [0,2,0,0,0,0|2,0,0]=4 757 B10R1.2 N#CC1=CC=CC(I)=C1N C13344 [0,2,0,0,0,0|2,0,0]=4 758 B10R1.2 N#CC1=CC=CC(N)=C1Br C14256 [0,2,0,0,0,0|2,0,0]=4 759 B10R1.2 N#CC1=CC=CC(N)=C1Cl 98212 [0,2,0,0,0,0|2,0,0]=4 760 B10R1.2 N#CC1=CC=CC(O)=C1Cl C10157 [0,2,0,0,0,0|2,0,0]=4 761 B10R1.2 N#CC1=CC=CC(O)=C1F 95628 [0,2,0,0,0,0|2,0,0]=4 762 B10R1.2 NC1=C(Br)C=CC=C1C=O 36406 [0,2,0,0,0,0|2,0,0]=4 763 B10R1.2 NC1=C(C=O)C=CC=C1O D94436 [0,2,0,0,0,0|2,0,0]=4 764 B10R1.2 NC1=C(F)C=CC=C1CO W11419 [0,2,0,0,0,0|2,0,0]=4 765 B10R1.2 NCC1=CC=CC(Br)=C1F N13145 [0,2,0,0,0,0|2,0,0]=4 766 B10R1.2 NCC1=CC=CC(Br)=C1F O10075 [0,2,0,0,0,0|2,0,0]=4 767 B10R1.2 NCC1=CC=CC(F)=C1Br C71791 [0,2,0,0,0,0|2,0,0]=4 768 B10R1.2 NCC1=CC=CC(I)=C1Br C72076 [0,2,0,0,0,0|2,0,0]=4 769 B10R1.2 NCC1=CC=CC(O)=C1O S10740 [0,2,0,0,0,0|2,0,0]=4 770 B10R1.2 O=CC1=CC=CC(F)=C1I 34605 [0,2,0,0,0,0|2,0,0]=4 771 B10R1.2 OCC1=CC=CC(F)=C1Br 35519 [0,2,0,0,0,0|2,0,0]=4 772 B10R1.2 OCC1=CC=CC(F)=C1Cl CL8694 [0,2,0,0,0,0|2,0,0]=4 773 B10R1.2 OCC1=CC=CC(F)=C1I 79245 [0,2,0,0,0,0|2,0,0]=4 774 B10R1.2 OCC1=CC=CC(I)=C1Br CL8691 [0,2,0,0,0,0|2,0,0]=4 775 B10R1.8 C#CC1=CC(Cl)=CC(Cl)=C1 W16114 [0,2,0,0,0,0|1,0,1]=4 776 B10R1.8 C#CC1=CC(O)=CC(O)=C1 W16293 [0,2,0,0,0,0|1,0,1]=4 777 B10R1.8 CC1=CC(Br)=CC(CN)=C1 92716 [0,2,0,0,0,0|2,0,0]=4 778 B10R1.8 CC1=CC(Br)=CC(CO)=C1 52074 [0,2,0,0,0,0|2,0,0]=4 779 B10R1.8 CC1=CC(C#N)=CC(N)=C1 88824 [0,2,0,0,0,0|2,0,0]=4 780 B10R1.8 CC1=CC(CO)=CC(N)=C1 35511 [0,2,0,0,0,0|2,0,0]=4 781 B10R1.8 CC1=CC(Cl)=CC(C=O)=C1 34582 [0,2,0,0,0,0|2,0,0]=4 782 B10R1.8 CC1=CC(F)=CC(CN)=C1 D81546 [0,2,0,0,0,0|2,0,0]=4 783 B10R1.8 CCC1=CC(Br)=CC(N)=C1 O10968 [0,2,0,0,0,0|1,0,0]=3 784 B10R1.8 CCC1=CC(C)=CC(O)=C1 D84187 [0,2,0,0,0,0|1,0,0]=3 785 B10R1.8 CNC1=CC(Cl)=NC(Cl)=C1 I11051 [0,2,0,0,0,0|2,0,0]=4 786 B10R1.8 CNC1=CC(F)=CC(F)=C1 W16587 [0,2,0,0,0,0|1,0,0]=3 787 B10R1.8 COC1=CC(=O)OC(C)=C1 A10838 [0,2,0,0,0,0|1,1,0]=4 788 B10R1.8 COC1=CC(Br)=CC(Cl)=N1 O11171 [0,2,0,0,0,0|1,1,0]=4 789 B10R1.8 COC1=CC(Br)=NC(N)=C1 O11551 [0,2,0,0,0,0|1,1,0]=4 790 B10R1.8 COC1=CC(Cl)=CC(Cl)=N1 79601 [0,2,0,0,0,0|1,1,0]=4 791 B10R1.8 COC1=CC(Cl)=NC(C)=C1 A11697 [0,2,0,0,0,0|1,1,0]=4 792 B10R1.8 COC1=CC(Cl)=NC(N)=C1 O11575 [0,2,0,0,0,0|1,1,0]=4 793 B10R1.8 COC1=CC(F)=NC(F)=C1 D83208 [0,2,0,0,0,0|1,1,0]=4 794 B10R1.8 COC1=CC(N)=CC(Br)=N1 O10695 [0,2,0,0,0,0|1,1,0]=4 795 B10R1.8 COC1=CC(N)=CC(Cl)=N1 79629 [0,2,0,0,0,0|1,1,0]=4 796 B10R1.8 COC1=NC(C)=CC(Br)=C1 C71306 [0,2,0,0,0,0|1,1,0]=4 797 B10R1.8 COC1=NC(C)=CC(N)=C1 F21240 [0,2,0,0,0,0|1,1,0]=4 798 B10R1.8 COC1=NC(N)=CC(Br)=C1 D83261 [0,2,0,0,0,0|1,1,0]=4 799 B10R1.8 COC1=NC(N)=CC(Cl)=C1 O11220 [0,2,0,0,0,0|1,1,0]=4 800 B10R1.8 CSC1=CC(C)=NC(Cl)=N1 P18328 [0,2,0,0,0,0|2,0,0]=4 801 B10R1.8 CSC1=NC(N)=CC(C)=N1 C74284 [0,2,0,0,0,0|2,0,0]=4 802 B10R1.8 CSC1=NC(O)=CC(Cl)=N1 81362 [0,2,0,0,0,0|2,0,0]=4 803 B10R1.8 CSC1=NC(O)=NC(C)=C1 H10246 [0,2,0,0,0,0|2,0,0]=4 804 B10R1.8 N#CC1=CC(Br)=CC(O)=C1 91757 [0,2,0,0,0,0|2,0,0]=4 805 B10R1.8 N#CC1=CC(I)=CC(Br)=C1 C15499 [0,2,0,0,0,0|2,0,0]=4 806 B10R1.8 N#CC1=CC(N)=CC(N)=C1 S10867 [0,2,0,0,0,0|2,0,0]=4 807 B10R1.8 NC1=CC(CO)=CC(I)=C1 68577 [0,2,0,0,0,0|2,0,0]=4 808 B10R1.8 NOC1=CC(Cl)=CC(Cl)=C1 C77396 [0,2,0,0,0,0|1,1,0]=4 809 B10R1.8 O=CC1=CC(I)=CC(Br)=C1 CL9323 [0,2,0,0,0,0|2,0,0]=4 810 B10R1.8 O=CC1=CC(I)=CC(F)=C1 CL9234 [0,2,0,0,0,0|2,0,0]=4 811 B10R1.8 O=CC1=CC(I)=CC(I)=C1 N16985 [0,2,0,0,0,0|2,0,0]=4 812 B10R1.8 OCC1=CC(Br)=CC(O)=C1 C14009 [0,2,0,0,0,0|2,0,0]=4 813 B10R1.8 OCC1=CC(I)=CC(I)=C1 C75498 [0,2,0,0,0,0|2,0,0]=4 814 B10R1.10 C=CCC1=CC=CC(O)=C1 AC1729 [0,2,0,0,0,0|1,0,1]=4 815 B10R1.10 CC#CC1=CC(Br)=CN=C1 F13546 [0,2,0,0,0,0|2,0,0]=4 816 B10R1.10 CC#CC1=CC=CC(Br)=C1 Y10633 [0,2,0,0,0,0|1,0,0]=3 817 B10R1.10 CC1=CC=CC(CCCl)=C1 C74996 [0,2,0,0,0,0|1,0,0]=3 818 B10R1.10 CCCC1=CC=CC(Br)=C1 W17019 [0,2,0,0,0,0|1,0,0]=3 819 B10R1.10 CCCC1=CC=CC(N)=C1 S11405 [0,2,0,0,0,0|1,0,0]=3 820 B10R1.10 CCNC1=CC=CC(F)=C1 AB11320 [0,2,0,0,0,0|1,0,0]=3 821 B10R1.10 CCNC1=CC=CC(O)=C1 T71675 [0,2,0,0,0,0|1,0,0]=3 822 B10R1.10 CCOC1=CC(Br)=NC=C1 C73290 [0,2,0,0,0,0|1,1,0]=4 823 B10R1.10 CCOC1=CC(Cl)=NC=C1 AC1568 [0,2,0,0,0,0|1,1,0]=4 824 B10R1.10 CCOC1=NC(N)=CC=C1 78558 [0,2,0,0,0,0|1,1,0]=4 825 B10R1.10 CCOC1=NC=CC(Cl)=C1 26911 [0,2,0,0,0,0|1,1,0]=4 826 B10R1.10 CNCC1=CC(C)=CC=C1 C78188 [0,2,0,0,0,0|1,0,0]=3 827 B10R1.10 CNCC1=CC=CC(Br)=N1 C76128 [0,2,0,0,0,0|2,0,0]=4 828 B10R1.10 COCC1=CC(Br)=CN=C1 W19232 [0,2,0,0,0,0|1,1,0]=4 829 B10R1.10 COCC1=CC(Cl)=NC=C1 CS1797 [0,2,0,0,0,0|1,1,0]=4 830 B10R1.10 CSCC1=CC(F)=CC=C1 A12575 [0,2,0,0,0,0|0,0,0]=2 831 B10R1.10 CSCC1=CC(N)=NC=C1 79313 [0,2,0,0,0,0|1,0,0]=3 832 B10R1.10 CSCC1=CC=CC(Br)=C1 W10420 [0,2,0,0,0,0|0,0,0]=2 833 B10R1.10 CSCC1=CC=CC(Cl)=C1 W19463 [0,2,0,0,0,0|0,0,0]=2 834 B10R1.10 NCCC1=CC=CC(N)=C1 51444 [0,2,0,0,0,0|1,0,0]=3 835 B10R1.10 NNCC1=CC=CC(Br)=C1 AC3898 [0,2,0,0,0,0|2,0,0]=4 836 B10R1.10 NNCC1=CC=CC(F)=C1 75837 [0,2,0,0,0,0|2,0,0]=4 837 B10R1.10 O=CCC1=CC=CC(Br)=C1 AB10311 [0,2,0,0,0,0|1,0,1]=4 838 B10R1.10 O=CCC1=CC=CC(F)=C1 W16826 [0,2,0,0,0,0|1,0,1]=4 839 B10R1.10 OCCC1=CC(Cl)=NC=C1 70307 [0,2,0,0,0,0|2,0,0]=4 840 B10R1.10 OCCC1=CC=CC(Br)=N1 AC1439 [0,2,0,0,0,0|2,0,0]=4 841 B10R1.10 OCCC1=NC=CC(Br)=C1 73397 [0,2,0,0,0,0|2,0,0]=4 842 B10R1.30 C#CC1=C(F)C=CC(Br)=C1 D95606 [0,2,0,0,0,0|1,0,1]=4 843 B10R1.30 C#CC1=C(N)C=CC(C)=C1 C74053 [0,2,0,0,0,0|1,0,1]=4 844 B10R1.30 CC1=C(C#N)C=C(I)C=C1 C75444 [0,2,0,0,0,0|2,0,0]=4 845 B10R1.30 CC1=C(C=O)C=C(Cl)C=C1 CK2094 [0,2,0,0,0,0|2,0,0]=4 846 B10R1.30 CC1=C(C=O)C=C(I)C=C1 F20710 [0,2,0,0,0,0|2,0,0]=4 847 B10R1.30 CC1=C(CCl)C=C(Cl)C=C1 AT13353 [0,2,0,0,0,0|2,0,0]=4 848 B10R1.30 CC1=C(CO)C=C(Cl)C=C1 70915 [0,2,0,0,0,0|2,0,0]=4 849 B10R1.30 CC1=C(CO)C=C(I)C=C1 F20542 [0,2,0,0,0,0|2,0,0]=4 850 B10R1.30 CC1=C(NN)C=C(Br)C=C1 O10123 [0,2,0,0,0,0|2,0,0]=4 851 B10R1.30 CC1=C(NN)C=C(Cl)C=C1 C75556 [0,2,0,0,0,0|2,0,0]=4 852 B10R1.30 CC1=CC(C#N)=C(O)C=C1 90838 [0,2,0,0,0,0|2,0,0]=4 853 B10R1.30 CC1=CC(C=O)=C(I)C=C1 H10219 [0,2,0,0,0,0|2,0,0]=4 854 B10R1.30 CC1=CC(CBr)=C(C)C=C1 CL9683 [0,2,0,0,0,0|2,0,0]=4 855 B10R1.30 CC1=CC(CN)=C(F)C=C1 W18911 [0,2,0,0,0,0|2,0,0]=4 856 B10R1.30 CC1=CC(CO)=C(Br)C=C1 78891 [0,2,0,0,0,0|2,0,0]=4 857 B10R1.30 CC1=CC(CO)=C(O)C=C1 A11080 [0,2,0,0,0,0|2,0,0]=4 858 B10R1.30 CC1=CC(NN)=C(Cl)C=C1 C77156 [0,2,0,0,0,0|2,0,0]=4 859 B10R1.30 CCC1=C(N)C=CC(F)=C1 D83440 [0,2,0,0,0,0|1,0,0]=3 860 B10R1.30 CCC1=C(O)C=CC(C)=N1 T71674 [0,2,0,0,0,0|2,0,0]=4 861 B10R1.30 CCN1C=C(Br)C=CC1=O AC2035 [0,2,0,0,0,0|2,0,0]=4 862 B10R1.30 CNC1=C(C)C=CC(Cl)=C1 W16029 [0,2,0,0,0,0|1,0,0]=3 863 B10R1.30 CNC1=C(C)C=CC(O)=C1 C75943 [0,2,0,0,0,0|1,0,0]=3 864 B10R1.30 CNC1=C(N)C=CC(C)=C1 N12938 [0,2,0,0,0,0|1,0,0]=3 865 B10R1.30 CNC1=C(N)C=CC(Cl)=N1 W11032 [0,2,0,0,0,0|2,0,0]=4 866 B10R1.30 CNC1=CC(Br)=CN=C1N N10250 [0,2,0,0,0,0|2,0,0]=4 867 B10R1.30 COC1=C(Br)C=CC(Cl)=N1 88327 [0,2,0,0,0,0|1,1,0]=4 868 B10R1.30 COC1=C(Br)C=NC(C)=C1 N10207 [0,2,0,0,0,0|1,1,0]=4 869 B10R1.30 COC1=C(Br)C=NC(F)=C1 FD10681 [0,2,0,0,0,0|1,1,0]=4 870 B10R1.30 COC1=C(Cl)C=CC(Br)=N1 D83067 [0,2,0,0,0,0|1,1,0]=4 871 B10R1.30 COC1=C(Cl)C=NC(N)=C1 A10702 [0,2,0,0,0,0|1,1,0]=4 872 B10R1.30 COC1=C(I)C=CC(Br)=N1 W18510 [0,2,0,0,0,0|1,1,0]=4 873 B10R1.30 COC1=C(I)C=CC(C)=C1 Y14673 [0,2,0,0,0,0|0,1,0]=3 874 B10R1.30 COC1=C(I)C=CC(N)=C1 C71377 [0,2,0,0,0,0|0,1,0]=3 875 B10R1.30 COC1=C(I)C=NC(Cl)=C1 C71858 [0,2,0,0,0,0|1,1,0]=4 876 B10R1.30 COC1=C(I)C=NC(N)=C1 D76350 [0,2,0,0,0,0|1,1,0]=4 877 B10R1.30 COC1=C(N)C=CC(Cl)=C1 AB2767 [0,2,0,0,0,0|0,1,0]=3 878 B10R1.30 COC1=C(N)C=CC(N)=C1 E10141 [0,2,0,0,0,0|0,1,0]=3 879 B10R1.30 COC1=C(N)C=CC(O)=C1 30482 [0,2,0,0,0,0|0,1,0]=3 880 B10R1.30 COC1=C(O)C=CC(Br)=N1 C11325 [0,2,0,0,0,0|1,1,0]=4 881 B10R1.30 COC1=CC(Br)=CN=C1C 82190 [0,2,0,0,0,0|1,1,0]=4 882 B10R1.30 COC1=CC(Br)=NC=C1Br 94342 [0,2,0,0,0,0|1,1,0]=4 883 B10R1.30 COC1=CC(Br)=NC=C1C A11960 [0,2,0,0,0,0|1,1,0]=4 884 B10R1.30 COC1=CC(Cl)=NC=C1Cl 26260 [0,2,0,0,0,0|1,1,0]=4 885 B10R1.30 COC1=CC(Cl)=NC=C1N C72019 [0,2,0,0,0,0|1,1,0]=4 886 B10R1.30 COC1=CC(N)=CN=C1Cl 54845 [0,2,0,0,0,0|1,1,0]=4 887 B10R1.30 CSC1=C(C)C=CC(Cl)=C1 D83340 [0,2,0,0,0,0|0,0,0]=2 888 B10R1.30 CSC1=C(F)C=NC(Cl)=N1 P11955 [0,2,0,0,0,0|2,0,0]=4 889 B10R1.30 CSC1=CC(Cl)=CN=C1Cl 79286 [0,2,0,0,0,0|1,0,0]=3 890 B10R1.30 CSC1=CC(Cl)=NC=C1F D79860 [0,2,0,0,0,0|1,0,0]=3 891 B10R1.30 ClCC1=C(Br)C=CC(Br)=C1 68638 [0,2,0,0,0,0|2,0,0]=4 892 B10R1.30 ClCC1=C(Cl)C=CC(Br)=C1 35517 [0,2,0,0,0,0|2,0,0]=4 893 B10R1.30 N#CC1=C(I)C=CC(Cl)=C1 D87712 [0,2,0,0,0,0|2,0,0]=4 894 B10R1.30 N#CC1=C(I)C=CC(F)=C1 D87569 [0,2,0,0,0,0|2,0,0]=4 895 B10R1.30 N#CC1=C(N)C=CC(N)=C1 C10959 [0,2,0,0,0,0|2,0,0]=4 896 B10R1.30 N#CC1=C(O)C=CC(O)=C1 C75243 [0,2,0,0,0,0|2,0,0]=4 897 B10R1.30 NC1=C(C=O)C=C(F)C=C1 88468 [0,2,0,0,0,0|2,0,0]=4 898 B10R1.30 NC1=CC(CO)=C(Cl)C=C1 35510 [0,2,0,0,0,0|2,0,0]=4 899 B10R1.30 NCC1=C(Br)C=CC(Br)=C1 N12804 [0,2,0,0,0,0|2,0,0]=4 900 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 CK1118 [0,2,0,0,0,0|2,0,0]=4 901 B10R1.30 NCC1=C(N)C=CC(Br)=C1 C71032 [0,2,0,0,0,0|2,0,0]=4 902 B10R1.30 NCC1=C(O)C=CC(Br)=C1 O10496 [0,2,0,0,0,0|2,0,0]=4 903 B10R1.30 NNC1=C(F)C=CC(Br)=C1 C74046 [0,2,0,0,0,0|2,0,0]=4 904 B10R1.30 O=CC1=C(I)C=CC(F)=C1 34607 [0,2,0,0,0,0|2,0,0]=4 905 B10R1.30 OCC1=C(Cl)C=CC(O)=C1 C76883 [0,2,0,0,0,0|2,0,0]=4 906 B10R1.113 C=C(C)C1=CC(Br)=CN=C1 27507 [0,2,0,0,0,0|2,0,0]=4 907 B10R1.113 C=C(C)C1=CC(C)=CC=C1 AC1343 [0,2,0,0,0,0|1,0,0]=3 908 B10R1.113 C=C(C)C1=CC=CC(Cl)=C1 AC1313 [0,2,0,0,0,0|1,0,0]=3 909 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 A10170 [0,2,0,0,0,0|2,0,0]=4 910 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 W17608 [0,2,0,0,0,0|2,0,0]=4 911 B10R1.113 CC(=O)C1=CC(C)=NC=C1 27585 [0,2,0,0,0,0|2,0,0]=4 912 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 78890 [0,2,0,0,0,0|2,0,0]=4 913 B10R1.113 CC(=O)C1=CC(F)=CN=C1 N13069 [0,2,0,0,0,0|2,0,0]=4 914 B10R1.113 CC(=O)C1=CC(F)=NC=C1 52239 [0,2,0,0,0,0|2,0,0]=4 915 B10R1.113 CC(=O)C1=CC(N)=NC=C1 82952 [0,2,0,0,0,0|2,0,0]=4 916 B10R1.113 CC(=O)C1=CC=CC(Cl)=C1 D77821 [0,2,0,0,0,0|1,0,0]=3 917 B10R1.113 CC(=O)C1=CC=CC(F)=N1 F30144 [0,2,0,0,0,0|2,0,0]=4 918 B10R1.113 CC(=O)C1=C[N+]([O-])=CC=C1 31268 [0,2,0,0,0,0|2,0,0]=4 919 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 RB1136 [0,2,0,0,0,0|2,0,0]=4 920 B10R1.113 CC(=O)C1=NC=CC(N)=C1 C72011 [0,2,0,0,0,0|2,0,0]=4 921 B10R1.113 CC(C)C1=CC(Br)=CN=C1 C71734 [0,2,0,0,0,0|2,0,0]=4 922 B10R1.113 CC(C)C1=CC=CC(=O)N1 D96359 [0,2,0,0,0,0|2,0,0]=4 923 B10R1.113 CC(C)C1=CC=CC(Br)=N1 35873 [0,2,0,0,0,0|2,0,0]=4 924 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 O10744 [0,2,0,0,0,0|2,0,0]=4 925 B10R1.113 CC(C)C1=CN=CC(N)=C1 C72026 [0,2,0,0,0,0|2,0,0]=4 926 B10R1.113 CC(C)C1=NC=CC(Br)=C1 F52115 [0,2,0,0,0,0|2,0,0]=4 927 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 C77363 [0,2,0,0,0,0|2,0,0]=4 928 B10R1.113 CC(C)C1=NC=CC(N)=C1 F52587 [0,2,0,0,0,0|2,0,0]=4 929 B10R1.113 CC1=CC([C@H](C)O)=NC=C1 AB7628 [0,2,0,0,0,0|2,0,0]=4 930 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 79174 [0,2,0,0,0,0|1,0,0]=3 931 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 I11812 [0,2,0,0,0,0|1,0,0]=3 932 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 Y10001 [0,2,0,0,0,0|1,0,0]=3 933 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 Y10156 [0,2,0,0,0,0|1,0,0]=3 934 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 Y11645 [0,2,0,0,0,0|1,0,0]=3 935 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 W11160 [0,2,0,0,0,0|1,0,0]=3 936 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 W11161 [0,2,0,0,0,0|1,0,0]=3 937 B10R1.113 CC1=CC=CC([C@H](C)O)=N1 AB7630 [0,2,0,0,0,0|2,0,0]=4 938 B10R1.113 CC1=NC=CC([C@H](C)N)=C1 Y11263 [0,2,0,0,0,0|2,0,0]=4 939 B10R1.113 CC1=NC=CC([C@H](C)N)=C1 Y11474 [0,2,0,0,0,0|2,0,0]=4 940 B10R1.113 CN(C)C1=CC(Cl)=NC=C1 S11986 [0,2,0,0,0,0|2,0,0]=4 941 B10R1.113 CN(C)C1=CC(F)=NC=C1 Y10856 [0,2,0,0,0,0|2,0,0]=4 942 B10R1.113 CN(C)C1=CC(N)=NC=C1 D95136 [0,2,0,0,0,0|2,0,0]=4 943 B10R1.113 CN(C)C1=CC=CC(Br)=N1 92343 [0,2,0,0,0,0|2,0,0]=4 944 B10R1.113 CN(C)C1=NC=CC(Br)=C1 26905 [0,2,0,0,0,0|2,0,0]=4 945 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 D81619 [0,2,0,0,0,0|2,0,0]=4 946 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 N10536 [0,2,0,0,0,0|2,0,0]=4 947 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 Y11879 [0,2,0,0,0,0|2,0,0]=4 948 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 Y13386 [0,2,0,0,0,0|2,0,0]=4 949 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 Y10857 [0,2,0,0,0,0|2,0,0]=4 950 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 Y11465 [0,2,0,0,0,0|2,0,0]=4 951 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 N10750 [0,2,0,0,0,0|2,0,0]=4 952 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 N10751 [0,2,0,0,0,0|2,0,0]=4 953 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 Y11065 [0,2,0,0,0,0|2,0,0]=4 954 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 Y13387 [0,2,0,0,0,0|2,0,0]=4 955 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 74119 [0,2,0,0,0,0|2,0,0]=4 956 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 N11225 [0,2,0,0,0,0|2,0,0]=4 957 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 Y12112 [0,2,0,0,0,0|2,0,0]=4 958 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 Y13390 [0,2,0,0,0,0|2,0,0]=4 959 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 Y13391 [0,2,0,0,0,0|2,0,0]=4 960 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 90830 [0,2,0,0,0,0|2,0,0]=4 961 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 Y10994 [0,2,0,0,0,0|2,0,0]=4 962 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 Y11212 [0,2,0,0,0,0|2,0,0]=4 963 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 20368 [0,2,0,0,0,0|1,0,0]=3 964 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 Y10443 [0,2,0,0,0,0|1,0,0]=3 965 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 90542 [0,2,0,0,0,0|2,0,0]=4 966 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 D81642 [0,2,0,0,0,0|2,0,0]=4 967 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 D81648 [0,2,0,0,0,0|2,0,0]=4 968 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 N11222 [0,2,0,0,0,0|2,0,0]=4 969 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 Y12109 [0,2,0,0,0,0|2,0,0]=4 970 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 Y12110 [0,2,0,0,0,0|2,0,0]=4 971 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 Y13396 [0,2,0,0,0,0|2,0,0]=4 972 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 80051 [0,2,0,0,0,0|1,0,0]=3 973 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 Y10165 [0,2,0,0,0,0|1,0,0]=3 974 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 Y11266 [0,2,0,0,0,0|1,0,0]=3 975 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 N11224 [0,2,0,0,0,0|2,0,0]=4 976 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 Y11269 [0,2,0,0,0,0|2,0,0]=4 977 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 35666 [0,2,0,0,0,0|1,0,0]=3 978 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 I10702 [0,2,0,0,0,0|1,0,0]=3 979 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 SC1338 [0,2,0,0,0,0|1,0,0]=3 980 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 Y10157 [0,2,0,0,0,0|1,0,0]=3 981 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 Y14762 [0,2,0,0,0,0|1,0,0]=3 982 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 90537 [0,2,0,0,0,0|2,0,0]=4 983 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 90538 [0,2,0,0,0,0|2,0,0]=4 984 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 Y11175 [0,2,0,0,0,0|2,0,0]=4 985 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 Y14741 [0,2,0,0,0,0|2,0,0]=4 986 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70881 [0,2,0,0,0,0|1,0,0]=3 987 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y13415 [0,2,0,0,0,0|1,0,0]=3 988 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 N12887 [0,2,0,0,0,0|1,0,0]=3 989 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 N13189 [0,2,0,0,0,0|1,0,0]=3 990 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 Y10220 [0,2,0,0,0,0|1,0,0]=3 991 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 Y10873 [0,2,0,0,0,0|1,0,0]=3 992 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 SC1266 [0,2,0,0,0,0|1,0,0]=3 993 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 SC1260 [0,2,0,0,0,0|1,0,0]=3 994 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 SC1269 [0,2,0,0,0,0|1,0,0]=3 995 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1248 [0,2,0,0,0,0|1,0,0]=3 996 B10R1.113 C[C@H](O)C1=NC=CC(Br)=C1 AC1228 [0,2,0,0,0,0|2,0,0]=4 997 B10R1.113 FC(F)C1=CC=CC(I)=C1 72424 [0,2,0,0,0,0|2,0,0]=4 998 B10R1.113 NC(=O)C1=CC(O)=CC=C1 C75901 [0,2,0,0,0,0|2,0,0]=4 999 B10R1.113 OC1=CC=CC(C(F)F)=C1 71582 [0,2,0,0,0,0|2,0,0]=4 1000 B10R1.172 C#CC1=CC=CC(C#N)=C1 A50669 [0,2,0,0,0,0|1,0,1]=4 1001 B10R1.172 C#CC1=CC=CC(C=O)=C1 F21254 [0,2,0,0,0,0|1,0,1]=4 1002 B10R1.172 C#CC1=CC=CC(CN)=C1 C75883 [0,2,0,0,0,0|1,0,1]=4 1003 B10R1.172 C#CC1=CC=CC(SC)=C1 W13076 [0,2,0,0,0,0|0,0,0]=2 1004 B10R1.172 C=CC1=CC=CC(C=O)=C1 C15241 [0,2,0,0,0,0|1,0,1]=4 1005 B10R1.172 C=CC1=NC=CC(OC)=C1 52910 [0,2,0,0,0,0|1,1,0]=4 1006 B10R1.172 CCC1=CC=CC(C=O)=N1 87877 [0,2,0,0,0,0|2,0,0]=4 1007 B10R1.172 CCC1=CC=CC(CO)=N1 26583 [0,2,0,0,0,0|2,0,0]=4 1008 B10R1.172 CNC1=CC(OC)=NC=C1 F13448 [0,2,0,0,0,0|1,1,0]=4 1009 B10R1.172 CNC1=CC=CC(C#N)=C1 O10890 [0,2,0,0,0,0|1,0,0]=3 1010 B10R1.172 CNC1=CC=CC(NC)=C1 76715 [0,2,0,0,0,0|1,0,0]=3 1011 B10R1.172 COC1=CC=CC(CCl)=N1 36534 [0,2,0,0,0,0|1,1,0]=4 1012 B10R1.172 COC1=CN=CC(CN)=C1 38429 [0,2,0,0,0,0|1,1,0]=4 1013 B10R1.172 COC1=CN=CC(CN)=C1 Y14791 [0,2,0,0,0,0|1,1,0]=4 1014 B10R1.172 COC1=CN=CC(OC)=C1 24562 [0,2,0,0,0,0|1,1,0]=4 1015 B10R1.172 COC1=NC(CN)=CC=C1 Y11459 [0,2,0,0,0,0|1,1,0]=4 1016 B10R1.172 COC1=NC=CC(CCl)=C1 82046 [0,2,0,0,0,0|1,1,0]=4 1017 B10R1.172 COC1=NC=CC(CN)=C1 36533 [0,2,0,0,0,0|1,1,0]=4 1018 B10R1.172 COC1=NC=CC(CN)=C1 Y13036 [0,2,0,0,0,0|1,1,0]=4 1019 B10R1.172 CSC1=NC(C=O)=CC=N1 26756 [0,2,0,0,0,0|2,0,0]=4 1020 B10R1.172 CSC1=NC(CN)=CC=N1 C72245 [0,2,0,0,0,0|2,0,0]=4 1021 B10R1.172 CSC1=NC(NN)=CC=N1 F16827 [0,2,0,0,0,0|2,0,0]=4 1022 B10R1.172 CSC1=NC=NC(NN)=C1 O11236 [0,2,0,0,0,0|2,0,0]=4 1023 B10R1.172 N#CC1=CC(CN)=CC=C1 CL8992 [0,2,0,0,0,0|2,0,0]=4 1024 B10R1.172 O=CC1=CC(CO)=CC=C1 N13346 [0,2,0,0,0,0|2,0,0]=4 1025 B10R1.172 OCC1=CC=CC(CBr)=C1 23785 [0,2,0,0,0,0|2,0,0]=4 1026 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 31291 [0,2,0,0,0,0|1,0,1]=4 1027 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 32646 [0,2,0,0,0,0|1,0,1]=4 1028 B10R1.15 C=C(CBr)C1=CC=CC=C1 35089 [0,2,0,0,0,0|1,0,0]=3 1029 B10R1.15 C=C(CC)C1=CC=CC=C1 C73845 [0,2,0,0,0,0|1,0,0]=3 1030 B10R1.15 C=CC(=O)C1=CC=CC=C1 77875 [0,2,0,0,0,0|1,0,1]=4 1031 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11941 [0,2,0,0,0,0|1,0,1]=4 1032 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11942 [0,2,0,0,0,0|1,0,1]=4 1033 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y12425 [0,2,0,0,0,0|1,0,1]=4 1034 B10R1.15 CCN(C)C1=CC=CC=C1 S10715 [0,2,0,0,0,0|1,0,0]=3 1035 B10R1.15 CC[C@H](Br)C1=CC=CC=C1 A11640 [0,2,0,0,0,0|1,0,0]=3 1036 B10R1.15 CC[C@H](N)C1=CC=CN=C1 31586 [0,2,0,0,0,0|2,0,0]=4 1037 B10R1.15 CC[C@H](N)C1=CC=CN=C1 74009 [0,2,0,0,0,0|2,0,0]=4 1038 B10R1.15 CC[C@H](N)C1=CC=NC=C1 31287 [0,2,0,0,0,0|2,0,0]=4 1039 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74015 [0,2,0,0,0,0|2,0,0]=4 1040 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74017 [0,2,0,0,0,0|2,0,0]=4 1041 B10R1.15 CC[C@H](N)C1=CC=NC=C1 D81379 [0,2,0,0,0,0|2,0,0]=4 1042 B10R1.15 CC[C@H](N)C1=NC=CC=C1 F16910 [0,2,0,0,0,0|2,0,0]=4 1043 B10R1.15 CC[C@H](N)C1=NC=CC=C1 I11245 [0,2,0,0,0,0|2,0,0]=4 1044 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10610 [0,2,0,0,0,0|2,0,0]=4 1045 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11176 [0,2,0,0,0,0|2,0,0]=4 1046 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11466 [0,2,0,0,0,0|2,0,0]=4 1047 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y12115 [0,2,0,0,0,0|2,0,0]=4 1048 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T71858 [0,2,0,0,0,0|1,0,0]=3 1049 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T72707 [0,2,0,0,0,0|1,0,0]=3 1050 B10R1.15 CN(C=O)C1=NC=CC=C1 A12745 [0,2,0,0,0,0|2,0,0]=4 1051 B10R1.15 F[C@@H](CBr)C1=CC=CC=C1 32835 [0,2,0,0,0,0|1,0,0]=3 1052 B10R1.15 N=C(NN)C1=CC=CC=C1 D97377 [0,2,0,0,0,0|2,0,0]=4 1053 B10R1.15 NC[C@H](N)C1=CC=CC=C1 N12631 [0,2,0,0,0,0|1,0,0]=3 1054 B10R1.15 NC[C@H](O)C1=NC=CC=C1 C77057 [0,2,0,0,0,0|2,0,0]=4 1055 B10R1.15 NNC(=S)C1=CC=CC=C1 W10972 [0,2,0,0,0,0|2,0,0]=4 1056 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 32217 [0,2,0,0,0,0|2,0,0]=4 1057 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11463 [0,2,0,0,0,0|2,0,0]=4 1058 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12121 [0,2,0,0,0,0|2,0,0]=4 1059 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y13389 [0,2,0,0,0,0|2,0,0]=4 1060 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 F13354 [0,2,0,0,0,0|2,0,0]=4 1061 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12482 [0,2,0,0,0,0|2,0,0]=4 1062 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 D85222 [0,2,0,0,0,0|2,0,0]=4 1063 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y13398 [0,2,0,0,0,0|2,0,0]=4 1064 B10R1.15 O=C(CBr)C1=CN=CC=C1 D82267 [0,2,0,0,0,0|2,0,0]=4 1065 B10R1.15 O=C(CO)C1=NC=CC=C1 AC7454 [0,2,0,0,0,0|2,0,0]=4 1066 B10R1.15 O=C[C@H](Br)C1=CC=CC=C1 F13390 [0,2,0,0,0,0|1,0,1]=4 1067 B10R1.15 O[C@@H](CF)C1=CC=CC=C1 C91661 [0,2,0,0,0,0|1,0,0]=3 1068 B10R1.28 CC(C)(N)C1=CC=CN=C1 27050 [0,2,0,0,0,0|2,0,0]=4 1069 B10R1.28 CC(C)(N)C1=CC=NC=C1 F17065 [0,2,0,0,0,0|2,0,0]=4 1070 B10R1.28 CC(C)(N)C1=NC=CC=C1 F20062 [0,2,0,0,0,0|2,0,0]=4 1071 B10R1.28 CC(C)(O)C1=CN=CC=C1 50806 [0,2,0,0,0,0|2,0,0]=4 1072 B10R1.28 CC(C)(O)C1=NC=CC=C1 W17538 [0,2,0,0,0,0|2,0,0]=4 1073 B10R1.28 CS(=O)(=O)C1=CC=NC=C1 C15067 [0,2,0,0,0,0|1,0,1]=4 1074 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 D77743 [0,2,0,0,0,0|1,0,0]=3 1075 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 D77813 [0,2,0,0,0,0|1,0,0]=3 1076 B10R1.28 C[S@](=N)(=O)C1=CC=CC=C1 W16234 [0,2,0,0,0,0|0,0,1]=3 1077 B10R1.28 C[Sn](C)(C)C1=NC=CC=C1 T71744 [0,2,0,0,0,0|2,0,0]=4 1078 B10R1.61 C=C(C)C1=C(Br)C=CC=C1 W17018 [0,2,0,0,0,0|1,0,0]=3 1079 B10R1.61 CC(=O)C1=C(Br)C=CC=N1 80328 [0,2,0,0,0,0|2,0,0]=4 1080 B10R1.61 CC(=O)C1=C(C)N=CC=C1 C73307 [0,2,0,0,0,0|2,0,0]=4 1081 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 27067 [0,2,0,0,0,0|2,0,0]=4 1082 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Y14823 [0,2,0,0,0,0|2,0,0]=4 1083 B10R1.61 CC(=O)C1=C(Cl)C=NC=C1 N12959 [0,2,0,0,0,0|2,0,0]=4 1084 B10R1.61 CC(=O)C1=C(O)C=NC=C1 27646 [0,2,0,0,0,0|2,0,0]=4 1085 B10R1.61 CC(=O)C1=C(O)N=CC=C1 93481 [0,2,0,0,0,0|2,0,0]=4 1086 B10R1.61 CC(=O)C1=CC=CN=C1F F31395 [0,2,0,0,0,0|2,0,0]=4 1087 B10R1.61 CC(=O)C1=CNC=CC1=O C74936 [0,2,0,0,0,0|2,0,0]=4 1088 B10R1.61 CC(=O)C1=NC=CC=C1N 80156 [0,2,0,0,0,0|2,0,0]=4 1089 B10R1.61 CC(=O)C1=NC=CC=C1O 80210 [0,2,0,0,0,0|2,0,0]=4 1090 B10R1.61 CC(C)C1=C(N)C=CN=C1 C77054 [0,2,0,0,0,0|2,0,0]=4 1091 B10R1.61 CC(C)C1=C(O)C=CC=N1 72523 [0,2,0,0,0,0|2,0,0]=4 1092 B10R1.61 CC(C)C1=C(S)C=CC=C1 29274 [0,2,0,0,0,0|1,0,0]=3 1093 B10R1.61 CC(C)C1=CC=CN=C1Br C72641 [0,2,0,0,0,0|2,0,0]=4 1094 B10R1.61 CC(C)C1=CC=CN=C1N 60027 [0,2,0,0,0,0|2,0,0]=4 1095 B10R1.61 CC(C)C1=NC=CC=C1N C72482 [0,2,0,0,0,0|2,0,0]=4 1096 B10R1.61 CC1=C(C(=N)N)C=CC=C1 28690 [0,2,0,0,0,0|2,0,0]=4 1097 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52748 [0,2,0,0,0,0|1,0,0]=3 1098 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52749 [0,2,0,0,0,0|1,0,0]=3 1099 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 N10464 [0,2,0,0,0,0|1,0,0]=3 1100 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 Y10511 [0,2,0,0,0,0|1,0,0]=3 1101 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y11090 [0,2,0,0,0,0|2,0,0]=4 1102 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12107 [0,2,0,0,0,0|2,0,0]=4 1103 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12108 [0,2,0,0,0,0|2,0,0]=4 1104 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13392 [0,2,0,0,0,0|2,0,0]=4 1105 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13393 [0,2,0,0,0,0|2,0,0]=4 1106 B10R1.61 CC1=CC=CN=C1[C@H](C)O 21080 [0,2,0,0,0,0|2,0,0]=4 1107 B10R1.61 CC1=NC=CC=C1[C@H](C)N Y12491 [0,2,0,0,0,0|2,0,0]=4 1108 B10R1.61 CN(C)C1=C(Br)C=CC=N1 N11615 [0,2,0,0,0,0|2,0,0]=4 1109 B10R1.61 CN(C)C1=C(Br)C=NC=C1 F19675 [0,2,0,0,0,0|2,0,0]=4 1110 B10R1.61 C[C@H](Cl)C1=C(F)C=NC=C1 W10402 [0,2,0,0,0,0|2,0,0]=4 1111 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21516 [0,2,0,0,0,0|1,0,0]=3 1112 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21517 [0,2,0,0,0,0|1,0,0]=3 1113 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 Y10364 [0,2,0,0,0,0|1,0,0]=3 1114 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70080 [0,2,0,0,0,0|2,0,0]=4 1115 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 90519 [0,2,0,0,0,0|2,0,0]=4 1116 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 D81561 [0,2,0,0,0,0|2,0,0]=4 1117 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 20095 [0,2,0,0,0,0|1,0,0]=3 1118 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1344 [0,2,0,0,0,0|1,0,0]=3 1119 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1353 [0,2,0,0,0,0|1,0,0]=3 1120 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=N1 90516 [0,2,0,0,0,0|2,0,0]=4 1121 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52754 [0,2,0,0,0,0|1,0,0]=3 1122 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52755 [0,2,0,0,0,0|1,0,0]=3 1123 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 I10701 [0,2,0,0,0,0|1,0,0]=3 1124 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y10447 [0,2,0,0,0,0|1,0,0]=3 1125 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y11656 [0,2,0,0,0,0|1,0,0]=3 1126 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13070 [0,2,0,0,0,0|2,0,0]=4 1127 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13095 [0,2,0,0,0,0|2,0,0]=4 1128 B10R1.61 C[C@H](N)C1=C(N)C=CC=C1 C78195 [0,2,0,0,0,0|1,0,0]=3 1129 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 SC1257 [0,2,0,0,0,0|1,0,0]=3 1130 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1230 [0,2,0,0,0,0|1,0,0]=3 1131 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1233 [0,2,0,0,0,0|1,0,0]=3 1132 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=N1 P19330 [0,2,0,0,0,0|2,0,0]=4 1133 B10R1.61 C[C@H](O)C1=C(F)C=CC=N1 F13157 [0,2,0,0,0,0|2,0,0]=4 1134 B10R1.61 C[C@H](O)C1=C(O)C=CC=C1 W16007 [0,2,0,0,0,0|1,0,0]=3 1135 B10R1.61 C[C@H](O)C1=CC=CN=C1F F15555 [0,2,0,0,0,0|2,0,0]=4 1136 B10R1.61 N=C(N)C1=C(Cl)C=CC=C1 71514 [0,2,0,0,0,0|2,0,0]=4 1137 B10R1.61 NC1=C(C(F)F)C=CC=C1 72620 [0,2,0,0,0,0|2,0,0]=4 1138 B10R1.4 CC1=C(CCN)C=CC=C1 C78305 [0,2,0,0,0,0|1,0,0]=3 1139 B10R1.4 CC1=CC=CN=C1CCN C80033 [0,2,0,0,0,0|2,0,0]=4 1140 B10R1.4 CCNC1=C(N)C=NC=C1 W19029 [0,2,0,0,0,0|2,0,0]=4 1141 B10R1.4 CCNC1=C(O)C=CC=C1 I11473 [0,2,0,0,0,0|1,0,0]=3 1142 B10R1.4 CCNC1=CC=CN=C1N P19791 [0,2,0,0,0,0|2,0,0]=4 1143 B10R1.4 CCOC1=C(N)C=CN=C1 79299 [0,2,0,0,0,0|1,1,0]=4 1144 B10R1.4 CCOC1=CC=CN=C1F AC1769 [0,2,0,0,0,0|1,1,0]=4 1145 B10R1.4 CCOC1=CC=CNC1=O N13107 [0,2,0,0,0,0|1,1,0]=4 1146 B10R1.4 CCOC1=NC=CC=C1O 79061 [0,2,0,0,0,0|1,1,0]=4 1147 B10R1.4 CNCC1=CC=CN=C1C AC2519 [0,2,0,0,0,0|2,0,0]=4 1148 B10R1.4 COCC1=C(O)C=CC=C1 AC1453 [0,2,0,0,0,0|0,1,0]=3 1149 B10R1.4 N#CCC1=C(O)C=CC=C1 32266 [0,2,0,0,0,0|1,0,1]=4 1150 B10R1.4 NC1=C(CCO)C=CC=N1 70885 [0,2,0,0,0,0|2,0,0]=4 1151 B10R1.4 NCCC1=C(Br)C=CC=N1 P10594 [0,2,0,0,0,0|2,0,0]=4 1152 B10R1.4 NCCC1=C(O)C=CC=C1 83456 [0,2,0,0,0,0|1,0,0]=3 1153 B10R1.4 NNCC1=C(Br)C=CC=C1 37005 [0,2,0,0,0,0|2,0,0]=4 1154 B10R1.4 O=CCC1=C(Br)C=CC=C1 W16824 [0,2,0,0,0,0|1,0,1]=4 1155 B10R1.4 O=CCC1=C(F)C=CC=C1 W16825 [0,2,0,0,0,0|1,0,1]=4 1156 B10R1.4 OCCC1=C(F)C=CC=N1 P15943 [0,2,0,0,0,0|2,0,0]=4 1157 B10R1.4 [BH3-]C1=C(CNC)C=CC=C1 AC8598 [0,2,0,0,0,0|1,0,0]=3 1158 B10R1.17 C=C\C=C\C1=CC=CC=C1 54349 [0,2,0,0,0,0|1,0,1]=4 1159 B10R1.17 CCCCC1=CC=NC=C1 BL000376 [0,2,0,0,0,0|2,0,0]=4 1160 B10R1.17 CCCOC1=CC=CC=C1 C75927 [0,2,0,0,0,0|0,1,0]=3 1161 B10R1.17 CCNCC1=CC=CC=C1 D77748 [0,2,0,0,0,0|1,0,0]=3 1162 B10R1.17 CNCCC1=CC=CN=C1 AR1271 [0,2,0,0,0,0|2,0,0]=4 1163 B10R1.17 CNNCC1=CC=CC=C1 30192 [0,2,0,0,0,0|1,0,0]=3 1164 B10R1.17 CNNCC1=CC=CN=C1 30189 [0,2,0,0,0,0|2,0,0]=4 1165 B10R1.17 ICCCC1=CC=CC=C1 AC6098 [0,2,0,0,0,0|1,0,0]=3 1166 B10R1.17 N#CCCC1=CC=NC=C1 P16939 [0,2,0,0,0,0|2,0,0]=4 1167 B10R1.17 NCC#CC1=CC=CC=C1 AB10164 [0,2,0,0,0,0|1,0,0]=3 1168 B10R1.17 NCCCC1=CC=CN=C1 31799 [0,2,0,0,0,0|2,0,0]=4 1169 B10R1.17 NCCCC1=CC=NC=C1 S12068 [0,2,0,0,0,0|2,0,0]=4 1170 B10R1.17 NCCOC1=CC=NC=C1 F31099 [0,2,0,0,0,0|1,1,0]=4 1171 B10R1.17 NCCOC1=CC=NC=C1 Y10522 [0,2,0,0,0,0|1,1,0]=4 1172 B10R1.17 OCC#CC1=CC=NC=C1 31862 [0,2,0,0,0,0|2,0,0]=4 1173 B10R1.17 OCCOC1=CN=CC=C1 D86242 [0,2,0,0,0,0|1,1,0]=4 1174 B10R1.17 OC\C=C\C1=NC=CC=C1 AC7737 [0,2,0,0,0,0|2,0,0]=4 1175 B10R1.17 SCCCC1=CC=NC=C1 F18251 [0,2,0,0,0,0|2,0,0]=4 1176 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 50056 [0,2,0,0,0,0|1,0,0]=3 1177 B10R1.18 BrC(Br)=CC1=CC=CC=C1 31017 [0,2,0,0,0,0|1,0,1]=4 1178 B10R1.18 CC(=O)CC1=CN=CC=C1 28512 [0,2,0,0,0,0|2,0,0]=4 1179 B10R1.18 CC(=O)NC1=CC=CC=C1 D72485 [0,2,0,0,0,0|1,0,0]=3 1180 B10R1.18 C[C@H](N)CC1=NC=CC=C1 C80024 [0,2,0,0,0,0|2,0,0]=4 1181 B10R1.18 FC(F)SC1=CC=CC=C1 I11988 [0,2,0,0,0,0|0,0,0]=2 1182 B10R1.18 N=C(N)CC1=CC=CC=C1 F19863 [0,2,0,0,0,0|1,0,1]=4 1183 B10R1.18 NC(=S)CC1=CC=CC=C1 71029 [0,2,0,0,0,0|1,0,1]=4 1184 B10R1.20 C#CC1=CC=CN=C1OC C71657 [0,2,0,0,0,0|1,1,0]=4 1185 B10R1.20 C=CC1=C(CO)C=CC=C1 C74805 [0,2,0,0,0,0|1,0,1]=4 1186 B10R1.20 CNC1=C(C#N)C=CC=C1 C77665 [0,2,0,0,0,0|1,0,0]=3 1187 B10R1.20 CNC1=C(C=O)C=CC=C1 O10528 [0,2,0,0,0,0|1,0,0]=3 1188 B10R1.20 CNC1=C(C=O)C=CC=N1 FD10569 [0,2,0,0,0,0|2,0,0]=4 1189 B10R1.20 CNC1=C(CCl)C=CC=C1 D93985 [0,2,0,0,0,0|1,0,0]=3 1190 B10R1.20 COC1=C(C#N)C=CN=C1 W19146 [0,2,0,0,0,0|1,1,0]=4 1191 B10R1.20 COC1=C(C#N)C=NC=C1 64002 [0,2,0,0,0,0|1,1,0]=4 1192 B10R1.20 COC1=C(C=O)C=CN=C1 P17577 [0,2,0,0,0,0|1,1,0]=4 1193 B10R1.20 COC1=C(CBr)C=CC=N1 55281 [0,2,0,0,0,0|1,1,0]=4 1194 B10R1.20 COC1=C(CBr)C=NC=C1 79192 [0,2,0,0,0,0|1,1,0]=4 1195 B10R1.20 COC1=C(CN)C=CN=C1 C73553 [0,2,0,0,0,0|1,1,0]=4 1196 B10R1.20 COC1=C(CN)N=CC=C1 AC6429 [0,2,0,0,0,0|1,1,0]=4 1197 B10R1.20 COC1=C(CN)N=CC=C1 D94536 [0,2,0,0,0,0|1,1,0]=4 1198 B10R1.20 COC1=C(CO)N=CC=C1 F17518 [0,2,0,0,0,0|1,1,0]=4 1199 B10R1.20 COC1=CC=CN=C1C=O P10318 [0,2,0,0,0,0|1,1,0]=4 1200 B10R1.20 COC1=CC=CN=C1CBr O10505 [0,2,0,0,0,0|1,1,0]=4 1201 B10R1.20 COC1=CC=CN=C1CCl 60117 [0,2,0,0,0,0|1,1,0]=4 1202 B10R1.20 COC1=NC=CC=C1CN 37576 [0,2,0,0,0,0|1,1,0]=4 1203 B10R1.20 COC1=NC=CC=C1NN D84114 [0,2,0,0,0,0|1,1,0]=4 1204 B10R1.20 CSC1=C(C=O)C=CC=C1 T72851 [0,2,0,0,0,0|0,0,0]=2 1205 B10R1.20 N#CC1=C(CN)C=CC=C1 A51071 [0,2,0,0,0,0|2,0,0]=4 1206 B10R1.20 N#CC1=C(NN)C=CC=C1 C10139 [0,2,0,0,0,0|2,0,0]=4 1207 B10R1.20 NCC1=C(CN)C=CC=C1 20182 [0,2,0,0,0,0|2,0,0]=4 1208 B10R1.20 OCC1=C(CBr)C=CC=C1 O10024 [0,2,0,0,0,0|2,0,0]=4 1209 B10R1.20 OCC1=C(CF)C=CC=C1 W10520 [0,2,0,0,0,0|2,0,0]=4 1210 B10R1.245 BrCC1=C(Br)C=CC=C1Br 96245 [0,2,0,0,0,0|2,0,0]=4 1211 B10R1.245 C=CC1=C(Cl)C=CC=C1Cl CK2536 [0,2,0,0,0,0|1,0,1]=4 1212 B10R1.245 CC1=CC=CC(Cl)=C1CN Y12256 [0,2,0,0,0,0|2,0,0]=4 1213 B10R1.245 CC1=CC=CC(F)=C1CO W16613 [0,2,0,0,0,0|2,0,0]=4 1214 B10R1.245 CC1=CC=CC(O)=C1C=O 50507 [0,2,0,0,0,0|2,0,0]=4 1215 B10R1.245 CC1=CC=CC(O)=C1CO C74535 [0,2,0,0,0,0|2,0,0]=4 1216 B10R1.245 CCC1=C(Br)C=CC=C1Br 86463 [0,2,0,0,0,0|1,0,0]=3 1217 B10R1.245 CNC1=C(Br)C=CC=C1N C71480 [0,2,0,0,0,0|1,0,0]=3 1218 B10R1.245 CNC1=C(F)C=CC=C1F C77614 [0,2,0,0,0,0|1,0,0]=3 1219 B10R1.245 COC1=C(Br)C=CC=C1C F52555 [0,2,0,0,0,0|0,1,0]=3 1220 B10R1.245 COC1=C(Br)C=CN=C1C A11666 [0,2,0,0,0,0|1,1,0]=4 1221 B10R1.245 COC1=C(Br)C=NC=C1N I11194 [0,2,0,0,0,0|1,1,0]=4 1222 B10R1.245 COC1=C(Cl)C=CC=C1O 95656 [0,2,0,0,0,0|0,1,0]=3 1223 B10R1.245 COC1=C(Cl)C=CN=C1N F51098 [0,2,0,0,0,0|1,1,0]=4 1224 B10R1.245 COC1=C(N)C=CC=C1N A12416 [0,2,0,0,0,0|0,1,0]=3 1225 B10R1.245 COC1=C(N)C=CN=C1Cl F17572 [0,2,0,0,0,0|1,1,0]=4 1226 B10R1.245 NC1=CC=CC(Br)=C1C=O 90067 [0,2,0,0,0,0|2,0,0]=4 1227 B10R1.245 NC1=CC=CC(Br)=C1CO 90066 [0,2,0,0,0,0|2,0,0]=4 1228 B10R1.245 NC1=CC=CC(F)=C1C=O F15850 [0,2,0,0,0,0|2,0,0]=4 1229 B10R1.245 NC1=CC=CC(I)=C1C=O D70934 [0,2,0,0,0,0|2,0,0]=4 1230 B10R1.245 NCC1=C(Br)C=CC=C1Br O10035 [0,2,0,0,0,0|2,0,0]=4 1231 B10R1.245 NNC1=C(Br)C=CC=C1F O10042 [0,2,0,0,0,0|2,0,0]=4 1232 B10R1.245 NNC1=C(F)C=CC=C1F 35832 [0,2,0,0,0,0|2,0,0]=4 1233 B10R1.245 O=CC1=C(I)C=CC=C1Cl C75422 [0,2,0,0,0,0|2,0,0]=4 1234 B10R1.245 [C-]#[N+]C1=C(C)C=CC=C1C S10630 [0,2,0,0,0,0|1,0,1]=4 1235 B10R2.31 NC1=CC2=C(C=C1)CC2 67858 [0,1,0,1,0,0|1,0,0]=3 1236 B10R2.31 NC1=CC2=C(C=C1)CC2 D83029 [0,1,0,1,0,0|1,0,0]=3 1237 B10R2.320 O=C1CC2=C1C=CC=C2 67963 [0,1,0,1,0,0|1,0,0]=3 1238 B10R2.7 C1=CC2=C(C=C1)SN=N2 C74419 [0,1,0,1,0,0|1,0,0]=3 1239 B10R2.7 C1=CC2=C(C=N1)CCN2 86683 [0,1,0,1,0,0|2,0,0]=4 1240 B10R2.7 C1=CC2=C(C=N1)CNC2 83142 [0,1,0,1,0,0|2,0,0]=4 1241 B10R2.7 C1=CC2=C(C=N1)CNC2 SC3491 [0,1,0,1,0,0|2,0,0]=4 1242 B10R2.7 C1=CC2=C(C=N1)NCC2 A10607 [0,1,0,1,0,0|2,0,0]=4 1243 B10R2.7 C1=CC2=C(C=N1)NCC2 C73056 [0,1,0,1,0,0|2,0,0]=4 1244 B10R2.7 C1=CC2=C(C=N1)SC=N2 26297 [0,1,0,1,0,0|1,0,1]=4 1245 B10R2.7 C1=CC2=CON=C2C=C1 T70698 [0,1,0,1,0,0|0,1,1]=4 1246 B10R2.7 C1=CC2=N[Se]N=C2C=C1 T70699 [0,1,0,1,0,0|1,1,0]=4 1247 B10R2.7 C1=CN=C2CCNC2=C1 70854 [0,1,0,1,0,0|2,0,0]=4 1248 B10R2.7 C1=CN=C2CNCC2=C1 83068 [0,1,0,1,0,0|2,0,0]=4 1249 B10R2.7 C1=CN=C2CNCC2=C1 SC3341 [0,1,0,1,0,0|2,0,0]=4 1250 B6R1.2 CC1=CC=CN1 23756 [1,0,0,0,1,0|1,0,0]=3 1251 B6R1.2 CC1=CNC=C1 59365 [1,0,0,0,1,0|1,0,0]=3 1252 B6R1.2 CC1=CNN=C1 AT22811 [1,0,0,0,1,0|2,0,0]=4 1253 B6R1.2 CC1=COC=C1 W18310 [1,0,0,0,1,0|1,0,0]=3 1254 B6R1.2 CC1=NOC=C1 35767 [1,0,0,0,1,0|2,0,0]=4 1255 B6R1.2 NC1=CNC=C1 D82737 [1,0,0,0,1,0|2,0,0]=4 1256 B6R1.2 NC1=CSC=C1 D77326 [1,0,0,0,1,0|2,0,0]=4 1257 B6R1.2 SC1=CC=CS1 23061 [1,0,0,0,1,0|1,0,0]=3 1258 B6R1.2 SC1=CSC=C1 79297 [1,0,0,0,1,0|1,0,0]=3