0 B9R1.15 BrCC1=C(Br)C=CC=N1 N13045 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.15 C#CC1=C(Cl)C=NC=C1 79083 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.15 C#CC1=C(F)C=CC=N1 F21381 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.15 C#CC1=C(N)C=CN=C1 C71943 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.15 C#CC1=CC=CN=C1F C77200 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.15 C#CC1=CC=CN=C1O CS1686 [0,0,0,0,0,0|2,1,1]=4 6 B9R1.15 C=CC1=C(N)C=CC=C1 25265 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.15 C=CC1=CC=CN=C1Br 83953 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.15 C=CC1=CC=CN=C1C P11579 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.15 CC1=C(C#N)C=CC=N1 AB2931 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.15 CC1=C(C=O)C=CN=C1 AB10090 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.15 CC1=C(CBr)C=CC=N1 F16424 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.15 CC1=C(CCl)C=CC=N1 24248 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.15 CC1=C(CCl)C=NC=C1 C72783 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.15 CC1=C(CO)C=NC=C1 38669 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.15 CC1=C(NN)C=CN=C1 F15970 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.15 CC1=CC=CN=C1CN C72913 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.15 CC1=NC=CC=C1CN 72802 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.15 CC1=NC=CC=C1CN AB7634 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.15 CCC1=C(Br)C=CC=N1 P11641 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.15 CCC1=C(Br)C=CN=C1 38064 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.15 CCC1=C(F)C=CC=C1 F20938 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.15 CCC1=C(O)C=CC=N1 71246 [0,0,0,0,0,0|2,1,0]=3 23 B9R1.15 CCC1=CC=CN=C1Br D80252 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.15 CCC1=CC=CN=C1N 55791 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.15 CCC1=CC=NN=C1Cl S11385 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.15 CCC1=CC=NNC1=O S11452 [0,0,0,0,0,0|3,1,0]=4 27 B9R1.15 CCC1=NC=CN=C1N RB3385 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.15 CCC1=NC=CNC1=O S12194 [0,0,0,0,0,0|3,1,0]=4 29 B9R1.15 CNC1=C(Br)C=NC=N1 27470 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.15 CNC1=C(C)C=CN=C1 C12398 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.15 CNC1=C(I)C=NC=C1 D83398 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.15 CNC1=C(N)C=CN=C1 F51691 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.15 CNC1=C(N)C=NC=C1 C73540 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.15 CNC1=CC=CN=C1N 94808 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.15 CNC1=NC=CC=C1N 72351 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.15 CNC1=NC=CN=C1N 25161 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.15 COC1=C(Br)C=CN=C1 26564 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.15 COC1=C(Br)C=NC=N1 H10144 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.15 COC1=C(I)C=CN=C1 D82954 [0,0,0,0,0,0|2,0,0]=2 40 B9R1.15 COC1=C(I)C=NC=N1 C74109 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.15 COC1=C(N)C=CN=C1 35474 [0,0,0,0,0,0|2,0,0]=2 42 B9R1.15 COC1=C(O)C=NC=C1 79066 [0,0,0,0,0,0|1,1,0]=2 43 B9R1.15 COC1=CNC=NC1=O H10327 [0,0,0,0,0,0|2,1,0]=3 44 B9R1.15 COC1=NC=CC=C1C C73664 [0,0,0,0,0,0|2,0,0]=2 45 B9R1.15 COC1=NC=CN=C1Br 27717 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.15 COC1=NC=NC=C1N 24306 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.15 COC1=NC=NC=C1N 36696 [0,0,0,0,0,0|3,0,0]=3 48 B9R1.15 CSC1=C(F)N=CC=C1 F50785 [0,0,0,0,0,0|2,1,0]=3 49 B9R1.15 CSC1=C(N)C=CN=C1 W16024 [0,0,0,0,0,0|2,1,0]=3 50 B9R1.15 ClCC1=C(Br)C=CC=N1 W15864 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.15 ClCC1=C(Br)C=NC=C1 32531 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.15 ClCC1=C(Cl)C=CC=N1 86866 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.15 ClCC1=C(Cl)C=CC=N1 C71965 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.15 FC1=C(CBr)C=CC=N1 72213 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.15 FC1=C(CCl)C=CN=C1 72889 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.15 FC1=CC=CN=C1CBr 38126 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.15 FC1=CC=CN=C1CCl AC1446 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.15 N#CC1=C(Br)C=CN=C1 55794 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.15 N#CC1=C(I)C=CC=N1 CL0132 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.15 N#CC1=CNC=CC1=O 88910 [0,0,0,0,0,0|3,1,0]=4 61 B9R1.15 NC1=C(CO)C=CN=C1 F13531 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.15 NC1=C(CO)C=NC=C1 28348 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.15 NC1=CC=CN=C1C=O 80155 [0,0,0,0,0,0|4,0,0]=4 64 B9R1.15 NC1=CC=CN=C1CO H10562 [0,0,0,0,0,0|4,0,0]=4 65 B9R1.15 NCC1=C(Br)C=CC=N1 N13373 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.15 NCC1=C(Br)C=CC=N1 Y13366 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.15 NCC1=C(Br)C=CN=C1 F30244 [0,0,0,0,0,0|4,0,0]=4 68 B9R1.15 NCC1=C(Br)C=NC=C1 O10077 [0,0,0,0,0,0|4,0,0]=4 69 B9R1.15 NCC1=C(Cl)C=CC=N1 20194 [0,0,0,0,0,0|4,0,0]=4 70 B9R1.15 NCC1=C(Cl)C=CN=C1 73185 [0,0,0,0,0,0|4,0,0]=4 71 B9R1.15 NCC1=C(Cl)C=NC=C1 D79765 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.15 NCC1=C(Cl)C=NC=C1 F50132 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.15 NCC1=C(F)C=CC=N1 37501 [0,0,0,0,0,0|4,0,0]=4 74 B9R1.15 NCC1=C(F)C=CC=N1 71993 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.15 NCC1=C(F)C=CC=N1 P10857 [0,0,0,0,0,0|4,0,0]=4 76 B9R1.15 NCC1=C(F)C=NC=C1 26837 [0,0,0,0,0,0|4,0,0]=4 77 B9R1.15 NCC1=C(F)C=NC=C1 78901 [0,0,0,0,0,0|4,0,0]=4 78 B9R1.15 NCC1=C(I)C=CC=C1 C75019 [0,0,0,0,0,0|3,0,0]=3 79 B9R1.15 NCC1=CC=CN=C1Br D82416 [0,0,0,0,0,0|4,0,0]=4 80 B9R1.15 NCC1=CC=CN=C1Cl 51113 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.15 NCC1=CC=CN=C1N 89358 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.15 NCC1=CC=CN=C1O 55767 [0,0,0,0,0,0|3,1,0]=4 83 B9R1.15 NCC1=NC=CC=C1N AC4283 [0,0,0,0,0,0|4,0,0]=4 84 B9R1.15 NNC1=C(Br)C=NC=C1 C13755 [0,0,0,0,0,0|4,0,0]=4 85 B9R1.15 NNC1=C(F)C=CC=N1 F20903 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.15 NNC1=C(I)C=CC=C1 C75827 [0,0,0,0,0,0|3,0,0]=3 87 B9R1.15 O=C1NC=CC=C1CO P16012 [0,0,0,0,0,0|3,1,0]=4 88 B9R1.15 O=CC1=C(Br)C=CN=C1 P16584 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.15 O=CC1=C(Cl)C=CC=C1 D77644 [0,0,0,0,0,0|3,0,0]=3 90 B9R1.15 O=CC1=C(O)C=CN=C1 P10968 [0,0,0,0,0,0|3,1,0]=4 91 B9R1.15 O=CC1=C(O)C=NC=C1 25615 [0,0,0,0,0,0|3,1,0]=4 92 B9R1.15 OCC1=C(Br)C=CN=C1 71972 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.15 OCC1=C(F)C=CN=C1 P15839 [0,0,0,0,0,0|4,0,0]=4 94 B9R1.15 OCC1=C(O)C=NC=C1 D84251 [0,0,0,0,0,0|3,1,0]=4 95 B8R1.2 CCC1=NC=NC=C1 F17281 [1,0,0,0,0,0|3,0,0]=4 96 B8R1.2 CNC1=CN=CN=C1 Y10181 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.2 CNC1=CN=NC=C1 A10648 [1,0,0,0,0,0|3,0,0]=4 98 B8R1.2 CNC1=NC=NC=C1 W10133 [1,0,0,0,0,0|3,0,0]=4 99 B8R1.2 COC1=NC=NC=C1 T72699 [1,0,0,0,0,0|2,0,0]=3 100 B8R1.2 N#CC1=NC=CC=C1 D77869 [1,0,0,0,0,0|3,0,0]=4 101 B8R1.2 NCC1=CC=CC=C1 RB3068 [1,0,0,0,0,0|2,0,0]=3 102 B8R1.2 NCC1=CC=NC=C1 35876 [1,0,0,0,0,0|3,0,0]=4 103 B8R1.2 NNC1=CC=CN=C1 S12141 [1,0,0,0,0,0|3,0,0]=4 104 B8R1.2 SCC1=CC=NC=C1 F18336 [1,0,0,0,0,0|3,0,0]=4 105 B8R1.2 SCC1=CN=CC=C1 F18343 [1,0,0,0,0,0|3,0,0]=4 106 B8R1.2 SCC1=NC=CC=C1 Y10072 [1,0,0,0,0,0|3,0,0]=4 107 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [1,0,0,0,0,0|1,0,1]=3 108 B8R1.5 BrC1=C(I)C=NC=C1 C76998 [1,0,0,0,0,0|3,0,0]=4 109 B8R1.5 CC1=C(Cl)C=NC=N1 F17326 [1,0,0,0,0,0|3,0,0]=4 110 B8R1.5 CC1=C(F)C=CN=C1 F19730 [1,0,0,0,0,0|2,0,0]=3 111 B8R1.5 CC1=C(I)C=CC=N1 F19761 [1,0,0,0,0,0|2,0,0]=3 112 B8R1.5 CC1=C(I)C=NC=C1 C74973 [1,0,0,0,0,0|2,0,0]=3 113 B8R1.5 CC1=C(I)C=NC=N1 27820 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.5 CC1=CC=NN=C1Br N13316 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.5 CC1=CC=NN=C1Cl 38744 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.5 CC1=CN=CN=C1Br 27819 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.5 CC1=CN=CN=C1O 25833 [1,0,0,0,0,0|2,1,0]=4 118 B8R1.5 CC1=NC=CN=C1Br 26975 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.5 CC1=NC=NC=C1N 25415 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.5 ClC1=CC=CN=C1I 68801 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.5 NC1=C(O)C=CN=N1 D83804 [1,0,0,0,0,0|3,0,0]=4 122 B8R1.5 NC1=C(S)C=CN=C1 AT18151 [1,0,0,0,0,0|2,0,0]=3 123 B8R1.5 NC1=CC=CN=C1I RB1070 [1,0,0,0,0,0|3,0,0]=4 124 B8R1.5 NC1=[N+]([O-])C=CC=C1 T70263 [1,0,0,0,0,0|2,0,1]=4 125 B8R1.5 O=C1NC=NC=C1O 25860 [1,0,0,0,0,0|2,1,0]=4 126 B8R1.5 O=C1NC=NC=C1O C73082 [1,0,0,0,0,0|2,1,0]=4 127 B8R1.5 OC1=C(Cl)C=NN=C1 F10592 [1,0,0,0,0,0|3,0,0]=4 128 B8R1.5 OC1=C(I)C=CC=N1 CS1389 [1,0,0,0,0,0|2,0,0]=3 129 B8R1.5 OC1=C(I)C=CN=C1 25190 [1,0,0,0,0,0|2,0,0]=3 130 B8R1.5 OC1=C(I)C=NC=N1 25919 [1,0,0,0,0,0|3,0,0]=4 131 B8R1.5 OC1=C(O)C=NC=C1 C14003 [1,0,0,0,0,0|1,1,0]=3 132 B8R1.5 OC1=NC=CN=C1Br A11981 [1,0,0,0,0,0|3,0,0]=4 133 B8R1.5 OC1=NC=CN=C1O C74124 [1,0,0,0,0,0|2,1,0]=4 134 B8R1.5 SC1=C(Br)C=NC=C1 C12894 [1,0,0,0,0,0|2,0,0]=3 135 B10R1.2 BrCC1=CC=CC(I)=C1Br CL8690 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.2 CC1=C(Br)C=CC=C1CBr 54940 [0,1,0,0,0,0|3,0,0]=4 137 B10R1.2 CC1=C(Br)C=CC=C1CN 98269 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.2 CC1=C(C#N)C=CC=C1N 51688 [0,1,0,0,0,0|3,0,0]=4 139 B10R1.2 CC1=C(I)C=CC=C1CBr CL9688 [0,1,0,0,0,0|3,0,0]=4 140 B10R1.2 CC1=C(I)C=CC=C1CO CL9687 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.2 CC1=C(O)C=CC=C1C#N 26569 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.2 CC1=CC=CC(C#N)=C1O F20100 [0,1,0,0,0,0|2,1,0]=4 143 B10R1.2 CC1=CC=CC(CN)=C1F CL9718 [0,1,0,0,0,0|3,0,0]=4 144 B10R1.2 CC1=CC=CC(CN)=C1O Y10488 [0,1,0,0,0,0|2,1,0]=4 145 B10R1.2 CC1=CC=CC(CO)=C1Br 74396 [0,1,0,0,0,0|3,0,0]=4 146 B10R1.2 CC1=CC=CC(CO)=C1O F20046 [0,1,0,0,0,0|2,1,0]=4 147 B10R1.2 CC1=CC=CC(NN)=C1C A11966 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.2 CCC1=CC=CC(O)=C1O C77203 [0,1,0,0,0,0|1,1,0]=3 149 B10R1.2 CCC1=CC=NC(N)=C1Br F50948 [0,1,0,0,0,0|3,0,0]=4 150 B10R1.2 CNC1=C(N)C(Br)=NC=C1 79198 [0,1,0,0,0,0|3,0,0]=4 151 B10R1.2 CNC1=CC=CC(Br)=C1N 79197 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.2 COC1=C(Br)C(N)=CC=N1 38420 [0,1,0,0,0,0|2,0,0]=3 153 B10R1.2 COC1=C(C)C(Br)=NC=C1 D83215 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.2 COC1=C(C)C(Cl)=NC=C1 D84336 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.2 COC1=C(C)C(Cl)=NC=N1 H11469 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.2 COC1=C(C)C(N)=CN=C1 N13054 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.2 COC1=C(Cl)C(Cl)=CC=N1 D83251 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.2 COC1=C(Cl)C(Cl)=NC=C1 P17363 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.2 COC1=C(Cl)C(Cl)=NC=N1 P18609 [0,1,0,0,0,0|3,0,0]=4 160 B10R1.2 COC1=C(Cl)C(Cl)=NN=C1 C16141 [0,1,0,0,0,0|3,0,0]=4 161 B10R1.2 COC1=C(Cl)C(N)=CC=C1 C12073 [0,1,0,0,0,0|1,0,0]=2 162 B10R1.2 COC1=C(F)C(Br)=NC=C1 H11794 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.2 COC1=C(I)C(N)=CC=C1 34421 [0,1,0,0,0,0|1,0,0]=2 164 B10R1.2 COC1=C(N)C(N)=CC=C1 35991 [0,1,0,0,0,0|1,0,0]=2 165 B10R1.2 COC1=C(N)C(N)=CC=C1 Y10418 [0,1,0,0,0,0|1,0,0]=2 166 B10R1.2 COC1=C(O)C(N)=CC=C1 O10656 [0,1,0,0,0,0|0,1,0]=2 167 B10R1.2 COC1=CC=CC(Br)=C1Br CL8946 [0,1,0,0,0,0|1,0,0]=2 168 B10R1.2 COC1=CC=CC(Cl)=C1Br F20980 [0,1,0,0,0,0|1,0,0]=2 169 B10R1.2 COC1=CC=CC(Cl)=C1O O10746 [0,1,0,0,0,0|0,1,0]=2 170 B10R1.2 COC1=CC=CC(F)=C1I 34512 [0,1,0,0,0,0|1,0,0]=2 171 B10R1.2 COC1=CC=CC(I)=C1N S10846 [0,1,0,0,0,0|1,0,0]=2 172 B10R1.2 COC1=CC=CC(I)=C1O 84030 [0,1,0,0,0,0|0,1,0]=2 173 B10R1.2 COC1=CN=CC(Br)=C1C CS1899 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.2 COC1=NC=CC(Br)=C1C C71404 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.2 COC1=NC=CC(C)=C1N 34938 [0,1,0,0,0,0|2,0,0]=3 176 B10R1.2 COC1=NC=CC(I)=C1C 96428 [0,1,0,0,0,0|2,0,0]=3 177 B10R1.2 COC1=NC=CC(I)=C1Cl 92374 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.2 COC1=NC=CC(N)=C1N 24240 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.2 CSC1=CC=CC(Cl)=C1C F14681 [0,1,0,0,0,0|1,1,0]=3 180 B10R1.2 N#CC1=C(N)C(N)=CC=C1 CL9178 [0,1,0,0,0,0|3,0,0]=4 181 B10R1.2 N#CC1=CC=CC(Cl)=C1Br AC1543 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.2 N#CC1=CC=CC(F)=C1I 35314 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.2 N#CC1=CC=CC(F)=C1O 75820 [0,1,0,0,0,0|2,1,0]=4 184 B10R1.2 N#CC1=CC=CC(I)=C1N C13344 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.2 N#CC1=CC=CC(N)=C1Br C14256 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.2 N#CC1=CC=CC(N)=C1Cl 98212 [0,1,0,0,0,0|3,0,0]=4 187 B10R1.2 N#CC1=CC=CC(O)=C1Cl C10157 [0,1,0,0,0,0|3,0,0]=4 188 B10R1.2 N#CC1=CC=CC(O)=C1F 95628 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.2 NC1=C(Br)C=CC=C1C=O 36406 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.2 NC1=C(C=O)C=CC=C1O D94436 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.2 NC1=C(F)C=CC=C1CO W11419 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.2 NCC1=CC=CC(Br)=C1F N13145 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.2 NCC1=CC=CC(Br)=C1F O10075 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.2 NCC1=CC=CC(F)=C1Br C71791 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.2 NCC1=CC=CC(I)=C1Br C72076 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.2 NCC1=CC=CC(O)=C1O S10740 [0,1,0,0,0,0|2,1,0]=4 197 B10R1.2 O=CC1=CC=CC(F)=C1I 34605 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.2 OCC1=CC=CC(F)=C1Br 35519 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.2 OCC1=CC=CC(F)=C1Cl CL8694 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.2 OCC1=CC=CC(F)=C1I 79245 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.2 OCC1=CC=CC(I)=C1Br CL8691 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.4 CC1=C(CCN)C=CC=C1 C78305 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.4 CC1=CC=CN=C1CCN C80033 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.4 CCNC1=C(N)C=NC=C1 W19029 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.4 CCNC1=C(O)C=CC=C1 I11473 [0,1,0,0,0,0|1,1,0]=3 206 B10R1.4 CCNC1=CC=CN=C1N P19791 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.4 CCOC1=C(N)C=CN=C1 79299 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.4 CCOC1=CC=CN=C1F AC1769 [0,1,0,0,0,0|2,0,0]=3 209 B10R1.4 CCOC1=CC=CNC1=O N13107 [0,1,0,0,0,0|1,1,0]=3 210 B10R1.4 CCOC1=NC=CC=C1O 79061 [0,1,0,0,0,0|1,1,0]=3 211 B10R1.4 CCOC1=NC=CN=C1N 25986 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.4 CCOC1=NC=NC=C1N C75583 [0,1,0,0,0,0|3,0,0]=4 213 B10R1.4 CNCC1=CC=CN=C1C AC2519 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.4 COCC1=C(O)C=CC=C1 AC1453 [0,1,0,0,0,0|0,1,0]=2 215 B10R1.4 N#CCC1=C(O)C=CC=C1 32266 [0,1,0,0,0,0|1,1,1]=4 216 B10R1.4 NC1=C(CCO)C=CC=N1 70885 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.4 NCCC1=C(Br)C=CC=N1 P10594 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.4 NCCC1=C(O)C=CC=C1 83456 [0,1,0,0,0,0|1,1,0]=3 219 B10R1.4 NNCC1=C(Br)C=CC=C1 37005 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.4 O=CCC1=C(Br)C=CC=C1 W16824 [0,1,0,0,0,0|2,0,1]=4 221 B10R1.4 O=CCC1=C(F)C=CC=C1 W16825 [0,1,0,0,0,0|2,0,1]=4 222 B10R1.4 OCCC1=C(F)C=CC=N1 P15943 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.4 [BH3-]C1=C(CNC)C=CC=C1 AC8598 [0,1,0,0,0,0|2,0,0]=3 224 B10R1.20 C#CC1=CC=CN=C1OC C71657 [0,1,0,0,0,0|2,0,0]=3 225 B10R1.20 C=CC1=C(CO)C=CC=C1 C74805 [0,1,0,0,0,0|1,1,1]=4 226 B10R1.20 CNC1=C(C#N)C=CC=C1 C77665 [0,1,0,0,0,0|2,0,0]=3 227 B10R1.20 CNC1=C(C=O)C=CC=C1 O10528 [0,1,0,0,0,0|1,1,0]=3 228 B10R1.20 CNC1=C(C=O)C=CC=N1 FD10569 [0,1,0,0,0,0|2,1,0]=4 229 B10R1.20 CNC1=C(CCl)C=CC=C1 D93985 [0,1,0,0,0,0|2,0,0]=3 230 B10R1.20 COC1=C(C#N)C=CN=C1 W19146 [0,1,0,0,0,0|2,0,0]=3 231 B10R1.20 COC1=C(C#N)C=NC=C1 64002 [0,1,0,0,0,0|2,0,0]=3 232 B10R1.20 COC1=C(C#N)N=CN=C1 81453 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.20 COC1=C(C=O)C=CN=C1 P17577 [0,1,0,0,0,0|1,1,0]=3 234 B10R1.20 COC1=C(CBr)C=CC=N1 55281 [0,1,0,0,0,0|2,0,0]=3 235 B10R1.20 COC1=C(CBr)C=NC=C1 79192 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.20 COC1=C(CN)C=CN=C1 C73553 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.20 COC1=C(CN)N=CC=C1 AC6429 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.20 COC1=C(CN)N=CC=C1 D94536 [0,1,0,0,0,0|2,0,0]=3 239 B10R1.20 COC1=C(CO)N=CC=C1 F17518 [0,1,0,0,0,0|1,1,0]=3 240 B10R1.20 COC1=C(NN)N=CN=C1 H10178 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.20 COC1=CC=CN=C1C=O P10318 [0,1,0,0,0,0|1,1,0]=3 242 B10R1.20 COC1=CC=CN=C1CBr O10505 [0,1,0,0,0,0|2,0,0]=3 243 B10R1.20 COC1=CC=CN=C1CCl 60117 [0,1,0,0,0,0|2,0,0]=3 244 B10R1.20 COC1=CN=CN=C1OC H10157 [0,1,0,0,0,0|2,1,0]=4 245 B10R1.20 COC1=NC=CC=C1CN 37576 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.20 COC1=NC=CC=C1NN D84114 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.20 COC1=NC=CN=C1NN C74005 [0,1,0,0,0,0|3,0,0]=4 248 B10R1.20 COC1=NC=CN=C1OC 21131 [0,1,0,0,0,0|2,1,0]=4 249 B10R1.20 CSC1=C(C=O)C=CC=C1 T72851 [0,1,0,0,0,0|0,2,0]=3 250 B10R1.20 N#CC1=C(CN)C=CC=C1 A51071 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.20 N#CC1=C(NN)C=CC=C1 C10139 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.20 NCC1=C(CN)C=CC=C1 20182 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.20 OCC1=C(CBr)C=CC=C1 O10024 [0,1,0,0,0,0|2,1,0]=4 254 B10R1.20 OCC1=C(CF)C=CC=C1 W10520 [0,1,0,0,0,0|2,1,0]=4 255 B10R1.25 C#CC1=C(Cl)C=C(N)C=C1 C76583 [0,1,0,0,0,0|2,0,1]=4 256 B10R1.25 C#CC1=C(F)C=C(Cl)C=C1 D94601 [0,1,0,0,0,0|2,0,1]=4 257 B10R1.25 C#CC1=C(F)C=C(N)C=C1 C14426 [0,1,0,0,0,0|2,0,1]=4 258 B10R1.25 C=CC1=C(Br)C=C(F)C=C1 S10822 [0,1,0,0,0,0|2,0,1]=4 259 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 93716 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.25 CC1=C(CCl)C=CC(Br)=C1 AB10222 [0,1,0,0,0,0|3,0,0]=4 261 B10R1.25 CC1=C(CF)C=CC(Br)=C1 C73525 [0,1,0,0,0,0|3,0,0]=4 262 B10R1.25 CC1=C(CN)C=CC(Br)=C1 C71550 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.25 CC1=C(CO)C=CC(N)=C1 F19834 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.25 CC1=CC(Br)=C(CN)C=C1 W19042 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.25 CC1=CC(C)=C(CBr)C=C1 24686 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 N12896 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.25 CC1=CC(F)=C(NN)C=C1 D82866 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.25 CC1=CC(F)=C(NN)C=C1 W17784 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.25 CCC1=C(Br)C=C(N)C=C1 27953 [0,1,0,0,0,0|2,0,0]=3 270 B10R1.25 CCC1=C(Br)C=C(O)C=C1 Y11628 [0,1,0,0,0,0|2,0,0]=3 271 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 W17033 [0,1,0,0,0,0|2,0,0]=3 272 B10R1.25 CCC1=C(F)C=C(Br)C=C1 D82415 [0,1,0,0,0,0|2,0,0]=3 273 B10R1.25 CCC1=C(F)C=C(O)C=C1 C11362 [0,1,0,0,0,0|2,0,0]=3 274 B10R1.25 CCC1=C(N)C=C(Br)C=C1 C72839 [0,1,0,0,0,0|2,0,0]=3 275 B10R1.25 CCC1=C(N)C=C(Cl)C=C1 C74962 [0,1,0,0,0,0|2,0,0]=3 276 B10R1.25 CCC1=NC=C(Br)C=C1N 38360 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.25 CCN1C=CC(Br)=CC1=O P13647 [0,1,0,0,0,0|2,1,0]=4 278 B10R1.25 CNC1=C(Br)C=C(F)C=C1 71883 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.25 CNC1=C(C)C=C(O)C=C1 C16321 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.25 CNC1=NC=C(Br)C=C1N C77013 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.25 COC1=C(Br)C=C(Cl)N=C1 S10226 [0,1,0,0,0,0|2,0,0]=3 282 B10R1.25 COC1=C(C)C=C(O)C=C1 95659 [0,1,0,0,0,0|1,0,0]=2 283 B10R1.25 COC1=C(C)N=C(Br)C=C1 W15448 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.25 COC1=C(C)N=C(C)N=C1 O11463 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.25 COC1=C(C)N=C(Cl)N=C1 72823 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.25 COC1=C(C)N=C(N)N=C1 FD10682 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.25 COC1=C(Cl)C=C(C)C=N1 C71882 [0,1,0,0,0,0|2,0,0]=3 288 B10R1.25 COC1=C(Cl)C=C(I)C=C1 F15482 [0,1,0,0,0,0|1,0,0]=2 289 B10R1.25 COC1=C(Cl)C=C(N)N=C1 37736 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.25 COC1=C(Cl)N=C(I)C=C1 72074 [0,1,0,0,0,0|2,0,0]=3 291 B10R1.25 COC1=C(F)C=C(N)C=N1 27254 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.25 COC1=C(F)N=C(Br)C=C1 CS1206 [0,1,0,0,0,0|2,0,0]=3 293 B10R1.25 COC1=C(I)C=C(Br)C=N1 C75707 [0,1,0,0,0,0|2,0,0]=3 294 B10R1.25 COC1=C(I)C=C(Cl)N=C1 S10146 [0,1,0,0,0,0|2,0,0]=3 295 B10R1.25 COC1=C(I)C=C(Cl)N=N1 S11536 [0,1,0,0,0,0|3,0,0]=4 296 B10R1.25 COC1=C(N)N=C(C)C=C1 84162 [0,1,0,0,0,0|2,0,0]=3 297 B10R1.25 COC1=C(N)N=C(Cl)C=N1 C91504 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.25 COC1=C(N)N=C(F)C=C1 D70935 [0,1,0,0,0,0|2,0,0]=3 299 B10R1.25 COC1=CC=C(Br)N=C1Br 79976 [0,1,0,0,0,0|2,0,0]=3 300 B10R1.25 COC1=CC=C(C)N=C1Cl C73850 [0,1,0,0,0,0|2,0,0]=3 301 B10R1.25 COC1=CC=C(C)N=C1I F30133 [0,1,0,0,0,0|2,0,0]=3 302 B10R1.25 COC1=CC=C(Cl)N=C1Br C72025 [0,1,0,0,0,0|2,0,0]=3 303 B10R1.25 COC1=CC=C(Cl)N=C1Cl 81824 [0,1,0,0,0,0|2,0,0]=3 304 B10R1.25 COC1=CC=C(Cl)N=C1I 82334 [0,1,0,0,0,0|2,0,0]=3 305 B10R1.25 COC1=CC=C(N)N=C1Cl F19661 [0,1,0,0,0,0|2,0,0]=3 306 B10R1.25 COC1=CN=C(Br)C=C1Cl F16734 [0,1,0,0,0,0|2,0,0]=3 307 B10R1.25 COC1=CN=C(Br)C=C1N AC1554 [0,1,0,0,0,0|2,0,0]=3 308 B10R1.25 COC1=CN=C(Br)C=C1O AT23971 [0,1,0,0,0,0|1,1,0]=3 309 B10R1.25 COC1=CN=C(C)N=C1Cl F30537 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.25 COC1=CN=C(Cl)C=C1N C71879 [0,1,0,0,0,0|2,0,0]=3 311 B10R1.25 COC1=CN=C(N)NC1=O 28170 [0,1,0,0,0,0|2,1,0]=4 312 B10R1.25 COC1=CNC(=O)C=C1Br W15670 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.25 COC1=NC=C(Cl)C=C1N E70381 [0,1,0,0,0,0|2,0,0]=3 314 B10R1.25 COC1=NC=C(Cl)N=C1Cl W12644 [0,1,0,0,0,0|3,0,0]=4 315 B10R1.25 COC1=NC=C(F)C=C1C C76918 [0,1,0,0,0,0|2,0,0]=3 316 B10R1.25 COC1=NC=C(F)C=C1N C71761 [0,1,0,0,0,0|2,0,0]=3 317 B10R1.25 COC1=NC=C(F)C=C1O S10276 [0,1,0,0,0,0|1,1,0]=3 318 B10R1.25 COC1=NN=C(Cl)C=C1C C77016 [0,1,0,0,0,0|3,0,0]=4 319 B10R1.25 COC1=NN=C(Cl)C=C1N P10109 [0,1,0,0,0,0|3,0,0]=4 320 B10R1.25 CSC1=C(Br)C=C(F)C=C1 69928 [0,1,0,0,0,0|1,1,0]=3 321 B10R1.25 CSC1=C(Cl)C=C(Br)C=C1 Y11168 [0,1,0,0,0,0|1,1,0]=3 322 B10R1.25 CSC1=C(F)C=C(N)C=C1 94984 [0,1,0,0,0,0|1,1,0]=3 323 B10R1.25 CSC1=C(F)N=C(F)C=C1 D79861 [0,1,0,0,0,0|2,1,0]=4 324 B10R1.25 FC1=C(CBr)C=CC(I)=C1 55991 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.25 FC1=CC(I)=C(CBr)C=C1 56051 [0,1,0,0,0,0|3,0,0]=4 326 B10R1.25 N#CC1=C(Br)C=C(O)C=C1 AC6875 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.25 N#CC1=C(Cl)C=C(I)C=C1 95932 [0,1,0,0,0,0|3,0,0]=4 328 B10R1.25 N#CC1=C(O)C=C(N)C=C1 S10894 [0,1,0,0,0,0|2,1,0]=4 329 B10R1.25 N#CC1=C(O)C=C(O)C=C1 C76016 [0,1,0,0,0,0|2,1,0]=4 330 B10R1.25 NC1=C(C=O)C=CC(F)=C1 34566 [0,1,0,0,0,0|3,0,0]=4 331 B10R1.25 NC1=CC(Br)=C(C=O)C=C1 C16178 [0,1,0,0,0,0|3,0,0]=4 332 B10R1.25 NC1=CC(F)=C(C=O)C=C1 AC6806 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.25 NC1=CC(N)=C(C=O)C=C1 C10737 [0,1,0,0,0,0|3,0,0]=4 334 B10R1.25 NCC1=C(Br)C=C(Cl)C=C1 C73878 [0,1,0,0,0,0|3,0,0]=4 335 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11612 [0,1,0,0,0,0|3,0,0]=4 336 B10R1.25 NCC1=C(Cl)C=C(Br)C=C1 Y12485 [0,1,0,0,0,0|3,0,0]=4 337 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14725 [0,1,0,0,0,0|3,0,0]=4 338 B10R1.25 NCC1=C(O)C=C(Br)C=C1 N13143 [0,1,0,0,0,0|2,1,0]=4 339 B10R1.25 NNC1=C(Cl)C=C(Br)C=C1 D83061 [0,1,0,0,0,0|3,0,0]=4 340 B10R1.25 NNC1=C(Cl)C=C(I)C=C1 27583 [0,1,0,0,0,0|3,0,0]=4 341 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 67919 [0,1,0,0,0,0|3,0,0]=4 342 B10R1.25 O=CC1=C(I)C=C(F)C=C1 CL9496 [0,1,0,0,0,0|3,0,0]=4 343 B10R1.25 OCC1=C(Br)C=C(O)C=C1 98273 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 CL9122 [0,1,0,0,0,0|3,0,0]=4 345 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 95677 [0,1,0,0,0,0|3,0,0]=4 346 B10R1.25 OCC1=C(O)C=C(Br)C=C1 35526 [0,1,0,0,0,0|2,1,0]=4 347 B10R1.30 C#CC1=C(F)C=CC(Br)=C1 D95606 [0,1,0,0,0,0|2,0,1]=4 348 B10R1.30 C#CC1=C(N)C=CC(C)=C1 C74053 [0,1,0,0,0,0|2,0,1]=4 349 B10R1.30 CC1=C(C#N)C=C(I)C=C1 C75444 [0,1,0,0,0,0|3,0,0]=4 350 B10R1.30 CC1=C(C=O)C=C(Cl)C=C1 CK2094 [0,1,0,0,0,0|3,0,0]=4 351 B10R1.30 CC1=C(C=O)C=C(I)C=C1 F20710 [0,1,0,0,0,0|3,0,0]=4 352 B10R1.30 CC1=C(CCl)C=C(Cl)C=C1 AT13353 [0,1,0,0,0,0|3,0,0]=4 353 B10R1.30 CC1=C(CO)C=C(Cl)C=C1 70915 [0,1,0,0,0,0|3,0,0]=4 354 B10R1.30 CC1=C(CO)C=C(I)C=C1 F20542 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.30 CC1=C(NN)C=C(Br)C=C1 O10123 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.30 CC1=C(NN)C=C(Cl)C=C1 C75556 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.30 CC1=CC(C#N)=C(O)C=C1 90838 [0,1,0,0,0,0|2,1,0]=4 358 B10R1.30 CC1=CC(C=O)=C(I)C=C1 H10219 [0,1,0,0,0,0|3,0,0]=4 359 B10R1.30 CC1=CC(CBr)=C(C)C=C1 CL9683 [0,1,0,0,0,0|3,0,0]=4 360 B10R1.30 CC1=CC(CN)=C(F)C=C1 W18911 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.30 CC1=CC(CO)=C(Br)C=C1 78891 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.30 CC1=CC(CO)=C(O)C=C1 A11080 [0,1,0,0,0,0|2,1,0]=4 363 B10R1.30 CC1=CC(NN)=C(Cl)C=C1 C77156 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.30 CCC1=C(N)C=CC(F)=C1 D83440 [0,1,0,0,0,0|2,0,0]=3 365 B10R1.30 CCC1=C(O)C=CC(C)=N1 T71674 [0,1,0,0,0,0|2,1,0]=4 366 B10R1.30 CCN1C=C(Br)C=CC1=O AC2035 [0,1,0,0,0,0|2,1,0]=4 367 B10R1.30 CNC1=C(C)C=CC(Cl)=C1 W16029 [0,1,0,0,0,0|2,0,0]=3 368 B10R1.30 CNC1=C(C)C=CC(O)=C1 C75943 [0,1,0,0,0,0|2,0,0]=3 369 B10R1.30 CNC1=C(N)C=CC(C)=C1 N12938 [0,1,0,0,0,0|2,0,0]=3 370 B10R1.30 CNC1=C(N)C=CC(Cl)=N1 W11032 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.30 CNC1=CC(Br)=CN=C1N N10250 [0,1,0,0,0,0|3,0,0]=4 372 B10R1.30 COC1=C(Br)C=CC(Cl)=N1 88327 [0,1,0,0,0,0|2,0,0]=3 373 B10R1.30 COC1=C(Br)C=NC(C)=C1 N10207 [0,1,0,0,0,0|2,0,0]=3 374 B10R1.30 COC1=C(Br)C=NC(F)=C1 FD10681 [0,1,0,0,0,0|2,0,0]=3 375 B10R1.30 COC1=C(C)C=NC(Cl)=N1 83973 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.30 COC1=C(Cl)C=CC(Br)=N1 D83067 [0,1,0,0,0,0|2,0,0]=3 377 B10R1.30 COC1=C(Cl)C=NC(N)=C1 A10702 [0,1,0,0,0,0|2,0,0]=3 378 B10R1.30 COC1=C(I)C=CC(Br)=N1 W18510 [0,1,0,0,0,0|2,0,0]=3 379 B10R1.30 COC1=C(I)C=CC(C)=C1 Y14673 [0,1,0,0,0,0|1,0,0]=2 380 B10R1.30 COC1=C(I)C=CC(N)=C1 C71377 [0,1,0,0,0,0|1,0,0]=2 381 B10R1.30 COC1=C(I)C=NC(Cl)=C1 C71858 [0,1,0,0,0,0|2,0,0]=3 382 B10R1.30 COC1=C(I)C=NC(Cl)=N1 F50762 [0,1,0,0,0,0|3,0,0]=4 383 B10R1.30 COC1=C(I)C=NC(N)=C1 D76350 [0,1,0,0,0,0|2,0,0]=3 384 B10R1.30 COC1=C(N)C=CC(Cl)=C1 AB2767 [0,1,0,0,0,0|1,0,0]=2 385 B10R1.30 COC1=C(N)C=CC(N)=C1 E10141 [0,1,0,0,0,0|1,0,0]=2 386 B10R1.30 COC1=C(N)C=CC(O)=C1 30482 [0,1,0,0,0,0|1,0,0]=2 387 B10R1.30 COC1=C(N)C=NC(Cl)=N1 73801 [0,1,0,0,0,0|3,0,0]=4 388 B10R1.30 COC1=C(O)C=CC(Br)=N1 C11325 [0,1,0,0,0,0|1,1,0]=3 389 B10R1.30 COC1=CC(=O)NN=C1Cl F20647 [0,1,0,0,0,0|3,0,0]=4 390 B10R1.30 COC1=CC(Br)=CN=C1C 82190 [0,1,0,0,0,0|2,0,0]=3 391 B10R1.30 COC1=CC(Br)=NC=C1Br 94342 [0,1,0,0,0,0|2,0,0]=3 392 B10R1.30 COC1=CC(Br)=NC=C1C A11960 [0,1,0,0,0,0|2,0,0]=3 393 B10R1.30 COC1=CC(Cl)=NC=C1Cl 26260 [0,1,0,0,0,0|2,0,0]=3 394 B10R1.30 COC1=CC(Cl)=NC=C1N C72019 [0,1,0,0,0,0|2,0,0]=3 395 B10R1.30 COC1=CC(Cl)=NN=C1N C10835 [0,1,0,0,0,0|3,0,0]=4 396 B10R1.30 COC1=CC(N)=CN=C1Cl 54845 [0,1,0,0,0,0|2,0,0]=3 397 B10R1.30 COC1=NC(Br)=CN=C1Br I11275 [0,1,0,0,0,0|3,0,0]=4 398 B10R1.30 COC1=NC(Br)=CN=C1I 27639 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.30 COC1=NC(Br)=CNC1=O C13693 [0,1,0,0,0,0|2,1,0]=4 400 B10R1.30 COC1=NC(C)=CN=C1C Y10564 [0,1,0,0,0,0|3,0,0]=4 401 B10R1.30 COC1=NC(C)=CN=C1N C77014 [0,1,0,0,0,0|3,0,0]=4 402 B10R1.30 COC1=NC(C)=NC=C1N C75487 [0,1,0,0,0,0|3,0,0]=4 403 B10R1.30 COC1=NC(N)=CN=C1Br D82133 [0,1,0,0,0,0|3,0,0]=4 404 B10R1.30 CSC1=C(C)C=CC(Cl)=C1 D83340 [0,1,0,0,0,0|1,1,0]=3 405 B10R1.30 CSC1=CC(Cl)=CN=C1Cl 79286 [0,1,0,0,0,0|2,1,0]=4 406 B10R1.30 CSC1=CC(Cl)=NC=C1F D79860 [0,1,0,0,0,0|2,1,0]=4 407 B10R1.30 ClCC1=C(Br)C=CC(Br)=C1 68638 [0,1,0,0,0,0|3,0,0]=4 408 B10R1.30 ClCC1=C(Cl)C=CC(Br)=C1 35517 [0,1,0,0,0,0|3,0,0]=4 409 B10R1.30 N#CC1=C(I)C=CC(Cl)=C1 D87712 [0,1,0,0,0,0|3,0,0]=4 410 B10R1.30 N#CC1=C(I)C=CC(F)=C1 D87569 [0,1,0,0,0,0|3,0,0]=4 411 B10R1.30 N#CC1=C(N)C=CC(N)=C1 C10959 [0,1,0,0,0,0|3,0,0]=4 412 B10R1.30 N#CC1=C(O)C=CC(O)=C1 C75243 [0,1,0,0,0,0|2,1,0]=4 413 B10R1.30 NC1=C(C=O)C=C(F)C=C1 88468 [0,1,0,0,0,0|3,0,0]=4 414 B10R1.30 NC1=CC(CO)=C(Cl)C=C1 35510 [0,1,0,0,0,0|3,0,0]=4 415 B10R1.30 NCC1=C(Br)C=CC(Br)=C1 N12804 [0,1,0,0,0,0|3,0,0]=4 416 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 CK1118 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.30 NCC1=C(N)C=CC(Br)=C1 C71032 [0,1,0,0,0,0|3,0,0]=4 418 B10R1.30 NCC1=C(O)C=CC(Br)=C1 O10496 [0,1,0,0,0,0|2,1,0]=4 419 B10R1.30 NNC1=C(F)C=CC(Br)=C1 C74046 [0,1,0,0,0,0|3,0,0]=4 420 B10R1.30 O=CC1=C(I)C=CC(F)=C1 34607 [0,1,0,0,0,0|3,0,0]=4 421 B10R1.30 OCC1=C(Cl)C=CC(O)=C1 C76883 [0,1,0,0,0,0|3,0,0]=4 422 B10R1.61 C=C(C)C1=C(Br)C=CC=C1 W17018 [0,1,0,0,0,0|2,0,0]=3 423 B10R1.61 CC(=O)C1=C(Br)C=CC=N1 80328 [0,1,0,0,0,0|3,0,0]=4 424 B10R1.61 CC(=O)C1=C(C)N=CC=C1 C73307 [0,1,0,0,0,0|3,0,0]=4 425 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 27067 [0,1,0,0,0,0|3,0,0]=4 426 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Y14823 [0,1,0,0,0,0|3,0,0]=4 427 B10R1.61 CC(=O)C1=C(Cl)C=NC=C1 N12959 [0,1,0,0,0,0|3,0,0]=4 428 B10R1.61 CC(=O)C1=C(O)C=NC=C1 27646 [0,1,0,0,0,0|2,1,0]=4 429 B10R1.61 CC(=O)C1=C(O)N=CC=C1 93481 [0,1,0,0,0,0|2,1,0]=4 430 B10R1.61 CC(=O)C1=CC=CN=C1F F31395 [0,1,0,0,0,0|3,0,0]=4 431 B10R1.61 CC(=O)C1=CNC=CC1=O C74936 [0,1,0,0,0,0|2,1,0]=4 432 B10R1.61 CC(=O)C1=NC=CC=C1N 80156 [0,1,0,0,0,0|3,0,0]=4 433 B10R1.61 CC(=O)C1=NC=CC=C1O 80210 [0,1,0,0,0,0|2,1,0]=4 434 B10R1.61 CC(C)C1=C(N)C=CN=C1 C77054 [0,1,0,0,0,0|3,0,0]=4 435 B10R1.61 CC(C)C1=C(O)C=CC=N1 72523 [0,1,0,0,0,0|2,1,0]=4 436 B10R1.61 CC(C)C1=C(S)C=CC=C1 29274 [0,1,0,0,0,0|1,0,0]=2 437 B10R1.61 CC(C)C1=CC=CN=C1Br C72641 [0,1,0,0,0,0|3,0,0]=4 438 B10R1.61 CC(C)C1=CC=CN=C1N 60027 [0,1,0,0,0,0|3,0,0]=4 439 B10R1.61 CC(C)C1=NC=CC=C1N C72482 [0,1,0,0,0,0|3,0,0]=4 440 B10R1.61 CC1=C(C(=N)N)C=CC=C1 28690 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52748 [0,1,0,0,0,0|2,0,0]=3 442 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52749 [0,1,0,0,0,0|2,0,0]=3 443 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 N10464 [0,1,0,0,0,0|2,0,0]=3 444 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 Y10511 [0,1,0,0,0,0|2,0,0]=3 445 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y11090 [0,1,0,0,0,0|3,0,0]=4 446 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12107 [0,1,0,0,0,0|3,0,0]=4 447 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12108 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13392 [0,1,0,0,0,0|3,0,0]=4 449 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13393 [0,1,0,0,0,0|3,0,0]=4 450 B10R1.61 CC1=CC=CN=C1[C@H](C)O 21080 [0,1,0,0,0,0|3,0,0]=4 451 B10R1.61 CC1=NC=CC=C1[C@H](C)N Y12491 [0,1,0,0,0,0|3,0,0]=4 452 B10R1.61 CN(C)C1=C(Br)C=CC=N1 N11615 [0,1,0,0,0,0|3,0,0]=4 453 B10R1.61 CN(C)C1=C(Br)C=NC=C1 F19675 [0,1,0,0,0,0|3,0,0]=4 454 B10R1.61 C[C@H](Cl)C1=C(F)C=NC=C1 W10402 [0,1,0,0,0,0|3,0,0]=4 455 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21516 [0,1,0,0,0,0|2,0,0]=3 456 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21517 [0,1,0,0,0,0|2,0,0]=3 457 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 Y10364 [0,1,0,0,0,0|2,0,0]=3 458 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70080 [0,1,0,0,0,0|3,0,0]=4 459 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 90519 [0,1,0,0,0,0|3,0,0]=4 460 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 D81561 [0,1,0,0,0,0|3,0,0]=4 461 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 20095 [0,1,0,0,0,0|2,0,0]=3 462 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1344 [0,1,0,0,0,0|2,0,0]=3 463 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1353 [0,1,0,0,0,0|2,0,0]=3 464 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=N1 90516 [0,1,0,0,0,0|3,0,0]=4 465 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52754 [0,1,0,0,0,0|2,0,0]=3 466 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52755 [0,1,0,0,0,0|2,0,0]=3 467 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 I10701 [0,1,0,0,0,0|2,0,0]=3 468 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y10447 [0,1,0,0,0,0|2,0,0]=3 469 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y11656 [0,1,0,0,0,0|2,0,0]=3 470 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13070 [0,1,0,0,0,0|3,0,0]=4 471 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13095 [0,1,0,0,0,0|3,0,0]=4 472 B10R1.61 C[C@H](N)C1=C(N)C=CC=C1 C78195 [0,1,0,0,0,0|2,0,0]=3 473 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 SC1257 [0,1,0,0,0,0|2,0,0]=3 474 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1230 [0,1,0,0,0,0|2,0,0]=3 475 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1233 [0,1,0,0,0,0|2,0,0]=3 476 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=N1 P19330 [0,1,0,0,0,0|3,0,0]=4 477 B10R1.61 C[C@H](O)C1=C(F)C=CC=N1 F13157 [0,1,0,0,0,0|3,0,0]=4 478 B10R1.61 C[C@H](O)C1=C(O)C=CC=C1 W16007 [0,1,0,0,0,0|1,1,0]=3 479 B10R1.61 C[C@H](O)C1=CC=CN=C1F F15555 [0,1,0,0,0,0|3,0,0]=4 480 B10R1.61 N=C(N)C1=C(Cl)C=CC=C1 71514 [0,1,0,0,0,0|3,0,0]=4 481 B10R1.61 NC1=C(C(F)F)C=CC=C1 72620 [0,1,0,0,0,0|3,0,0]=4 482 B10R1.245 BrCC1=C(Br)C=CC=C1Br 96245 [0,1,0,0,0,0|3,0,0]=4 483 B10R1.245 C=CC1=C(Cl)C=CC=C1Cl CK2536 [0,1,0,0,0,0|2,0,1]=4 484 B10R1.245 CC1=CC=CC(Cl)=C1CN Y12256 [0,1,0,0,0,0|3,0,0]=4 485 B10R1.245 CC1=CC=CC(F)=C1CO W16613 [0,1,0,0,0,0|3,0,0]=4 486 B10R1.245 CC1=CC=CC(O)=C1C=O 50507 [0,1,0,0,0,0|2,1,0]=4 487 B10R1.245 CC1=CC=CC(O)=C1CO C74535 [0,1,0,0,0,0|2,1,0]=4 488 B10R1.245 CCC1=C(Br)C=CC=C1Br 86463 [0,1,0,0,0,0|2,0,0]=3 489 B10R1.245 CNC1=C(Br)C=CC=C1N C71480 [0,1,0,0,0,0|2,0,0]=3 490 B10R1.245 CNC1=C(F)C=CC=C1F C77614 [0,1,0,0,0,0|2,0,0]=3 491 B10R1.245 COC1=C(Br)C=CC=C1C F52555 [0,1,0,0,0,0|1,0,0]=2 492 B10R1.245 COC1=C(Br)C=CN=C1C A11666 [0,1,0,0,0,0|2,0,0]=3 493 B10R1.245 COC1=C(Br)C=NC=C1N I11194 [0,1,0,0,0,0|2,0,0]=3 494 B10R1.245 COC1=C(Cl)C=CC=C1O 95656 [0,1,0,0,0,0|0,1,0]=2 495 B10R1.245 COC1=C(Cl)C=CN=C1N F51098 [0,1,0,0,0,0|2,0,0]=3 496 B10R1.245 COC1=C(N)C=CC=C1N A12416 [0,1,0,0,0,0|1,0,0]=2 497 B10R1.245 COC1=C(N)C=CN=C1Cl F17572 [0,1,0,0,0,0|2,0,0]=3 498 B10R1.245 NC1=CC=CC(Br)=C1C=O 90067 [0,1,0,0,0,0|3,0,0]=4 499 B10R1.245 NC1=CC=CC(Br)=C1CO 90066 [0,1,0,0,0,0|3,0,0]=4 500 B10R1.245 NC1=CC=CC(F)=C1C=O F15850 [0,1,0,0,0,0|3,0,0]=4 501 B10R1.245 NC1=CC=CC(I)=C1C=O D70934 [0,1,0,0,0,0|3,0,0]=4 502 B10R1.245 NCC1=C(Br)C=CC=C1Br O10035 [0,1,0,0,0,0|3,0,0]=4 503 B10R1.245 NNC1=C(Br)C=CC=C1F O10042 [0,1,0,0,0,0|3,0,0]=4 504 B10R1.245 NNC1=C(F)C=CC=C1F 35832 [0,1,0,0,0,0|3,0,0]=4 505 B10R1.245 O=CC1=C(I)C=CC=C1Cl C75422 [0,1,0,0,0,0|3,0,0]=4 506 B10R1.245 [C-]#[N+]C1=C(C)C=CC=C1C S10630 [0,1,0,0,0,0|2,0,1]=4 507 B10R2.7 C1=CC2=C(C=C1)SN=N2 C74419 [0,0,0,1,0,0|2,0,0]=3 508 B10R2.7 C1=CC2=C(C=CO2)N=C1 BL002594 [0,0,0,1,0,0|2,0,1]=4 509 B10R2.7 C1=CC2=C(C=N1)CCN2 86683 [0,0,0,1,0,0|3,0,0]=4 510 B10R2.7 C1=CC2=C(C=N1)N=CO2 C74415 [0,0,0,1,0,0|2,0,1]=4 511 B10R2.7 C1=CC2=C(C=N1)NCC2 A10607 [0,0,0,1,0,0|3,0,0]=4 512 B10R2.7 C1=CC2=C(C=N1)NCC2 C73056 [0,0,0,1,0,0|3,0,0]=4 513 B10R2.7 C1=CC2=C(C=N1)SC=N2 26297 [0,0,0,1,0,0|2,0,1]=4 514 B10R2.7 C1=CC2=CON=C2C=C1 T70698 [0,0,0,1,0,0|3,0,0]=4 515 B10R2.7 C1=CC2=N[Se]N=C2C=C1 T70699 [0,0,0,1,0,0|3,0,0]=4 516 B10R2.7 C1=CN=C2CCNC2=C1 70854 [0,0,0,1,0,0|3,0,0]=4 517 B10R2.7 C1=CN=C2OC=CC2=C1 N13064 [0,0,0,1,0,0|2,0,1]=4 518 B10R2.7 C1=CN=C2OC=NC2=C1 32393 [0,0,0,1,0,0|2,0,1]=4 519 B10R2.320 O=C1CC2=C1C=CC=C2 67963 [0,0,0,1,0,0|3,0,0]=4 520 B8R1.11 COC1=NNC=C1I F16206 [0,0,0,0,1,0|3,0,0]=4 521 B7R1.3 ClC1=CN=CC=C1 P19758 [2,0,0,0,0,0|2,0,0]=4 522 B7R1.3 NC1=CC=CC=C1 T70935 [2,0,0,0,0,0|1,0,0]=3 523 B7R1.3 NC1=CC=CC=C1 T71037 [2,0,0,0,0,0|1,0,0]=3 524 B7R1.3 SC1=NC=CN=C1 F16108 [2,0,0,0,0,0|2,0,0]=4 525 B9R1.1 C#CC1=CC=C(I)C=C1 F21257 [1,1,0,0,0,0|1,0,1]=4 526 B9R1.1 CCC1=CN=C(Br)C=C1 CS1557 [1,1,0,0,0,0|2,0,0]=4 527 B9R1.1 CCC1=CN=C(Cl)C=C1 72594 [1,1,0,0,0,0|2,0,0]=4 528 B9R1.1 CCC1=CN=C(O)C=C1 25325 [1,1,0,0,0,0|2,0,0]=4 529 B9R1.1 CCC1=NC=C(Br)C=C1 26547 [1,1,0,0,0,0|2,0,0]=4 530 B9R1.1 CCC1=NC=C(Cl)C=C1 C71513 [1,1,0,0,0,0|2,0,0]=4 531 B9R1.1 CCC1=NC=C(N)C=C1 C72111 [1,1,0,0,0,0|2,0,0]=4 532 B9R1.1 CNC1=CC=C(O)C=C1 D77985 [1,1,0,0,0,0|1,0,0]=3 533 B9R1.1 CNC1=CN=C(Br)C=C1 D86940 [1,1,0,0,0,0|2,0,0]=4 534 B9R1.1 CNC1=CN=C(C)C=C1 D83365 [1,1,0,0,0,0|2,0,0]=4 535 B9R1.1 CNC1=NC=C(N)C=C1 C74450 [1,1,0,0,0,0|2,0,0]=4 536 B9R1.1 COC1=CN=C(F)C=C1 98092 [1,1,0,0,0,0|1,0,0]=3 537 B9R1.1 COC1=CN=C(N)N=C1 11206 [1,1,0,0,0,0|2,0,0]=4 538 B9R1.1 COC1=NC=C(I)C=N1 W11580 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.1 COC1=NC=C(N)C=N1 35336 [1,1,0,0,0,0|2,0,0]=4 540 B9R1.1 COC1=NC=C(N)N=C1 24331 [1,1,0,0,0,0|2,0,0]=4 541 B9R1.1 COC1=NC=C(O)C=N1 C16680 [1,1,0,0,0,0|2,0,0]=4 542 B9R1.1 COC1=NN=C(I)C=C1 C15088 [1,1,0,0,0,0|2,0,0]=4 543 B9R1.1 ClCC1=CC=C(I)C=C1 AB8901 [1,1,0,0,0,0|2,0,0]=4 544 B9R1.1 FCC1=CC=C(Br)C=C1 W10394 [1,1,0,0,0,0|2,0,0]=4 545 B9R1.1 N#CC1=CC=C(S)C=C1 F31167 [1,1,0,0,0,0|2,0,0]=4 546 B9R1.1 NCC1=CC=C(O)C=C1 AC1832 [1,1,0,0,0,0|2,0,0]=4 547 B9R1.1 OCC1=CC=C(S)C=C1 Y11017 [1,1,0,0,0,0|2,0,0]=4 548 B9R1.2 C=CC1=CC(C)=CC=C1 F16162 [1,1,0,0,0,0|1,0,1]=4 549 B9R1.2 CCC1=CC(Br)=CN=C1 25835 [1,1,0,0,0,0|2,0,0]=4 550 B9R1.2 CCC1=CC=CC(Br)=N1 O10692 [1,1,0,0,0,0|2,0,0]=4 551 B9R1.2 CCC1=NC=CC(Br)=C1 S10560 [1,1,0,0,0,0|2,0,0]=4 552 B9R1.2 CNC1=CC(Br)=NC=C1 CS1908 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.2 CNC1=CC(N)=CC=C1 36494 [1,1,0,0,0,0|1,0,0]=3 554 B9R1.2 CNC1=NC=CC(Br)=C1 32749 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.2 CNC1=NC=CC(N)=C1 27435 [1,1,0,0,0,0|2,0,0]=4 556 B9R1.2 COC1=CC(=O)NC=C1 25837 [1,1,0,0,0,0|1,0,0]=3 557 B9R1.2 COC1=CC(Br)=NC=N1 C76202 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.2 COC1=CC(Cl)=CN=N1 E70128 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.2 COC1=CC(F)=NC=N1 D83389 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.2 COC1=NC(C)=CC=N1 C72586 [1,1,0,0,0,0|2,0,0]=4 561 B9R1.2 COC1=NC(C)=NC=C1 73836 [1,1,0,0,0,0|2,0,0]=4 562 B9R1.2 COC1=NC(N)=CN=C1 24364 [1,1,0,0,0,0|2,0,0]=4 563 B9R1.2 COC1=NC(O)=CC=N1 Y10376 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.2 COC1=NC=CC(Br)=N1 25350 [1,1,0,0,0,0|2,0,0]=4 565 B9R1.2 COC1=NC=NC(C)=C1 H10028 [1,1,0,0,0,0|2,0,0]=4 566 B9R1.2 CSC1=CC(F)=CC=C1 A12732 [1,1,0,0,0,0|0,1,0]=3 567 B9R1.2 CSC1=CC(O)=CC=C1 W12966 [1,1,0,0,0,0|0,1,0]=3 568 B9R1.2 CSC1=CC=CC(Cl)=N1 F14554 [1,1,0,0,0,0|1,1,0]=4 569 B9R1.2 CSC1=NC(N)=CC=C1 W18184 [1,1,0,0,0,0|1,1,0]=4 570 B9R1.2 N#[N+]C1=CC=CC(Br)=C1 98381 [1,1,0,0,0,0|2,0,0]=4 571 B9R1.2 NC1=CC=CC(C=O)=C1 CK2096 [1,1,0,0,0,0|2,0,0]=4 572 B9R1.2 NC1=CC=CC(CF)=C1 32172 [1,1,0,0,0,0|2,0,0]=4 573 B9R1.6 C=C(C)C1=NC=CC=C1 W17791 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13294 [1,1,0,0,0,0|2,0,0]=4 575 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77753 [1,1,0,0,0,0|1,0,0]=3 576 B9R1.6 C[C@H](N)C1=CC=CN=C1 20316 [1,1,0,0,0,0|2,0,0]=4 577 B9R1.6 C[C@H](N)C1=CC=CN=C1 74003 [1,1,0,0,0,0|2,0,0]=4 578 B9R1.6 C[C@H](N)C1=CC=CN=C1 74005 [1,1,0,0,0,0|2,0,0]=4 579 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31031 [1,1,0,0,0,0|2,0,0]=4 580 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31032 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31033 [1,1,0,0,0,0|2,0,0]=4 582 B9R1.6 C[C@H](N)C1=CC=NC=C1 N10538 [1,1,0,0,0,0|2,0,0]=4 583 B9R1.6 C[C@H](O)C1=NC=CC=C1 A11519 [1,1,0,0,0,0|2,0,0]=4 584 B9R1.6 C[C@H](O)C1=NC=CC=C1 C16040 [1,1,0,0,0,0|2,0,0]=4 585 B9R1.6 C[S@](=O)C1=NC=CC=C1 C74099 [1,1,0,0,0,0|1,1,0]=4 586 B9R1.8 BrC#CC1=CC=CC=C1 A51120 [1,1,0,0,0,0|1,0,1]=4 587 B9R1.8 BrCCC1=CC=NC=C1 C71689 [1,1,0,0,0,0|2,0,0]=4 588 B9R1.8 CCNC1=CC=CN=C1 C15578 [1,1,0,0,0,0|2,0,0]=4 589 B9R1.8 CNCC1=CC=NC=C1 AR1712 [1,1,0,0,0,0|2,0,0]=4 590 B9R1.8 ClCCC1=CC=NC=C1 O11064 [1,1,0,0,0,0|2,0,0]=4 591 B9R1.8 NOCC1=CN=CC=C1 AC6038 [1,1,0,0,0,0|2,0,0]=4 592 B9R1.8 N\N=C\C1=CC=CC=C1 D81797 [1,1,0,0,0,0|2,0,0]=4 593 B9R1.8 O\N=C/C1=CC=CC=C1 N10040 [1,1,0,0,0,0|2,0,0]=4 594 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 C11398 [1,1,0,0,0,0|1,0,1]=4 595 B9R1.3 CC1=C(Br)C=CN=C1Cl 27325 [1,1,0,0,0,0|2,0,0]=4 596 B9R1.3 CC1=C(Br)C=CN=C1N S10229 [1,1,0,0,0,0|2,0,0]=4 597 B9R1.3 CC1=C(Br)C=NC=C1Cl C72047 [1,1,0,0,0,0|2,0,0]=4 598 B9R1.3 CC1=C(Br)C=NC=C1O AC5971 [1,1,0,0,0,0|1,1,0]=4 599 B9R1.3 CC1=C(C)C(Br)=NC=C1 N10835 [1,1,0,0,0,0|2,0,0]=4 600 B9R1.3 CC1=C(C)C(N)=NC=C1 Y10702 [1,1,0,0,0,0|2,0,0]=4 601 B9R1.3 CC1=C(Cl)C(Br)=NC=C1 C76922 [1,1,0,0,0,0|2,0,0]=4 602 B9R1.3 CC1=C(Cl)C=CN=C1Br P17567 [1,1,0,0,0,0|2,0,0]=4 603 B9R1.3 CC1=C(Cl)C=CN=C1N C71886 [1,1,0,0,0,0|2,0,0]=4 604 B9R1.3 CC1=C(F)C=CN=C1N D70937 [1,1,0,0,0,0|2,0,0]=4 605 B9R1.3 CC1=C(I)C=CNC1=O W18300 [1,1,0,0,0,0|1,1,0]=4 606 B9R1.3 CC1=C(O)C(Br)=NC=C1 C71875 [1,1,0,0,0,0|1,1,0]=4 607 B9R1.3 CC1=C(O)C(Cl)=NC=C1 36409 [1,1,0,0,0,0|1,1,0]=4 608 B9R1.3 CC1=C(O)C=CNC1=O D94824 [1,1,0,0,0,0|1,1,0]=4 609 B9R1.3 CC1=CC=CC(I)=C1Br CL9287 [1,1,0,0,0,0|1,0,0]=3 610 B9R1.3 CC1=CC=CC(I)=C1Cl D82348 [1,1,0,0,0,0|1,0,0]=3 611 B9R1.3 CC1=CC=CC(I)=C1F 55203 [1,1,0,0,0,0|1,0,0]=3 612 B9R1.3 CC1=CC=NC(C)=C1Br C10200 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.3 CC1=CC=NC(N)=C1F 22700 [1,1,0,0,0,0|2,0,0]=4 614 B9R1.3 CC1=CN=CC(C)=C1Br 52045 [1,1,0,0,0,0|2,0,0]=4 615 B9R1.3 CC1=CN=CC(C)=C1Cl AB6822 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.3 CC1=CN=CC(C)=C1I 52056 [1,1,0,0,0,0|2,0,0]=4 617 B9R1.3 CC1=CN=CC(Cl)=C1N 27804 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.3 CC1=CN=CC(F)=C1N 93260 [1,1,0,0,0,0|2,0,0]=4 619 B9R1.3 CC1=CN=CC(I)=C1N F12221 [1,1,0,0,0,0|2,0,0]=4 620 B9R1.3 CC1=CN=CC(N)=C1N 26396 [1,1,0,0,0,0|2,0,0]=4 621 B9R1.3 CC1=NC=CC(Br)=C1Cl AC1900 [1,1,0,0,0,0|2,0,0]=4 622 B9R1.3 CC1=NC=CC(Br)=C1F O11181 [1,1,0,0,0,0|2,0,0]=4 623 B9R1.3 CC1=NC=CC(Br)=C1F S12180 [1,1,0,0,0,0|2,0,0]=4 624 B9R1.3 CC1=NC=CC(Br)=C1N F15057 [1,1,0,0,0,0|2,0,0]=4 625 B9R1.3 CC1=NC=CC(Cl)=C1F C71651 [1,1,0,0,0,0|2,0,0]=4 626 B9R1.3 CC1=NC=CC(N)=C1N 26933 [1,1,0,0,0,0|2,0,0]=4 627 B9R1.3 CC1=NC=CC(O)=C1C 89362 [1,1,0,0,0,0|1,1,0]=4 628 B9R1.3 CN1C(=O)C=CC=C1Br C76858 [1,1,0,0,0,0|1,1,0]=4 629 B9R1.3 CN1C=CC=C(Br)C1=O P11117 [1,1,0,0,0,0|1,1,0]=4 630 B9R1.3 CN1C=CC=C(N)C1=O CS1614 [1,1,0,0,0,0|1,1,0]=4 631 B9R1.3 ClC1=CC=CC(I)=C1Br C72487 [1,1,0,0,0,0|2,0,0]=4 632 B9R1.3 FC1=CC=CC(F)=C1S N10599 [1,1,0,0,0,0|1,0,0]=3 633 B9R1.3 FC1=CC=CC(I)=C1Cl D96251 [1,1,0,0,0,0|2,0,0]=4 634 B9R1.3 NC1=C(Cl)C(S)=CC=N1 D96782 [1,1,0,0,0,0|2,0,0]=4 635 B9R1.3 NC1=C(Cl)C=CC=C1O 83940 [1,1,0,0,0,0|1,0,0]=3 636 B9R1.3 NC1=C(Cl)C=CN=C1O 84125 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.3 NC1=C(I)C=CC=C1F C10209 [1,1,0,0,0,0|2,0,0]=4 638 B9R1.3 NC1=C(I)C=CC=C1O 56049 [1,1,0,0,0,0|1,0,0]=3 639 B9R1.3 NC1=C(O)C(Cl)=NC=C1 80296 [1,1,0,0,0,0|2,0,0]=4 640 B9R1.3 NC1=C(O)C=CN=C1Cl 80316 [1,1,0,0,0,0|2,0,0]=4 641 B9R1.3 NC1=CC=CC(Br)=C1Cl CL9068 [1,1,0,0,0,0|2,0,0]=4 642 B9R1.3 NC1=CC=CC(Br)=C1I D82519 [1,1,0,0,0,0|2,0,0]=4 643 B9R1.3 NC1=CC=CC(Cl)=C1S AT19652 [1,1,0,0,0,0|1,0,0]=3 644 B9R1.3 NC1=CC=CC(F)=C1I 34364 [1,1,0,0,0,0|2,0,0]=4 645 B9R1.3 NC1=CC=CC(I)=C1O D93643 [1,1,0,0,0,0|1,0,0]=3 646 B9R1.3 NC1=CC=CC(N)=C1O C73483 [1,1,0,0,0,0|1,0,0]=3 647 B9R1.3 NC1=CC=CC(O)=C1Cl A11176 [1,1,0,0,0,0|1,0,0]=3 648 B9R1.3 NC1=CC=CC(O)=C1F D83231 [1,1,0,0,0,0|1,0,0]=3 649 B9R1.3 NC1=CC=CC(O)=C1N Y11294 [1,1,0,0,0,0|1,0,0]=3 650 B9R1.3 O=C1NC=CC(O)=C1Cl 24944 [1,1,0,0,0,0|2,0,0]=4 651 B9R1.3 OC1=C(Br)C=CN=C1Br W15957 [1,1,0,0,0,0|2,0,0]=4 652 B9R1.3 OC1=C(Br)C=CN=C1Cl 55295 [1,1,0,0,0,0|2,0,0]=4 653 B9R1.3 OC1=C(Cl)C=CN=C1Br W11194 [1,1,0,0,0,0|2,0,0]=4 654 B9R1.3 OC1=C(Cl)C=CN=C1Cl C12296 [1,1,0,0,0,0|2,0,0]=4 655 B9R1.3 OC1=C(F)C=CN=C1Cl F12183 [1,1,0,0,0,0|2,0,0]=4 656 B9R1.3 OC1=C(I)C=CC=C1Br A10639 [1,1,0,0,0,0|1,0,0]=3 657 B9R1.3 OC1=C(I)C=CC=C1Cl C10110 [1,1,0,0,0,0|1,0,0]=3 658 B9R1.3 OC1=C(I)C=CC=C1I W15211 [1,1,0,0,0,0|1,0,0]=3 659 B9R1.3 OC1=C(I)C=CN=C1Cl F50756 [1,1,0,0,0,0|2,0,0]=4 660 B9R1.3 OC1=C(I)C=CN=C1I 37855 [1,1,0,0,0,0|2,0,0]=4 661 B9R1.3 OC1=C(I)C=NC=C1I W18704 [1,1,0,0,0,0|2,0,0]=4 662 B9R1.3 OC1=CC=CC(Cl)=C1I 34465 [1,1,0,0,0,0|1,0,0]=3 663 B9R1.3 OC1=CC=CC(Cl)=C1O I10220 [1,1,0,0,0,0|0,1,0]=3 664 B9R1.3 OC1=CC=CC(I)=C1Cl O10718 [1,1,0,0,0,0|1,0,0]=3 665 B9R1.69 CC1=C(Br)C=C(F)C=N1 22786 [1,1,0,0,0,0|2,0,0]=4 666 B9R1.69 CC1=C(Br)C=C(F)N=C1 C14400 [1,1,0,0,0,0|2,0,0]=4 667 B9R1.69 CC1=C(Br)C=C(N)N=C1 72100 [1,1,0,0,0,0|2,0,0]=4 668 B9R1.69 CC1=C(C)N=C(N)C=C1 C75720 [1,1,0,0,0,0|2,0,0]=4 669 B9R1.69 CC1=C(Cl)C=C(N)N=C1 C71138 [1,1,0,0,0,0|2,0,0]=4 670 B9R1.69 CC1=C(Cl)C=C(O)C=N1 94607 [1,1,0,0,0,0|2,0,0]=4 671 B9R1.69 CC1=C(Cl)C=CC(Br)=N1 C16781 [1,1,0,0,0,0|2,0,0]=4 672 B9R1.69 CC1=C(Cl)C=CC(O)=N1 C10556 [1,1,0,0,0,0|2,0,0]=4 673 B9R1.69 CC1=C(Cl)C=NC(O)=C1 C76951 [1,1,0,0,0,0|2,0,0]=4 674 B9R1.69 CC1=C(F)C=C(Cl)C=C1 D77788 [1,1,0,0,0,0|1,0,0]=3 675 B9R1.69 CC1=C(F)C=C(N)C=N1 D70662 [1,1,0,0,0,0|2,0,0]=4 676 B9R1.69 CC1=C(F)C=CC(Br)=C1 AC7936 [1,1,0,0,0,0|1,0,0]=3 677 B9R1.69 CC1=C(I)C=C(N)N=C1 72489 [1,1,0,0,0,0|2,0,0]=4 678 B9R1.69 CC1=C(I)C=CC(F)=N1 22653 [1,1,0,0,0,0|2,0,0]=4 679 B9R1.69 CC1=C(I)C=NC(Br)=C1 I10152 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.69 CC1=C(I)C=NC(F)=C1 22752 [1,1,0,0,0,0|2,0,0]=4 681 B9R1.69 CC1=C(N)C=CC(N)=C1 D87687 [1,1,0,0,0,0|1,0,0]=3 682 B9R1.69 CC1=C(O)C=C(I)C=C1 D76555 [1,1,0,0,0,0|0,1,0]=3 683 B9R1.69 CC1=C(O)C=CC(S)=C1 63544 [1,1,0,0,0,0|0,1,0]=3 684 B9R1.69 CC1=CC(=S)N(O)C=C1 D80842 [1,1,0,0,0,0|1,0,1]=4 685 B9R1.69 CC1=CC(Br)=C(C)C=N1 N13082 [1,1,0,0,0,0|2,0,0]=4 686 B9R1.69 CC1=CC(Br)=C(C)N=C1 P10110 [1,1,0,0,0,0|2,0,0]=4 687 B9R1.69 CC1=CC(Br)=C(O)C=N1 53715 [1,1,0,0,0,0|2,0,0]=4 688 B9R1.69 CC1=CC(Br)=CN=C1I I11229 [1,1,0,0,0,0|2,0,0]=4 689 B9R1.69 CC1=CC(C)=C(Br)C=N1 W18180 [1,1,0,0,0,0|2,0,0]=4 690 B9R1.69 CC1=CC(Cl)=C(C)C=N1 O11204 [1,1,0,0,0,0|2,0,0]=4 691 B9R1.69 CC1=CC(F)=CN=C1N 27788 [1,1,0,0,0,0|2,0,0]=4 692 B9R1.69 CC1=CC(I)=C(Br)C=C1 T71407 [1,1,0,0,0,0|2,0,0]=4 693 B9R1.69 CC1=CC(I)=CN=C1Cl I10138 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.69 CC1=CC(I)=CN=C1F A10643 [1,1,0,0,0,0|2,0,0]=4 695 B9R1.69 CC1=CC(O)=C(Br)C=N1 C72039 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.69 CC1=CC(O)=CN=C1C W19117 [1,1,0,0,0,0|2,0,0]=4 697 B9R1.69 CC1=CC(O)=CN=C1Cl 25601 [1,1,0,0,0,0|2,0,0]=4 698 B9R1.69 CC1=CC(O)=CN=C1F BL009882 [1,1,0,0,0,0|2,0,0]=4 699 B9R1.69 CC1=CC(O)=CN=C1N 72099 [1,1,0,0,0,0|2,0,0]=4 700 B9R1.69 CC1=CC=C(Cl)NC1=O 78111 [1,1,0,0,0,0|1,1,0]=4 701 B9R1.69 CC1=CC=C(N)N=C1N N13200 [1,1,0,0,0,0|2,0,0]=4 702 B9R1.69 CC1=CC=C(O)C(Cl)=N1 35292 [1,1,0,0,0,0|2,0,0]=4 703 B9R1.69 CC1=CN=C(Br)C=C1Br F11640 [1,1,0,0,0,0|2,0,0]=4 704 B9R1.69 CC1=CN=C(Br)C=C1Cl F11669 [1,1,0,0,0,0|2,0,0]=4 705 B9R1.69 CC1=CN=C(Br)C=C1F D70629 [1,1,0,0,0,0|2,0,0]=4 706 B9R1.69 CC1=CN=C(Br)C=C1N 79079 [1,1,0,0,0,0|2,0,0]=4 707 B9R1.69 CC1=CN=C(C)C(N)=C1 P11581 [1,1,0,0,0,0|2,0,0]=4 708 B9R1.69 CC1=CN=C(C)C=C1N W13730 [1,1,0,0,0,0|2,0,0]=4 709 B9R1.69 CC1=CN=C(Cl)C(O)=C1 C77105 [1,1,0,0,0,0|2,0,0]=4 710 B9R1.69 CC1=CN=C(F)C(O)=C1 79064 [1,1,0,0,0,0|2,0,0]=4 711 B9R1.69 CC1=CN=C(F)C=C1N D83156 [1,1,0,0,0,0|2,0,0]=4 712 B9R1.69 CC1=CN=C(I)C(C)=C1 72078 [1,1,0,0,0,0|2,0,0]=4 713 B9R1.69 CC1=CN=C(N)C(C)=C1 S10186 [1,1,0,0,0,0|2,0,0]=4 714 B9R1.69 CC1=CN=C(N)C=C1C F18079 [1,1,0,0,0,0|2,0,0]=4 715 B9R1.69 CC1=NC(N)=C(O)C=C1 25163 [1,1,0,0,0,0|2,0,0]=4 716 B9R1.69 CC1=NC=C(Br)C=C1O 24970 [1,1,0,0,0,0|1,1,0]=4 717 B9R1.69 CC1=NC=C(F)C=C1N D96784 [1,1,0,0,0,0|2,0,0]=4 718 B9R1.69 CC1=[N+]([O-])C=CC(Br)=C1 58524 [1,1,0,0,0,0|1,1,0]=4 719 B9R1.69 CN1C=C(F)C=CC1=O C75398 [1,1,0,0,0,0|1,1,0]=4 720 B9R1.69 CN1C=CC(=O)C(O)=C1 O11011 [1,1,0,0,0,0|1,1,0]=4 721 B9R1.69 CN1C=CC(I)=CC1=O W16774 [1,1,0,0,0,0|1,1,0]=4 722 B9R1.69 CN1C=CC(O)=CC1=O 32621 [1,1,0,0,0,0|1,1,0]=4 723 B9R1.69 FC1=C(I)C=C(Cl)C=C1 D76847 [1,1,0,0,0,0|2,0,0]=4 724 B9R1.69 NC1=C(Br)C=CC(Br)=C1 AB9018 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.69 NC1=C(F)C=C(S)C=C1 AC4437 [1,1,0,0,0,0|2,0,0]=4 726 B9R1.69 NC1=C(O)C=CC(Cl)=N1 83945 [1,1,0,0,0,0|2,0,0]=4 727 B9R1.69 NC1=C(O)C=CC(O)=C1 D82359 [1,1,0,0,0,0|1,0,0]=3 728 B9R1.69 NC1=C(S)C=C(Br)C=C1 83378 [1,1,0,0,0,0|1,0,0]=3 729 B9R1.69 NC1=CC(Br)=NC=C1O AC2756 [1,1,0,0,0,0|2,0,0]=4 730 B9R1.69 NC1=CC(Cl)=NC=C1O C14679 [1,1,0,0,0,0|2,0,0]=4 731 B9R1.69 NC1=CC(F)=C(F)C=C1 D77855 [1,1,0,0,0,0|2,0,0]=4 732 B9R1.69 NC1=CC(F)=C(N)C=C1 O10786 [1,1,0,0,0,0|2,0,0]=4 733 B9R1.69 NC1=CC(N)=C(Br)C=C1 34773 [1,1,0,0,0,0|2,0,0]=4 734 B9R1.69 NC1=CC(O)=C(F)C=C1 53863 [1,1,0,0,0,0|1,0,0]=3 735 B9R1.69 NC1=CC(O)=C(N)C=C1 Y10783 [1,1,0,0,0,0|1,0,0]=3 736 B9R1.69 NC1=CN=C(Cl)C=C1O O11344 [1,1,0,0,0,0|2,0,0]=4 737 B9R1.69 NC1=NC=C(F)C=C1O F12177 [1,1,0,0,0,0|2,0,0]=4 738 B9R1.69 O=C1C=CC(=O)C(Br)=C1 T70875 [1,1,0,0,0,0|1,0,1]=4 739 B9R1.69 OC1=C(F)C=C(F)C=N1 W17865 [1,1,0,0,0,0|2,0,0]=4 740 B9R1.69 OC1=C(F)C=CC(I)=C1 26402 [1,1,0,0,0,0|1,0,0]=3 741 B9R1.69 OC1=C(F)N=C(Br)C=C1 96388 [1,1,0,0,0,0|2,0,0]=4 742 B9R1.69 OC1=C(I)C=C(Cl)N=C1 W12390 [1,1,0,0,0,0|2,0,0]=4 743 B9R1.69 OC1=CC(Br)=C(I)C=C1 A11846 [1,1,0,0,0,0|2,0,0]=4 744 B9R1.69 OC1=CC(Br)=CN=C1Br C76772 [1,1,0,0,0,0|2,0,0]=4 745 B9R1.69 OC1=CC(Cl)=CN=C1F RB1101 [1,1,0,0,0,0|2,0,0]=4 746 B9R1.69 OC1=CC(F)=C(I)C=C1 36664 [1,1,0,0,0,0|2,0,0]=4 747 B9R1.69 OC1=CC(F)=CN=C1Br 79185 [1,1,0,0,0,0|2,0,0]=4 748 B9R1.69 OC1=CC(F)=CN=C1Cl Y10122 [1,1,0,0,0,0|2,0,0]=4 749 B9R1.69 OC1=CC=C(Cl)N=C1Cl 81828 [1,1,0,0,0,0|2,0,0]=4 750 B9R1.69 OC1=CN=C(F)C=C1F 70871 [1,1,0,0,0,0|2,0,0]=4 751 B9R1.14 COC1=C(C=O)OC=C1 65862 [0,1,0,0,1,0|1,1,0]=4 752 B9R1.22 COC1=C(Br)C=C(Br)S1 95246 [0,1,0,0,1,0|2,0,0]=4 753 B11R1.8 COC1=C(C)C(C)=CC(C)=C1 D70095 [0,2,0,0,0,0|1,0,0]=3 754 B11R1.8 COC1=C(C)C(N)=CC(Br)=C1 90646 [0,2,0,0,0,0|1,0,0]=3 755 B11R1.8 COC1=C(O)C(C)=CC(Br)=C1 39208 [0,2,0,0,0,0|0,1,0]=3 756 B11R1.8 COC1=CC(Br)=CC(F)=C1Cl 95554 [0,2,0,0,0,0|1,0,0]=3 757 B11R1.8 COC1=CC(Cl)=CC(Cl)=C1I 53005 [0,2,0,0,0,0|1,0,0]=3 758 B11R1.8 COC1=CC(F)=CC(Br)=C1N W11164 [0,2,0,0,0,0|1,0,0]=3 759 B11R1.13 CCNC1=CC=CC(Cl)=C1Cl AB1375 [0,2,0,0,0,0|2,0,0]=4 760 B11R1.13 CCOC1=C(N)C(N)=CC=C1 79683 [0,2,0,0,0,0|1,0,0]=3 761 B11R1.13 CCOC1=CC=CC(F)=C1N D84510 [0,2,0,0,0,0|1,0,0]=3 762 B11R1.13 CNCC1=CC=CC(Cl)=C1Cl 23580 [0,2,0,0,0,0|2,0,0]=4 763 B11R1.13 CNCC1=CC=CC(Cl)=C1F 36790 [0,2,0,0,0,0|2,0,0]=4 764 B11R1.13 CNCC1=CC=CC(Cl)=C1F 76700 [0,2,0,0,0,0|2,0,0]=4 765 B11R1.13 CNCC1=CC=CC(F)=C1F AC1201 [0,2,0,0,0,0|2,0,0]=4 766 B11R1.13 COCC1=CC=CC(Br)=C1F 79640 [0,2,0,0,0,0|1,0,0]=3 767 B11R1.13 NCCC1=CC=CC(F)=C1F Y13621 [0,2,0,0,0,0|2,0,0]=4 768 B11R1.13 OCCC1=CC=CC(F)=C1F A11216 [0,2,0,0,0,0|2,0,0]=4 769 B11R1.72 COC1=C(C)C(C)=NC=C1C C14162 [0,2,0,0,0,0|2,0,0]=4 770 B11R1.72 COC1=C(C)N=CC(Br)=C1O W11207 [0,2,0,0,0,0|1,1,0]=4 771 B11R1.72 COC1=C(Cl)C=CC(Br)=C1Cl AT18855 [0,2,0,0,0,0|1,0,0]=3 772 B11R1.72 COC1=C(F)C(F)=CC=C1N 34413 [0,2,0,0,0,0|1,0,0]=3 773 B11R1.159 CC(=O)C1=C(N)C(C)=CC=C1 W18414 [0,2,0,0,0,0|2,0,0]=4 774 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 24067 [0,2,0,0,0,0|2,0,0]=4 775 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 O10249 [0,2,0,0,0,0|1,1,0]=4 776 B11R1.159 CC(=O)C1=CC=CC(Br)=C1C CL9266 [0,2,0,0,0,0|2,0,0]=4 777 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1N 51210 [0,2,0,0,0,0|2,0,0]=4 778 B11R1.159 CC(=O)C1=CC=CC(F)=C1Br C73097 [0,2,0,0,0,0|2,0,0]=4 779 B11R1.159 CC(=O)C1=CC=CC(N)=C1F C72091 [0,2,0,0,0,0|2,0,0]=4 780 B11R1.159 CC(C)C1=CC=CC(N)=C1F C72489 [0,2,0,0,0,0|2,0,0]=4 781 B11R1.159 CC1=CC=CC(C(C)C)=C1N 77942 [0,2,0,0,0,0|2,0,0]=4 782 B11R1.159 CC1=CC=CC([C@H](C)N)=C1C Y11914 [0,2,0,0,0,0|2,0,0]=4 783 B11R1.159 CC1=CC=CC([C@H](C)N)=C1C Y12440 [0,2,0,0,0,0|2,0,0]=4 784 B11R1.159 CC1=CC=CC([C@H](C)N)=C1Cl Y12291 [0,2,0,0,0,0|2,0,0]=4 785 B11R1.159 CC1=CC=CC([C@H](C)N)=C1Cl Y12292 [0,2,0,0,0,0|2,0,0]=4 786 B11R1.159 CC1=CC=CC([C@H](C)N)=C1Cl Y13233 [0,2,0,0,0,0|2,0,0]=4 787 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1Cl F16890 [0,2,0,0,0,0|2,0,0]=4 788 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F 20057 [0,2,0,0,0,0|2,0,0]=4 789 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F 72338 [0,2,0,0,0,0|2,0,0]=4 790 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F I11007 [0,2,0,0,0,0|2,0,0]=4 791 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F N13159 [0,2,0,0,0,0|2,0,0]=4 792 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F Y10319 [0,2,0,0,0,0|2,0,0]=4 793 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F Y11208 [0,2,0,0,0,0|2,0,0]=4 794 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Cl N10578 [0,2,0,0,0,0|2,0,0]=4 795 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Cl Y11025 [0,2,0,0,0,0|2,0,0]=4 796 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Cl Y11260 [0,2,0,0,0,0|2,0,0]=4 797 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Cl Y11261 [0,2,0,0,0,0|2,0,0]=4 798 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1F 20103 [0,2,0,0,0,0|2,0,0]=4 799 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1F 20105 [0,2,0,0,0,0|2,0,0]=4 800 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1F S12185 [0,2,0,0,0,0|2,0,0]=4 801 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1F Y11584 [0,2,0,0,0,0|2,0,0]=4 802 B11R1.159 C[C@H](O)C1=CC=CC(Br)=C1F 33965 [0,2,0,0,0,0|2,0,0]=4 803 B11R1.265 CNC1=CC=CC(F)=C1C#N C11601 [0,2,0,0,0,0|2,0,0]=4 804 B11R1.265 COC1=C(Br)C=NC=C1C=O C72172 [0,2,0,0,0,0|1,1,0]=4 805 B11R1.265 COC1=C(C#N)C(Br)=NC=C1 W12870 [0,2,0,0,0,0|2,0,0]=4 806 B11R1.265 COC1=C(C#N)C(C)=NC=C1 64420 [0,2,0,0,0,0|2,0,0]=4 807 B11R1.265 COC1=C(C=O)C(Cl)=NC=C1 F17477 [0,2,0,0,0,0|1,1,0]=4 808 B11R1.265 COC1=C(C=O)C=CN=C1Br D94598 [0,2,0,0,0,0|1,1,0]=4 809 B11R1.265 COC1=C(F)C=CC=C1CO 26176 [0,2,0,0,0,0|0,1,0]=3 810 B11R1.265 COC1=C(OC)C(Cl)=NC=C1 D83309 [0,2,0,0,0,0|1,1,0]=4 811 B11R1.265 COC1=CC=CC(I)=C1OC 71532 [0,2,0,0,0,0|0,1,0]=3 812 B11R1.265 COC1=CN=CC(F)=C1C=O 75831 [0,2,0,0,0,0|1,1,0]=4 813 B11R1.265 COC1=NC=CC(Br)=C1C=O C71245 [0,2,0,0,0,0|1,1,0]=4 814 B11R1.265 COC1=NC=CC(Cl)=C1C=O C71046 [0,2,0,0,0,0|1,1,0]=4 815 B11R1.265 COC1=NC=CC(O)=C1OC W10568 [0,2,0,0,0,0|1,1,0]=4 816 B11R1.265 CSC1=C(C#N)C(F)=CC=C1 79515 [0,2,0,0,0,0|1,1,0]=4 817 B11R1.267 COC1=C(Br)C(C#N)=CC=C1 F13391 [0,2,0,0,0,0|1,0,0]=3 818 B11R1.267 COC1=C(Br)C(C=O)=CC=C1 59975 [0,2,0,0,0,0|1,0,0]=3 819 B11R1.267 COC1=C(C)C(CO)=NC=C1 C76823 [0,2,0,0,0,0|2,0,0]=4 820 B11R1.267 COC1=C(F)C(C#N)=CC=N1 C71737 [0,2,0,0,0,0|2,0,0]=4 821 B11R1.267 COC1=C(F)C(CO)=CC=N1 W18529 [0,2,0,0,0,0|2,0,0]=4 822 B11R1.267 COC1=C(I)C(C#N)=CC=N1 C77092 [0,2,0,0,0,0|2,0,0]=4 823 B11R1.267 COC1=C(N)C(C#N)=CC=C1 35235 [0,2,0,0,0,0|1,0,0]=3 824 B11R1.267 COC1=C(N)C(CO)=CC=C1 C73902 [0,2,0,0,0,0|1,0,0]=3 825 B11R1.267 COC1=CC=CC(C=O)=C1C CL9336 [0,2,0,0,0,0|1,0,0]=3 826 B11R1.267 COC1=CC=CC(OC)=C1Cl F14475 [0,2,0,0,0,0|1,0,0]=3 827 B11R1.267 COC1=CC=NC(C#N)=C1F S10200 [0,2,0,0,0,0|2,0,0]=4 828 B11R1.267 COC1=CN=CC(OC)=C1Br C10138 [0,2,0,0,0,0|2,0,0]=4 829 B11R1.267 COC1=NC=CC(OC)=C1N 79443 [0,2,0,0,0,0|2,0,0]=4 830 B11R1.278 COC1=C(Br)C(=O)N(C)C=C1 79096 [0,2,0,0,0,0|2,0,0]=4 831 B11R1.278 COC1=C(Br)C(C)=C(Br)C=N1 I10975 [0,2,0,0,0,0|2,0,0]=4 832 B11R1.278 COC1=C(Br)C(C)=C(Cl)C=N1 I10048 [0,2,0,0,0,0|2,0,0]=4 833 B11R1.278 COC1=C(Br)C(N)=C(Br)C=N1 N10073 [0,2,0,0,0,0|2,0,0]=4 834 B11R1.278 COC1=C(N)C(N)=C(Br)C=C1 79359 [0,2,0,0,0,0|1,0,0]=3 835 B11R1.278 COC1=C(O)C(F)=C(Br)C=C1 W18484 [0,2,0,0,0,0|0,1,0]=3 836 B11R1.278 COC1=C(O)C(O)=C(Br)C=C1 91389 [0,2,0,0,0,0|0,1,0]=3 837 B11R1.278 COC1=CC=C(Cl)C(F)=C1I 83746 [0,2,0,0,0,0|1,0,0]=3 838 B11R1.278 COC1=CC=C(Cl)C(N)=C1Br F14367 [0,2,0,0,0,0|1,0,0]=3 839 B11R1.278 COC1=CC=C(Cl)C(N)=C1Cl A12632 [0,2,0,0,0,0|1,0,0]=3 840 B11R1.278 COC1=CC=C(F)C(N)=C1Cl 88547 [0,2,0,0,0,0|1,0,0]=3 841 B11R1.278 COC1=CC=C(O)C(Cl)=C1O Y14116 [0,2,0,0,0,0|0,1,0]=3 842 B11R1.17 C#CCOC1=C(O)C=CC=C1 W16056 [0,2,0,0,0,0|0,1,0]=3 843 B11R1.17 C=CCCC1=C(Br)C=CC=C1 20639 [0,2,0,0,0,0|2,0,0]=4 844 B11R1.17 C=CCOC1=C(O)C=CC=C1 H11445 [0,2,0,0,0,0|0,1,0]=3 845 B11R1.17 CC1=C(NCCO)C=CC=C1 29426 [0,2,0,0,0,0|2,0,0]=4 846 B11R1.17 CC1=C(OCCBr)C=CC=C1 71086 [0,2,0,0,0,0|1,0,0]=3 847 B11R1.17 CCNCC1=C(O)C=CC=C1 AC1355 [0,2,0,0,0,0|1,1,0]=4 848 B11R1.17 COCCC1=C(O)C=CC=C1 D94967 [0,2,0,0,0,0|0,1,0]=3 849 B11R1.17 COCOC1=C(I)C=CN=C1 W18233 [0,2,0,0,0,0|2,0,0]=4 850 B11R1.17 FC1=C(CCCBr)C=CC=C1 AB10312 [0,2,0,0,0,0|2,0,0]=4 851 B11R1.17 FC1=C(OCCBr)C=CC=C1 F50418 [0,2,0,0,0,0|1,0,0]=3 852 B11R1.17 NC1=C(CCCO)C=CC=C1 Y12219 [0,2,0,0,0,0|2,0,0]=4 853 B11R1.17 NCCCC1=C(Br)C=CC=C1 AC1659 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.17 O=CCCC1=C(Cl)C=CC=C1 20776 [0,2,0,0,0,0|2,0,0]=4 855 B11R1.17 OCCCC1=C(Cl)C=CC=C1 AB3571 [0,2,0,0,0,0|2,0,0]=4 856 B11R1.17 OCCCC1=C(F)C=CC=C1 AB3823 [0,2,0,0,0,0|2,0,0]=4 857 B11R1.41 CCSC1=C(C=O)C=CC=C1 W12314 [0,2,0,0,0,0|0,2,0]=4 858 B11R1.41 CNCC1=C(CO)C=CC=C1 31935 [0,2,0,0,0,0|1,1,0]=4 859 B11R1.41 COC1=C(CC=O)C=CC=C1 29933 [0,2,0,0,0,0|0,1,0]=3 860 B11R1.41 COC1=C(CCN)C=CC=C1 C11486 [0,2,0,0,0,0|1,0,0]=3 861 B11R1.41 COC1=C(CCN)C=CN=C1 F13309 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.41 COC1=C(CCN)C=CN=C1 W19534 [0,2,0,0,0,0|2,0,0]=4 863 B11R1.41 COC1=C(CCO)N=CC=C1 52931 [0,2,0,0,0,0|1,1,0]=4 864 B11R1.41 COCC1=C(C=O)C=CC=C1 A11867 [0,2,0,0,0,0|0,1,0]=3 865 B11R1.41 N#CC1=C(CCBr)C=CC=C1 C71089 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.81 CCCC1=C(O)C=C(O)C=C1 C73634 [0,2,0,0,0,0|1,1,0]=4 867 B11R1.81 CCOC1=C(C)N=C(N)C=C1 O11421 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.81 CCOC1=C(Cl)C=C(N)C=C1 C75445 [0,2,0,0,0,0|1,0,0]=3 869 B11R1.81 CCOC1=C(F)C=C(N)C=N1 26695 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.81 CCOC1=C(F)C=C(O)C=C1 36938 [0,2,0,0,0,0|1,0,0]=3 871 B11R1.81 COCC1=C(Br)C=C(F)C=C1 N11828 [0,2,0,0,0,0|1,0,0]=3 872 B11R1.81 COCC1=C(F)C=C(N)C=C1 I10129 [0,2,0,0,0,0|1,0,0]=3 873 B11R1.81 COCC1=C(N)C=C(Br)C=C1 CL9392 [0,2,0,0,0,0|1,0,0]=3 874 B11R1.81 COCC1=CC=C(Cl)N=C1Cl W10447 [0,2,0,0,0,0|2,0,0]=4 875 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 O10665 [0,2,0,0,0,0|2,0,0]=4 876 B11R1.81 ClC1=CC(Cl)=C(CCBr)C=C1 C77752 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.81 OCCC1=C(Cl)C=C(Br)C=C1 F50644 [0,2,0,0,0,0|2,0,0]=4 878 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 CL8845 [0,2,0,0,0,0|2,0,0]=4 879 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 AR2168 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.86 CC(C)OC1=C(O)C=CC=C1 D71146 [0,2,0,0,0,0|0,1,0]=3 881 B11R1.86 C[C@H](N)CC1=C(F)C=CC=C1 N10828 [0,2,0,0,0,0|2,0,0]=4 882 B11R1.86 C[C@H](O)CC1=C(Cl)C=CC=C1 D84375 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.86 FC(F)OC1=C(Br)C=CC=N1 C71784 [0,2,0,0,0,0|2,0,0]=4 884 B11R1.86 FC(F)OC1=CC=CN=C1Cl 33631 [0,2,0,0,0,0|2,0,0]=4 885 B11R1.86 NC1=CC=CN=C1OC(F)F C71783 [0,2,0,0,0,0|2,0,0]=4 886 B11R1.182 CCOC1=C(Br)C=CC(Cl)=N1 D83089 [0,2,0,0,0,0|2,0,0]=4 887 B11R1.182 CCOC1=C(Br)C=NC(Cl)=C1 D70594 [0,2,0,0,0,0|2,0,0]=4 888 B11R1.182 CCOC1=CC(Cl)=NC=C1N C76855 [0,2,0,0,0,0|2,0,0]=4 889 B11R1.182 CNCC1=C(O)C=CC(Cl)=C1 31930 [0,2,0,0,0,0|1,1,0]=4 890 B11R1.182 CNCC1=C(O)C=CC(F)=C1 32252 [0,2,0,0,0,0|1,1,0]=4 891 B11R1.182 COCC1=C(F)C=CC(Br)=C1 N10199 [0,2,0,0,0,0|1,0,0]=3 892 B11R1.182 COCC1=C(N)C=CC(N)=C1 C74735 [0,2,0,0,0,0|1,0,0]=3 893 B11R1.182 OCCC1=C(F)C=CC(F)=C1 A50721 [0,2,0,0,0,0|2,0,0]=4 894 B11R1.182 OCCC1=C(O)C=CC(Br)=C1 W15209 [0,2,0,0,0,0|1,1,0]=4 895 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D80972 [0,2,0,0,0,0|2,0,0]=4 896 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D81235 [0,2,0,0,0,0|2,0,0]=4 897 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N11177 [0,2,0,0,0,0|2,0,0]=4 898 B11R1.222 CC1=C([C@@H](O)CN)C=CC=C1 AR2909 [0,2,0,0,0,0|2,0,0]=4 899 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 20083 [0,2,0,0,0,0|2,0,0]=4 900 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 F16885 [0,2,0,0,0,0|2,0,0]=4 901 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 N10518 [0,2,0,0,0,0|2,0,0]=4 902 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 N10519 [0,2,0,0,0,0|2,0,0]=4 903 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 Y10722 [0,2,0,0,0,0|2,0,0]=4 904 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10294 [0,2,0,0,0,0|2,0,0]=4 905 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10295 [0,2,0,0,0,0|2,0,0]=4 906 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10316 [0,2,0,0,0,0|2,0,0]=4 907 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y11207 [0,2,0,0,0,0|2,0,0]=4 908 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y11964 [0,2,0,0,0,0|2,0,0]=4 909 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 S10041 [0,2,0,0,0,0|2,0,0]=4 910 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 Y10807 [0,2,0,0,0,0|2,0,0]=4 911 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14154 [0,2,0,0,0,0|1,1,0]=4 912 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14523 [0,2,0,0,0,0|1,1,0]=4 913 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N13149 [0,2,0,0,0,0|2,0,0]=4 914 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y11428 [0,2,0,0,0,0|2,0,0]=4 915 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y11555 [0,2,0,0,0,0|2,0,0]=4 916 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y12189 [0,2,0,0,0,0|2,0,0]=4 917 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y13379 [0,2,0,0,0,0|2,0,0]=4 918 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y14597 [0,2,0,0,0,0|2,0,0]=4 919 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 H11712 [0,2,0,0,0,0|2,0,0]=4 920 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 N12637 [0,2,0,0,0,0|2,0,0]=4 921 B11R1.222 COC(=O)C1=C(Br)C=CN=C1 I11422 [0,2,0,0,0,0|2,0,0]=4 922 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 26180 [0,2,0,0,0,0|2,0,0]=4 923 B11R1.222 COC(=O)C1=C(O)C=CN=C1 F30285 [0,2,0,0,0,0|1,1,0]=4 924 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 W19004 [0,2,0,0,0,0|1,1,0]=4 925 B11R1.222 NC[C@H](O)C1=C(Cl)C=CC=C1 AC1512 [0,2,0,0,0,0|2,0,0]=4 926 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81268 [0,2,0,0,0,0|2,0,0]=4 927 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81404 [0,2,0,0,0,0|2,0,0]=4 928 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12047 [0,2,0,0,0,0|2,0,0]=4 929 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12048 [0,2,0,0,0,0|2,0,0]=4 930 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11089 [0,2,0,0,0,0|2,0,0]=4 931 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11090 [0,2,0,0,0,0|2,0,0]=4 932 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y10773 [0,2,0,0,0,0|2,0,0]=4 933 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y13361 [0,2,0,0,0,0|2,0,0]=4 934 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 D83963 [0,2,0,0,0,0|2,0,0]=4 935 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11002 [0,2,0,0,0,0|2,0,0]=4 936 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11143 [0,2,0,0,0,0|2,0,0]=4 937 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y10336 [0,2,0,0,0,0|2,0,0]=4 938 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y12049 [0,2,0,0,0,0|2,0,0]=4 939 B11R1.222 O=C(CF)C1=C(F)C=CC=C1 75535 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.222 O=C(CO)C1=C(Cl)C=CC=C1 AC1212 [0,2,0,0,0,0|2,0,0]=4 941 B11R1.605 CCNC1=C(Cl)C=CC=C1Cl AB1378 [0,2,0,0,0,0|2,0,0]=4 942 B11R1.605 CNCC1=C(Cl)C=CC=C1Cl 23581 [0,2,0,0,0,0|2,0,0]=4 943 B11R1.37 CCC1=C(C=O)C=C(Br)C=C1 CL9497 [0,2,0,0,0,0|1,1,0]=4 944 B11R1.37 CCC1=C(C=O)C=CC(Cl)=C1 CK2098 [0,2,0,0,0,0|1,1,0]=4 945 B11R1.37 CCC1=C(CO)C=C(Br)C=C1 C13891 [0,2,0,0,0,0|1,1,0]=4 946 B11R1.37 CCC1=C(OC)C=CC(Br)=C1 C74737 [0,2,0,0,0,0|1,0,0]=3 947 B11R1.37 COC1=C(C#N)C=CC(Br)=N1 D92854 [0,2,0,0,0,0|2,0,0]=4 948 B11R1.37 COC1=C(C#N)C=CC(Cl)=N1 32018 [0,2,0,0,0,0|2,0,0]=4 949 B11R1.37 COC1=C(C#N)N=C(C)C=C1 F50991 [0,2,0,0,0,0|2,0,0]=4 950 B11R1.37 COC1=C(C=O)C=C(I)C=C1 63781 [0,2,0,0,0,0|0,1,0]=3 951 B11R1.37 COC1=C(C=O)C=C(O)C=C1 C74824 [0,2,0,0,0,0|0,1,0]=3 952 B11R1.37 COC1=C(C=O)C=CC(Br)=N1 Y11346 [0,2,0,0,0,0|1,1,0]=4 953 B11R1.37 COC1=C(C=O)C=CC(Br)=N1 Y11347 [0,2,0,0,0,0|1,1,0]=4 954 B11R1.37 COC1=C(C=O)N=C(Br)C=C1 36281 [0,2,0,0,0,0|1,1,0]=4 955 B11R1.37 COC1=C(CBr)C=C(Cl)C=C1 72125 [0,2,0,0,0,0|1,0,0]=3 956 B11R1.37 COC1=C(CBr)C=CC(Br)=N1 D80185 [0,2,0,0,0,0|2,0,0]=4 957 B11R1.37 COC1=C(CCl)C=C(Cl)C=C1 71375 [0,2,0,0,0,0|1,0,0]=3 958 B11R1.37 COC1=C(CN)C=C(Br)C=C1 F20543 [0,2,0,0,0,0|1,0,0]=3 959 B11R1.37 COC1=C(CN)C=C(Cl)C=C1 C74800 [0,2,0,0,0,0|1,0,0]=3 960 B11R1.37 COC1=C(CN)C=C(Cl)C=C1 O10127 [0,2,0,0,0,0|1,0,0]=3 961 B11R1.37 COC1=C(CN)C=C(F)C=C1 N12548 [0,2,0,0,0,0|1,0,0]=3 962 B11R1.37 COC1=C(CN)C=C(N)C=C1 O10877 [0,2,0,0,0,0|1,0,0]=3 963 B11R1.37 COC1=C(CN)C=CC(Br)=N1 N10742 [0,2,0,0,0,0|2,0,0]=4 964 B11R1.37 COC1=C(CN)C=CC(Br)=N1 Y11170 [0,2,0,0,0,0|2,0,0]=4 965 B11R1.37 COC1=C(CO)C=C(C)C=C1 A12781 [0,2,0,0,0,0|0,1,0]=3 966 B11R1.37 COC1=C(CO)C=C(Cl)C=C1 20565 [0,2,0,0,0,0|0,1,0]=3 967 B11R1.37 COC1=C(CO)C=CC(Br)=N1 N10745 [0,2,0,0,0,0|1,1,0]=4 968 B11R1.37 COC1=C(CO)C=CC(O)=C1 C71627 [0,2,0,0,0,0|0,1,0]=3 969 B11R1.37 COC1=C(NN)C=CC(Cl)=C1 W17153 [0,2,0,0,0,0|1,0,0]=3 970 B11R1.37 COC1=C(OC)C=C(N)N=C1 S10461 [0,2,0,0,0,0|1,1,0]=4 971 B11R1.37 COC1=C(SC)C=C(Br)C=C1 F15582 [0,2,0,0,0,0|0,0,0]=2 972 B11R1.37 COC1=C(SC)C=CC(N)=C1 72379 [0,2,0,0,0,0|0,0,0]=2 973 B11R1.37 COC1=CC(Br)=CN=C1C#N F30222 [0,2,0,0,0,0|2,0,0]=4 974 B11R1.37 COC1=CC(Br)=CN=C1C=O 97692 [0,2,0,0,0,0|1,1,0]=4 975 B11R1.37 COC1=CC(Br)=CN=C1OC 82178 [0,2,0,0,0,0|1,1,0]=4 976 B11R1.37 COC1=CC(C)=CN=C1OC C71876 [0,2,0,0,0,0|1,1,0]=4 977 B11R1.37 COC1=CC(Cl)=NC=C1C=O F20646 [0,2,0,0,0,0|1,1,0]=4 978 B11R1.37 COC1=CC(Cl)=NC=C1CO D75692 [0,2,0,0,0,0|1,1,0]=4 979 B11R1.37 COC1=NC=C(Br)C=C1CO P11193 [0,2,0,0,0,0|1,1,0]=4 980 B11R1.37 COC1=NC=C(Cl)C=C1C#N D79770 [0,2,0,0,0,0|2,0,0]=4 981 B11R1.53 C#CC1=C(C(C)=O)C=CC=C1 79244 [0,2,0,0,0,0|2,0,0]=4 982 B11R1.53 CC(C)C1=C(CBr)C=CC=C1 39100 [0,2,0,0,0,0|2,0,0]=4 983 B11R1.53 CCC1=C(C(C)=O)C=CC=C1 A10857 [0,2,0,0,0,0|1,1,0]=4 984 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y11921 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y11922 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y12590 [0,2,0,0,0,0|2,0,0]=4 987 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y12977 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.53 CN(C)C1=C(CN)C=CC=C1 C16014 [0,2,0,0,0,0|2,0,0]=4 989 B11R1.53 CN(C)C1=C(CO)C=CC=C1 W18685 [0,2,0,0,0,0|1,1,0]=4 990 B11R1.53 CNC1=C(C(C)=O)C=CC=C1 C73575 [0,2,0,0,0,0|1,1,0]=4 991 B11R1.53 COC1=C(B(O)O)C=NC=C1 63100 [0,2,0,0,0,0|1,1,0]=4 992 B11R1.53 COC1=C(C(=N)N)C=CC=C1 71596 [0,2,0,0,0,0|1,0,0]=3 993 B11R1.53 COC1=C(C(C)=O)C=CC=N1 32755 [0,2,0,0,0,0|1,1,0]=4 994 B11R1.53 COC1=C(C(C)=O)C=CN=C1 C76667 [0,2,0,0,0,0|1,1,0]=4 995 B11R1.53 COC1=C(C(C)=O)C=NC=C1 CS1683 [0,2,0,0,0,0|1,1,0]=4 996 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 52750 [0,2,0,0,0,0|1,0,0]=3 997 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 F16921 [0,2,0,0,0,0|1,0,0]=3 998 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 N10418 [0,2,0,0,0,0|1,0,0]=3 999 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 Y10162 [0,2,0,0,0,0|1,0,0]=3 1000 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 Y10512 [0,2,0,0,0,0|1,0,0]=3 1001 B11R1.53 COC1=NC=CC=C1[C@H](C)N Y12492 [0,2,0,0,0,0|2,0,0]=4 1002 B11R1.53 COC1=NC=CC=C1[C@H](C)O CS1968 [0,2,0,0,0,0|1,1,0]=4 1003 B11R1.53 CSC1=C([N+](=O)[O-])C=CC=C1 C74572 [0,2,0,0,0,0|0,2,0]=4 1004 B11R1.53 C[C@H](N)C1=C(C#N)C=CC=C1 Y12201 [0,2,0,0,0,0|2,0,0]=4 1005 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 77817 [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.166 CC(=O)C1=C(Br)C=C(N)C=C1 34088 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 52517 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 I12065 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 W18192 [0,2,0,0,0,0|2,0,0]=4 1010 B11R1.166 CC(C)C1=C(O)C=C(N)C=C1 F51191 [0,2,0,0,0,0|1,1,0]=4 1011 B11R1.166 CC1=C(C(C)C)C=CC(N)=C1 A12536 [0,2,0,0,0,0|2,0,0]=4 1012 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y10861 [0,2,0,0,0,0|2,0,0]=4 1013 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y10895 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y11476 [0,2,0,0,0,0|2,0,0]=4 1015 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y11477 [0,2,0,0,0,0|2,0,0]=4 1016 B11R1.166 CC1=C([C@H](C)N)C=CC(F)=C1 Y11919 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.166 CC1=C([C@H](C)N)C=CC(F)=C1 Y11920 [0,2,0,0,0,0|2,0,0]=4 1018 B11R1.166 CC1=C([C@H](C)N)C=CC(F)=C1 Y12621 [0,2,0,0,0,0|2,0,0]=4 1019 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 Y11487 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81528 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.166 C[C@H](N)C1=C(Br)C=C(F)C=C1 20177 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=C1 D81223 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=C1 Y10218 [0,2,0,0,0,0|2,0,0]=4 1024 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=C1 Y10360 [0,2,0,0,0,0|2,0,0]=4 1025 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 D80666 [0,2,0,0,0,0|2,0,0]=4 1026 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 D81664 [0,2,0,0,0,0|2,0,0]=4 1027 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 41021 [0,2,0,0,0,0|2,0,0]=4 1028 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 41031 [0,2,0,0,0,0|2,0,0]=4 1029 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 N10675 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 N10686 [0,2,0,0,0,0|2,0,0]=4 1031 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 Y10648 [0,2,0,0,0,0|2,0,0]=4 1032 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 Y11061 [0,2,0,0,0,0|2,0,0]=4 1033 B11R1.166 C[C@H](N)C1=C(F)C=C(Cl)C=C1 N16827 [0,2,0,0,0,0|2,0,0]=4 1034 B11R1.166 C[C@H](N)C1=C(F)C=C(Cl)C=C1 N16937 [0,2,0,0,0,0|2,0,0]=4 1035 B11R1.166 C[C@H](N)C1=C(F)C=C(Cl)C=C1 N17056 [0,2,0,0,0,0|2,0,0]=4 1036 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 N10465 [0,2,0,0,0,0|2,0,0]=4 1037 B11R1.277 CCC1=CC(F)=C(F)C=C1N 75978 [0,2,0,0,0,0|2,0,0]=4 1038 B11R1.277 COC1=C(Br)C=C(Cl)C(N)=C1 F14461 [0,2,0,0,0,0|1,0,0]=3 1039 B11R1.277 COC1=C(Br)C=C(N)C(N)=C1 AC2864 [0,2,0,0,0,0|1,0,0]=3 1040 B11R1.277 COC1=C(Cl)C=C(C)C(N)=C1 F51099 [0,2,0,0,0,0|1,0,0]=3 1041 B11R1.277 COC1=C(Cl)C=C(Cl)C(Cl)=N1 C74623 [0,2,0,0,0,0|2,0,0]=4 1042 B11R1.277 COC1=C(F)C=C(O)C(F)=C1 D85907 [0,2,0,0,0,0|1,0,0]=3 1043 B11R1.277 COC1=C(I)C=C(F)C(Br)=C1 D86112 [0,2,0,0,0,0|1,0,0]=3 1044 B11R1.277 COC1=C(I)C=C(I)C(N)=C1 N10276 [0,2,0,0,0,0|1,0,0]=3 1045 B11R1.277 COC1=CC(Br)=C(C)N=C1N 84361 [0,2,0,0,0,0|2,0,0]=4 1046 B11R1.277 COC1=CC(Br)=C(F)C=C1Cl 56088 [0,2,0,0,0,0|1,0,0]=3 1047 B11R1.277 COC1=CC(Br)=C(F)C=C1O 34437 [0,2,0,0,0,0|0,1,0]=3 1048 B11R1.277 COC1=CC(C)=C(Br)C=C1Cl I10816 [0,2,0,0,0,0|1,0,0]=3 1049 B11R1.277 COC1=CC(Cl)=C(I)C=C1N W13074 [0,2,0,0,0,0|1,0,0]=3 1050 B11R1.277 COC1=CC(N)=C(Br)C=C1C CL9341 [0,2,0,0,0,0|1,0,0]=3 1051 B11R1.277 COC1=CC(N)=C(Br)C=C1Cl 68730 [0,2,0,0,0,0|1,0,0]=3 1052 B11R1.277 COC1=CC(N)=C(I)C=C1Cl 50057 [0,2,0,0,0,0|1,0,0]=3 1053 B11R1.279 CCC1=CC(N)=C(OC)C=C1 W16778 [0,2,0,0,0,0|1,0,0]=3 1054 B11R1.279 CCC1=CC(O)=C(OC)C=C1 O11426 [0,2,0,0,0,0|0,1,0]=3 1055 B11R1.279 COC1=C(Br)C=C(C=O)C=N1 F12246 [0,2,0,0,0,0|2,0,0]=4 1056 B11R1.279 COC1=C(C)C=C(CO)C=C1 D87344 [0,2,0,0,0,0|1,0,0]=3 1057 B11R1.279 COC1=C(Cl)C=C(CCl)C=C1 N12801 [0,2,0,0,0,0|1,0,0]=3 1058 B11R1.279 COC1=C(F)C=C(C=O)C=N1 24822 [0,2,0,0,0,0|2,0,0]=4 1059 B11R1.279 COC1=C(N)C=C(C#N)C=C1 50134 [0,2,0,0,0,0|1,0,0]=3 1060 B11R1.279 COC1=C(N)C=C(CO)C=C1 74962 [0,2,0,0,0,0|1,0,0]=3 1061 B11R1.279 COC1=C(O)C=C(CO)N=C1 79208 [0,2,0,0,0,0|1,1,0]=4 1062 B11R1.279 COC1=CC(Br)=C(OC)C=N1 W13564 [0,2,0,0,0,0|2,0,0]=4 1063 B11R1.279 COC1=CC(O)=C(OC)C=C1 25077 [0,2,0,0,0,0|0,1,0]=3 1064 B11R1.279 COC1=CC=C(C=O)N=C1Br W17199 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.279 COC1=CC=C(CO)N=C1Cl W17845 [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.279 COC1=NC=C(C=O)C=C1C 72229 [0,2,0,0,0,0|2,0,0]=4 1067 B11R1.279 COC1=NC=C(CO)C=C1C 72276 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.464 COC1=C(C)N=C(Cl)C=C1Cl P11221 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.464 COC1=C(Cl)C=C(Cl)C=C1N I11279 [0,2,0,0,0,0|1,0,0]=3 1070 B11R1.464 COC1=C(Cl)N=C(Br)C=C1C C72603 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.167 CC(=O)C1=C(Br)C=CC(C)=C1 24153 [0,2,0,0,0,0|2,0,0]=4 1072 B11R1.167 CC(=O)C1=C(Br)C=CC(O)=C1 72605 [0,2,0,0,0,0|2,0,0]=4 1073 B11R1.167 CC(=O)C1=C(C)C=CC(O)=C1 N14343 [0,2,0,0,0,0|2,0,0]=4 1074 B11R1.167 CC(=O)C1=C(Cl)C=CC(N)=C1 AC8788 [0,2,0,0,0,0|2,0,0]=4 1075 B11R1.167 CC(=O)C1=C(Cl)C=CC(O)=C1 98261 [0,2,0,0,0,0|2,0,0]=4 1076 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 52903 [0,2,0,0,0,0|2,0,0]=4 1077 B11R1.167 CC(C)C1=C(F)C=CC(I)=C1 C72486 [0,2,0,0,0,0|2,0,0]=4 1078 B11R1.167 CC(C)C1=C(O)C=CC(O)=C1 S10162 [0,2,0,0,0,0|1,1,0]=4 1079 B11R1.167 CC1=C([C@H](C)N)C=C(F)C=C1 Y12032 [0,2,0,0,0,0|2,0,0]=4 1080 B11R1.167 CC1=C([C@H](C)N)C=C(F)C=C1 Y12589 [0,2,0,0,0,0|2,0,0]=4 1081 B11R1.167 CC1=C([C@H](C)N)C=C(F)C=C1 Y12591 [0,2,0,0,0,0|2,0,0]=4 1082 B11R1.167 CC1=CC([C@H](C)N)=C(C)C=C1 N13078 [0,2,0,0,0,0|2,0,0]=4 1083 B11R1.167 CN(C)C1=C(I)C=CC(O)=C1 C71961 [0,2,0,0,0,0|2,0,0]=4 1084 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 90613 [0,2,0,0,0,0|2,0,0]=4 1085 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 Y11887 [0,2,0,0,0,0|2,0,0]=4 1086 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 Y11893 [0,2,0,0,0,0|2,0,0]=4 1087 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 71504 [0,2,0,0,0,0|2,0,0]=4 1088 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 Y11772 [0,2,0,0,0,0|2,0,0]=4 1089 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 Y11773 [0,2,0,0,0,0|2,0,0]=4 1090 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12588 [0,2,0,0,0,0|2,0,0]=4 1091 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(F)=C1 Y13292 [0,2,0,0,0,0|2,0,0]=4 1092 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 20059 [0,2,0,0,0,0|2,0,0]=4 1093 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 N10677 [0,2,0,0,0,0|2,0,0]=4 1094 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 N13034 [0,2,0,0,0,0|2,0,0]=4 1095 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 Y10450 [0,2,0,0,0,0|2,0,0]=4 1096 B11R1.167 C[C@H](N)C1=C(F)C=CC(F)=C1 94482 [0,2,0,0,0,0|2,0,0]=4 1097 B11R1.167 C[C@H](N)C1=C(F)C=CC(F)=C1 94483 [0,2,0,0,0,0|2,0,0]=4 1098 B11R1.167 C[C@H](N)C1=C(F)C=CC(F)=C1 N12219 [0,2,0,0,0,0|2,0,0]=4 1099 B11R1.167 C[C@H](N)C1=C(F)C=CC(F)=C1 Y11205 [0,2,0,0,0,0|2,0,0]=4 1100 B11R1.167 C[C@H](N)C1=C(F)C=CC(F)=C1 Y11544 [0,2,0,0,0,0|2,0,0]=4 1101 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 Y11757 [0,2,0,0,0,0|1,1,0]=4 1102 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 Y11758 [0,2,0,0,0,0|1,1,0]=4 1103 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 Y12285 [0,2,0,0,0,0|1,1,0]=4 1104 B11R1.167 C[C@H](O)C1=C(I)C=CC(F)=C1 C91309 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.280 CCC1=C(Br)C=CC(OC)=C1 72075 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.280 CCC1=C(F)C=CC(CO)=C1 F31368 [0,2,0,0,0,0|2,0,0]=4 1107 B11R1.280 CNC1=CC(OC)=C(F)C=C1 D94417 [0,2,0,0,0,0|1,0,0]=3 1108 B11R1.280 COC1=C(Br)C=CC(C#N)=N1 96347 [0,2,0,0,0,0|2,0,0]=4 1109 B11R1.280 COC1=C(Br)C=CC(CBr)=C1 F52556 [0,2,0,0,0,0|1,0,0]=3 1110 B11R1.280 COC1=C(Br)C=NC(CO)=C1 54903 [0,2,0,0,0,0|2,0,0]=4 1111 B11R1.280 COC1=C(C)C=CC(CN)=C1 78978 [0,2,0,0,0,0|1,0,0]=3 1112 B11R1.280 COC1=C(C)C=CC(CN)=C1 N12583 [0,2,0,0,0,0|1,0,0]=3 1113 B11R1.280 COC1=C(Cl)C=CC(C=O)=N1 D80224 [0,2,0,0,0,0|2,0,0]=4 1114 B11R1.280 COC1=C(Cl)C=CC(CBr)=C1 76075 [0,2,0,0,0,0|1,0,0]=3 1115 B11R1.280 COC1=C(Cl)C=CC(CN)=C1 76074 [0,2,0,0,0,0|1,0,0]=3 1116 B11R1.280 COC1=C(Cl)C=CC(CO)=C1 VT1204 [0,2,0,0,0,0|1,0,0]=3 1117 B11R1.280 COC1=C(Cl)C=CC(NN)=C1 AT23120 [0,2,0,0,0,0|1,0,0]=3 1118 B11R1.280 COC1=C(Cl)C=CC(NN)=C1 F17081 [0,2,0,0,0,0|1,0,0]=3 1119 B11R1.280 COC1=C(F)C=CC(NN)=C1 AB9353 [0,2,0,0,0,0|1,0,0]=3 1120 B11R1.280 COC1=C(N)C=CC(C=O)=C1 C90569 [0,2,0,0,0,0|1,0,0]=3 1121 B11R1.280 COC1=C(N)C=CC(CO)=C1 F20106 [0,2,0,0,0,0|1,0,0]=3 1122 B11R1.280 COC1=CC(C=O)=CN=C1F P18769 [0,2,0,0,0,0|2,0,0]=4 1123 B11R1.280 COC1=CC(OC)=C(N)N=C1 28153 [0,2,0,0,0,0|2,0,0]=4 1124 B11R1.280 COC1=CC(OC)=NC=C1N 28154 [0,2,0,0,0,0|2,0,0]=4 1125 B11R1.87 CC(C)(C)C1=C(Br)C=CC=C1 C76258 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.87 CC(C)(N)C1=C(Br)C=CC=C1 Y10933 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.87 CS(=O)(=O)C1=C(N)C=CC=C1 AC1456 [0,2,0,0,0,0|1,1,0]=4 1128 B11R1.87 C[Si](C)(C)C1=C(F)C=CC=C1 AC4958 [0,2,0,0,0,0|2,0,0]=4 1129 B11R1.156 CC(=O)C1=C(F)C=CC=C1C CL9504 [0,2,0,0,0,0|2,0,0]=4 1130 B11R1.156 CC(=O)C1=C(F)C=CC=C1N C76841 [0,2,0,0,0,0|2,0,0]=4 1131 B11R1.156 CC(=O)C1=C(O)C=CC=C1C CL9444 [0,2,0,0,0,0|1,1,0]=4 1132 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N 20079 [0,2,0,0,0,0|2,0,0]=4 1133 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N 20081 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N D80841 [0,2,0,0,0,0|2,0,0]=4 1135 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N F16983 [0,2,0,0,0,0|2,0,0]=4 1136 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N Y11055 [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1Cl Y12650 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1Cl Y12651 [0,2,0,0,0,0|2,0,0]=4 1139 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1Cl Y13244 [0,2,0,0,0,0|2,0,0]=4 1140 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl 71000 [0,2,0,0,0,0|2,0,0]=4 1141 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl 73349 [0,2,0,0,0,0|2,0,0]=4 1142 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl 73350 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl Y10531 [0,2,0,0,0,0|2,0,0]=4 1144 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl Y10765 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl Y10926 [0,2,0,0,0,0|2,0,0]=4 1146 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F I10857 [0,2,0,0,0,0|2,0,0]=4 1147 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F N10469 [0,2,0,0,0,0|2,0,0]=4 1148 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F N10676 [0,2,0,0,0,0|2,0,0]=4 1149 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F Y10302 [0,2,0,0,0,0|2,0,0]=4 1150 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F Y10460 [0,2,0,0,0,0|2,0,0]=4 1151 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F Y10644 [0,2,0,0,0,0|2,0,0]=4 1152 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F 20101 [0,2,0,0,0,0|2,0,0]=4 1153 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F N10466 [0,2,0,0,0,0|2,0,0]=4 1154 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F Y11206 [0,2,0,0,0,0|2,0,0]=4 1155 B9R1.11 COC(=O)C1=CC=NS1 62854 [0,0,1,1,0,0|2,0,0]=4 1156 B11R2.106 BrC1=C2C=NOC2=CC=C1 27210 [0,1,0,1,0,0|2,0,0]=4 1157 B11R2.106 BrC1=C2CCCC2=CC=C1 38090 [0,1,0,1,0,0|2,0,0]=4 1158 B11R2.106 BrC1=C2OCOC2=CC=C1 67234 [0,1,0,1,0,0|0,1,0]=3 1159 B11R2.106 BrC1=C2ON=CC2=CC=C1 38088 [0,1,0,1,0,0|1,0,1]=4 1160 B11R2.106 BrC1=C2SN=NC2=CC=C1 F30547 [0,1,0,1,0,0|2,0,0]=4 1161 B11R2.106 CC1=C2CCCC2=CC=C1 Y11654 [0,1,0,1,0,0|2,0,0]=4 1162 B11R2.106 CC1=CC=CC2=C1C=CS2 C72689 [0,1,0,1,0,0|1,0,1]=4 1163 B11R2.106 ClC1=C2CCOC2=CC=C1 52389 [0,1,0,1,0,0|1,0,0]=3 1164 B11R2.106 ClC1=C2CNCC2=CC=C1 SC1314 [0,1,0,1,0,0|2,0,0]=4 1165 B11R2.106 ClC1=C2N=COC2=CC=C1 D76689 [0,1,0,1,0,0|1,0,1]=4 1166 B11R2.106 ClC1=C2N=CSC2=CC=C1 25561 [0,1,0,1,0,0|1,0,1]=4 1167 B11R2.106 ClC1=C2OC=CC2=CC=C1 AC5711 [0,1,0,1,0,0|1,0,1]=4 1168 B11R2.106 ClC1=C2SC=CC2=CC=C1 82930 [0,1,0,1,0,0|1,0,1]=4 1169 B11R2.106 FC1=C2CCCC2=CC=C1 Y12594 [0,1,0,1,0,0|2,0,0]=4 1170 B11R2.106 FC1=C2N=COC2=CC=C1 AC4244 [0,1,0,1,0,0|1,0,1]=4 1171 B11R2.106 FC1=C2OC=CC2=CC=C1 52893 [0,1,0,1,0,0|1,0,1]=4 1172 B11R2.106 FC1=C2SC=CC2=CC=C1 F13949 [0,1,0,1,0,0|1,0,1]=4 1173 B11R2.106 FC1=CC=CC2=C1C=CS2 70408 [0,1,0,1,0,0|1,0,1]=4 1174 B11R2.106 FC1=CC=CC2=C1N=CS2 E70373 [0,1,0,1,0,0|1,0,1]=4 1175 B11R2.106 FC1=CC=CC2=NON=C12 FD10636 [0,1,0,1,0,0|2,0,0]=4 1176 B11R2.106 IC1=C2CCCC2=CC=C1 N13267 [0,1,0,1,0,0|2,0,0]=4 1177 B11R2.106 IC1=C2CCOC2=NC=C1 P16092 [0,1,0,1,0,0|2,0,0]=4 1178 B11R2.106 NC1=C2CCOC2=NC=C1 97229 [0,1,0,1,0,0|2,0,0]=4 1179 B11R2.106 NC1=C2NCCC2=CC=C1 AC5784 [0,1,0,1,0,0|2,0,0]=4 1180 B11R2.106 NC1=C2OC=CC2=CC=C1 F20181 [0,1,0,1,0,0|1,0,1]=4 1181 B11R2.106 NC1=C2OC=CC2=CC=C1 P16876 [0,1,0,1,0,0|1,0,1]=4 1182 B11R2.106 NC1=C2OCCC2=CC=C1 Y10505 [0,1,0,1,0,0|1,0,0]=3 1183 B11R2.106 NC1=C2OCOC2=CC=C1 25897 [0,1,0,1,0,0|0,1,0]=3 1184 B11R2.106 NC1=C2SC=NC2=CC=C1 27175 [0,1,0,1,0,0|1,0,1]=4 1185 B11R2.106 NC1=CC=CC2=C1C=CO2 52950 [0,1,0,1,0,0|1,0,1]=4 1186 B11R2.106 NC1=CC=CC2=C1C=CS2 51426 [0,1,0,1,0,0|1,0,1]=4 1187 B11R2.106 NC1=CC=CC2=C1C=CS2 Y11369 [0,1,0,1,0,0|1,0,1]=4 1188 B11R2.106 NC1=CC=CC2=C1CCN2 O11831 [0,1,0,1,0,0|2,0,0]=4 1189 B11R2.106 NC1=CC=CC2=C1CNC2 62888 [0,1,0,1,0,0|2,0,0]=4 1190 B11R2.106 NC1=CC=CC2=C1CNC2 C90573 [0,1,0,1,0,0|2,0,0]=4 1191 B11R2.106 NC1=CC=CC2=C1N=CS2 79115 [0,1,0,1,0,0|1,0,1]=4 1192 B11R2.106 NC1=CC=CC2=C1N=NS2 F20183 [0,1,0,1,0,0|2,0,0]=4 1193 B11R2.106 O=C1NC=CC2=C1CCO2 D96871 [0,1,0,1,0,0|2,0,0]=4 1194 B11R2.106 OC1=C2CCNC2=CC=C1 76585 [0,1,0,1,0,0|1,1,0]=4 1195 B11R2.106 OC1=C2NCCC2=CC=C1 D82764 [0,1,0,1,0,0|1,1,0]=4 1196 B11R2.106 OC1=C2OC=CC2=CC=C1 70790 [0,1,0,1,0,0|0,1,1]=4 1197 B11R2.106 OC1=C2OCOC2=CC=C1 Y13605 [0,1,0,1,0,0|0,1,0]=3 1198 B11R2.106 OC1=CC=CC2=C1N=CO2 F17479 [0,1,0,1,0,0|1,0,1]=4 1199 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 30106 [0,1,0,1,0,0|1,0,1]=4 1200 B11R2.10 CC1=CC2=C(C=CC=C2)O1 F11695 [0,1,0,1,0,0|1,0,0]=3 1201 B11R2.10 CC1=NC2=C(C=CN=C2)O1 F13462 [0,1,0,1,0,0|2,0,0]=4 1202 B11R2.10 CC1=NC2=CC=CN=C2O1 AC1641 [0,1,0,1,0,0|2,0,0]=4 1203 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 P16419 [0,1,0,1,0,0|2,0,0]=4 1204 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 VT1375 [0,1,0,1,0,0|2,0,0]=4 1205 B11R2.10 IC1=CC2=C(C=CC=C2)O1 D83864 [0,1,0,1,0,0|1,0,1]=4 1206 B11R2.10 IC1=CC2=C(C=CC=C2)S1 F13439 [0,1,0,1,0,0|1,0,1]=4 1207 B11R2.10 NC1=CC2=C(C=CC=C2)S1 27373 [0,1,0,1,0,0|1,0,1]=4 1208 B11R2.20 C1=CC2=C(C=C1)CCN=C2 F12436 [0,1,0,1,0,0|2,0,0]=4 1209 B11R2.20 C1=CC2=C(C=C1)OCC=C2 N13096 [0,1,0,1,0,0|1,0,0]=3 1210 B11R2.20 C1=CC2=C(C=N1)NCCO2 84112 [0,1,0,1,0,0|2,0,0]=4 1211 B11R2.20 C1=CC2=C(C=N1)OCCN2 83898 [0,1,0,1,0,0|2,0,0]=4 1212 B11R2.20 C1=CN=C2OCCCC2=C1 AT22008 [0,1,0,1,0,0|2,0,0]=4 1213 B11R2.20 C1=CN=C2OCCNC2=C1 83897 [0,1,0,1,0,0|2,0,0]=4 1214 B11R2.20 C1=CN=C2OCCOC2=C1 F14644 [0,1,0,1,0,0|1,1,0]=4 1215 B11R2.1 BrC1=NSC2=C1C=CC=C2 D84733 [0,1,0,1,0,0|2,0,0]=4 1216 B11R2.1 C=C1CCC2=C1C=CC=C2 AC3155 [0,1,0,1,0,0|2,0,0]=4 1217 B11R2.1 CC1=CCC2=C1C=CC=C2 C76459 [0,1,0,1,0,0|2,0,0]=4 1218 B11R2.1 CN1CCC2=C1C=CC=C2 D83554 [0,1,0,1,0,0|2,0,0]=4 1219 B11R2.1 CN1N=CC2=C1C=CC=C2 P10138 [0,1,0,1,0,0|2,0,0]=4 1220 B11R2.1 C[C@@H]1NCC2=C1C=CC=C2 E72710 [0,1,0,1,0,0|2,0,0]=4 1221 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 I11746 [0,1,0,1,0,0|2,0,0]=4 1222 B11R2.1 ClC1=COC2=C1C=CC=C2 F14423 [0,1,0,1,0,0|1,0,1]=4 1223 B11R2.1 NC1=CSC2=C1C=CC=C2 25380 [0,1,0,1,0,0|1,0,1]=4 1224 B11R2.1 NN1CCC2=C1C=CC=C2 C90200 [0,1,0,1,0,0|2,0,0]=4 1225 B11R2.1 O=C1COC2=C1C=CN=C2 65977 [0,1,0,1,0,0|1,1,0]=4 1226 B11R2.1 O=C1COC2=C1C=CN=C2 W17205 [0,1,0,1,0,0|1,1,0]=4 1227 B11R2.1 O=C1CSC2=C1C=CC=C2 26760 [0,1,0,1,0,0|1,0,0]=3 1228 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D70931 [0,1,0,1,0,0|1,1,0]=4 1229 B11R2.1 O[C@H]1COC2=NC=CC=C21 D97315 [0,1,0,1,0,0|1,1,0]=4 1230 B11R2.36 BrC1=CC2=C(C=C1)CCC2 Y10449 [0,1,0,1,0,0|2,0,0]=4 1231 B11R2.36 BrC1=CC2=C(C=C1)CCN2 73495 [0,1,0,1,0,0|2,0,0]=4 1232 B11R2.36 BrC1=CC2=C(C=C1)ON=C2 25694 [0,1,0,1,0,0|2,0,0]=4 1233 B11R2.36 CC1=CC2=C(C=C1)CCC2 Y11729 [0,1,0,1,0,0|2,0,0]=4 1234 B11R2.36 CC1=CC2=C(C=C1)SC=C2 F11127 [0,1,0,1,0,0|1,0,1]=4 1235 B11R2.36 CC1=CC2=C(C=CS2)C=C1 C73204 [0,1,0,1,0,0|1,0,1]=4 1236 B11R2.36 ClC1=CC2=C(C=C1)CCC2 N12723 [0,1,0,1,0,0|2,0,0]=4 1237 B11R2.36 ClC1=CC2=C(C=C1)CCN2 F11859 [0,1,0,1,0,0|2,0,0]=4 1238 B11R2.36 ClC1=CC2=C(C=C1)N=CO2 W17078 [0,1,0,1,0,0|1,0,1]=4 1239 B11R2.36 ClC1=CC2=C(C=C1)OCC2 W17536 [0,1,0,1,0,0|1,0,0]=3 1240 B11R2.36 ClC1=CC2=C(C=C1)ON=C2 D78570 [0,1,0,1,0,0|2,0,0]=4 1241 B11R2.36 ClC1=NC2=C(C=C1)CCO2 D78959 [0,1,0,1,0,0|2,0,0]=4 1242 B11R2.36 FC1=CC2=C(C=C1)CCN2 F21334 [0,1,0,1,0,0|2,0,0]=4 1243 B11R2.36 FC1=CC2=C(C=C1)CCO2 Y13232 [0,1,0,1,0,0|1,0,0]=3 1244 B11R2.36 FC1=CC2=C(C=C1)N=CS2 F14497 [0,1,0,1,0,0|1,0,1]=4 1245 B11R2.36 FC1=CC2=C(C=C1)OC=C2 F30233 [0,1,0,1,0,0|1,0,1]=4 1246 B11R2.36 FC1=CC2=C(C=C1)OCO2 AC4347 [0,1,0,1,0,0|0,1,0]=3 1247 B11R2.36 FC1=CC2=C(C=C1)SC=N2 C13797 [0,1,0,1,0,0|1,0,1]=4 1248 B11R2.36 FC1=CC2=C(C=CS2)C=C1 P15213 [0,1,0,1,0,0|1,0,1]=4 1249 B11R2.36 IC1=CC2=C(C=C1)N=CS2 Y11641 [0,1,0,1,0,0|1,0,1]=4 1250 B11R2.36 IC1=CC2=C(C=C1)ON=C2 C77293 [0,1,0,1,0,0|2,0,0]=4 1251 B11R2.36 NC1=CC2=C(C=C1)C=NO2 26398 [0,1,0,1,0,0|2,0,0]=4 1252 B11R2.36 NC1=CC2=C(C=C1)CCO2 F12399 [0,1,0,1,0,0|1,0,0]=3 1253 B11R2.36 NC1=CC2=C(C=C1)N=NS2 F51398 [0,1,0,1,0,0|2,0,0]=4 1254 B11R2.36 NC1=CC2=C(C=C1)OCO2 D97371 [0,1,0,1,0,0|0,1,0]=3 1255 B11R2.36 NC1=CC2=C(C=C1)SN=C2 W17193 [0,1,0,1,0,0|2,0,0]=4 1256 B11R2.36 NC1=CC2=C(C=CO2)C=C1 D70068 [0,1,0,1,0,0|1,0,1]=4 1257 B11R2.36 OC1=CC2=C(C=C1)C=NO2 24777 [0,1,0,1,0,0|2,0,0]=4 1258 B11R2.36 OC1=CC2=C(C=C1)CCN2 C75271 [0,1,0,1,0,0|2,0,0]=4 1259 B11R2.36 OC1=CC2=C(C=C1)CCO2 27138 [0,1,0,1,0,0|1,0,0]=3 1260 B11R2.36 OC1=CC2=C(C=C1)N=CO2 D77541 [0,1,0,1,0,0|1,0,1]=4 1261 B11R2.36 OC1=CC2=C(C=C1)OC=N2 AC4843 [0,1,0,1,0,0|1,0,1]=4 1262 B11R2.36 OC1=CC2=C(C=C1)OCC2 24188 [0,1,0,1,0,0|1,0,0]=3 1263 B11R2.36 OC1=CC2=C(C=C1)SC=C2 59802 [0,1,0,1,0,0|1,0,1]=4 1264 B11R2.36 OC1=CC2=C(C=C1)SC=N2 C76461 [0,1,0,1,0,0|1,0,1]=4 1265 B11R2.36 OC1=CC2=C(C=CO2)C=C1 84605 [0,1,0,1,0,0|1,0,1]=4 1266 B7R1.1 COC1=CNN=C1 79311 [1,0,0,0,1,0|2,0,0]=4 1267 B7R1.1 COC1=NNC=C1 D79536 [1,0,0,0,1,0|2,0,0]=4 1268 B7R1.4 CC1=C(C)NC=C1 F20873 [1,0,0,0,1,0|2,0,0]=4 1269 B7R1.4 CC1=CSC=C1N P10841 [1,0,0,0,1,0|2,0,0]=4