0 B7R1.3 ClC1=CC=NC=C1 F17303 [0,0,0,0,0,0|1,0,0]=1 1 B7R1.3 ClC1=CN=NC=C1 F19795 [0,0,0,0,0,0|2,0,0]=2 2 B7R1.3 ClC1=NC=CC=N1 F20795 [0,0,0,0,0,0|4,0,0]=4 3 B7R1.3 ClC1=NC=NC=C1 F18311 [0,0,0,0,0,0|2,0,0]=2 4 B7R1.3 FC1=CC=NC=C1 F19691 [0,0,0,0,0,0|1,0,0]=1 5 B7R1.3 FC1=CN=CN=C1 F14737 [0,0,0,0,0,0|4,0,0]=4 6 B7R1.3 F[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 40525 [0,0,0,0,0,0|2,0,0]=2 7 B7R1.3 IC1=NC=NC=C1 C15557 [0,0,0,0,0,0|2,0,0]=2 8 B7R1.3 N[C@@H]1C=CCCC1 AB10372 [0,0,0,0,0,0|1,0,3]=4 9 B7R1.3 O=C1C=NCN=C1 36727 [0,0,0,0,0,0|4,0,0]=4 10 B7R1.3 O=C1C=NN=CN1 F30273 [0,0,0,0,0,0|3,0,0]=3 11 B7R1.3 OC1=CN=NC=C1 O12057 [0,0,0,0,0,0|2,0,0]=2 12 B7R1.3 OC1=CN=NCC1 S11490 [0,0,0,0,0,0|2,0,2]=4 13 B7R1.3 SC1=NN=CC=C1 AT13031 [0,0,0,0,0,0|4,0,0]=4 14 B7R1.3 [15NH2]C1=CC=CC=C1 41405 [0,0,0,0,0,0|1,0,0]=1 15 B7R1.3 [2H]C1=CC=CC=C1 D98570 [0,0,0,0,0,0|2,0,0]=2 16 B7R1.3 [2H]C1=CC=NC=C1 D98795 [0,0,0,0,0,0|1,0,0]=1 17 B7R1.3 [2H]C1=NC=CC=C1 D98277 [0,0,0,0,0,0|3,0,0]=3 18 B8R1.2 C=CC1=CC=CN=C1 71366 [0,1,0,0,0,0|3,0,0]=4 19 B8R1.2 CNC1=CC=CN=N1 79165 [0,1,0,0,0,0|3,0,0]=4 20 B8R1.2 ClCC1=NC=NC=C1 A10562 [0,1,0,0,0,0|2,0,0]=3 21 B8R1.2 NCC1=CC=CC=C1 T70846 [0,1,0,0,0,0|1,0,0]=2 22 B8R1.2 NNC1=CC=CN=N1 C15759 [0,1,0,0,0,0|3,0,0]=4 23 B8R1.2 NNC1=NC=NC=C1 57488 [0,1,0,0,0,0|1,0,0]=2 24 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [0,1,0,0,0,0|2,0,0]=3 25 B8R1.3 NC1=CC=C(N)N=N1 D78632 [0,1,0,0,0,0|3,0,0]=4 26 B8R1.3 NC1=CN=C(O)C=N1 N13380 [0,1,0,0,0,0|3,0,0]=4 27 B8R1.3 NC1=CN=C(S)C=C1 AT20609 [0,1,0,0,0,0|2,0,0]=3 28 B8R1.3 NC1=NC=C(O)C=N1 D78823 [0,1,0,0,0,0|3,0,0]=4 29 B8R1.3 NC1=NC=C([S-])C=N1 F51717 [0,1,0,0,0,0|3,0,0]=4 30 B8R1.3 NC1=NNC(=O)C=C1 AT17777 [0,1,0,0,0,0|3,0,0]=4 31 B8R1.3 [2H]C1=CC=C(Cl)C=C1 D98354 [0,1,0,0,0,0|2,0,0]=3 32 B8R1.3 [2H]C1=CC=C([2H])C=C1 D99669 [0,1,0,0,0,0|2,0,0]=3 33 B8R1.4 BrC1=CC(I)=NC=C1 A10666 [0,1,0,0,0,0|1,0,0]=2 34 B8R1.4 CC1=CC(I)=NC=C1 D87895 [0,1,0,0,0,0|1,0,0]=2 35 B8R1.4 CC1=CC=NC(I)=N1 N13215 [0,1,0,0,0,0|2,0,0]=3 36 B8R1.4 CC1=NC(N)=CN=N1 D86296 [0,1,0,0,0,0|2,0,0]=3 37 B8R1.4 ClC1=CC(I)=NC=N1 A51177 [0,1,0,0,0,0|2,0,0]=3 38 B8R1.4 ClC1=CC=NC(Br)=N1 81850 [0,1,0,0,0,0|2,0,0]=3 39 B8R1.4 ClC1=NC(Cl)=NN=C1 F53483 [0,1,0,0,0,0|3,0,0]=4 40 B8R1.4 FC1=NC=CC(Br)=N1 AT18301 [0,1,0,0,0,0|2,0,0]=3 41 B8R1.4 NC1=CC=CC(=S)N1 C15708 [0,1,0,0,0,0|2,0,0]=3 42 B8R1.4 NC1=NC(Cl)=NN=C1 92269 [0,1,0,0,0,0|2,0,0]=3 43 B8R1.4 O=C1C=C(S)NC=N1 FD7370 [0,1,0,0,0,0|2,0,0]=3 44 B8R1.4 O=C1C=CNC(=O)O1 C15625 [0,1,0,0,0,0|2,0,1]=4 45 B8R1.4 OC1=CC(I)=CN=C1 D74429 [0,1,0,0,0,0|3,0,0]=4 46 B8R1.4 SC1=CC(Br)=CN=C1 P12662 [0,1,0,0,0,0|3,0,0]=4 47 B8R1.4 [2H]C1=CC=CC([2H])=C1 D99674 [0,1,0,0,0,0|2,0,0]=3 48 B8R1.4 [2H]C1=CC=CC([2H])=N1 D98925 [0,1,0,0,0,0|3,0,0]=4 49 B8R1.5 BrC1=C(Br)C=NN=C1 AT11972 [0,1,0,0,0,0|2,0,0]=3 50 B8R1.5 BrC1=CN=CN=C1I P11647 [0,1,0,0,0,0|2,0,0]=3 51 B8R1.5 CC1=CC=NNC1=O 20227 [0,1,0,0,0,0|2,0,0]=3 52 B8R1.5 CC1=CN=CN=C1Cl 72600 [0,1,0,0,0,0|2,0,0]=3 53 B8R1.5 CC1=CN=NC=C1C C15709 [0,1,0,0,0,0|2,0,0]=3 54 B8R1.5 CC1=[N+](C)C=CC=C1 D87448 [0,1,0,0,0,0|3,0,0]=4 55 B8R1.5 C[C@H]1C=NC=CC1=S AT18149 [0,1,0,0,0,0|1,0,1]=3 56 B8R1.5 ClC1=C(Cl)C=NN=C1 S10980 [0,1,0,0,0,0|2,0,0]=3 57 B8R1.5 FC1=C(F)C=NC=C1 O10910 [0,1,0,0,0,0|1,0,0]=2 58 B8R1.5 FC1=CC=CN=C1S AT18759 [0,1,0,0,0,0|3,0,0]=4 59 B8R1.5 NC1=C(S)C=NC=C1 P11896 [0,1,0,0,0,0|0,0,0]=1 60 B8R1.5 O=C1NC=NC=C1Cl P12334 [0,1,0,0,0,0|2,0,0]=3 61 B8R1.5 O=C1NC=NC=C1I P13009 [0,1,0,0,0,0|2,0,0]=3 62 B8R1.5 OC1=C(Cl)C=NC=N1 25825 [0,1,0,0,0,0|2,0,0]=3 63 B8R1.5 OC1=C(O)C=NN=C1 S10982 [0,1,0,0,0,0|2,0,0]=3 64 B8R1.5 OC1=[13C](O)C=CC=C1 D98565 [0,1,0,0,0,0|2,0,0]=3 65 B8R1.5 S=C1C=CNC=C1Cl AT18152 [0,1,0,0,0,0|1,0,1]=3 66 B8R1.5 [2H]C1=C([2H])C=CC=C1 D97880 [0,1,0,0,0,0|2,0,0]=3 67 B8R1.5 [O-][N+]1=C([S-])C=CC=C1 S12409 [0,1,0,0,0,0|3,0,0]=4 68 B6R0.4 C=C\C=C/C(=O)O C74528 [0,0,1,0,0,0|3,0,0]=4 69 B6R0.4 C=C\C=C\C(=O)O 35918 [0,0,1,0,0,0|3,0,0]=4 70 B6R0.6 O=C\C=C\C=C\[O-] 98104 [0,0,1,0,0,0|3,0,0]=4 71 B6R1.2 BrC1=CC=NS1 AT21099 [0,0,0,0,1,0|2,0,0]=3 72 B6R1.2 CC1=CN=CO1 C77581 [0,0,0,0,1,0|2,0,0]=3 73 B6R1.2 CC1=NC=CO1 O10838 [0,0,0,0,1,0|3,0,0]=4 74 B6R1.2 CC1=NSC=C1 AC6637 [0,0,0,0,1,0|3,0,0]=4 75 B6R1.2 ClC1=CSN=C1 F13704 [0,0,0,0,1,0|2,0,0]=3 76 B6R1.2 ClC1=NC=CO1 F20650 [0,0,0,0,1,0|3,0,0]=4 77 B6R1.2 ClC1=NC=NN1 O11392 [0,0,0,0,1,0|3,0,0]=4 78 B6R1.2 ClC1=NN=CN1 O10979 [0,0,0,0,1,0|3,0,0]=4 79 B6R1.2 ClC1=NSC=C1 F19768 [0,0,0,0,1,0|3,0,0]=4 80 B6R1.2 ClC1=NSN=C1 AT12128 [0,0,0,0,1,0|3,0,0]=4 81 B6R1.2 IC1=NN=CS1 C74707 [0,0,0,0,1,0|3,0,0]=4 82 B6R1.2 NC1=CC=CS1 44128 [0,0,0,0,1,0|1,0,0]=2 83 B6R1.2 NC1=CC=CS1 F10359 [0,0,0,0,1,0|1,0,0]=2 84 B6R1.2 NC1=CC=NS1 W16800 [0,0,0,0,1,0|1,0,0]=2 85 B6R1.2 NC1=CNC=N1 P20245 [0,0,0,0,1,0|1,0,1]=3 86 B6R1.2 NC1=CNN=N1 AT26923 [0,0,0,0,1,0|2,0,0]=3 87 B6R1.2 OC1=CON=C1 AT21052 [0,0,0,0,1,0|2,0,0]=3 88 B6R1.2 OC1=NN=CS1 AT18843 [0,0,0,0,1,0|3,0,0]=4 89 B6R1.2 SC1=NC=CO1 AT18533 [0,0,0,0,1,0|3,0,0]=4 90 B6R1.2 [2H]N1C=CC=C1 D98995 [0,0,0,0,1,0|2,0,0]=3 91 B5R0.1 C=CCC(=C)C T72918 [1,0,1,0,0,0|1,0,1]=4 92 B5R0.2 N\N=C\C=N\N D72709 [1,0,1,0,0,0|2,0,0]=4 93 B7R0.2 C=CC(=O)C=C(C)C F12626 [0,1,1,0,0,0|2,0,0]=4 94 B7R1.1 BrCC1=CN=CS1 70967 [0,1,0,0,1,0|2,0,0]=4 95 B7R1.1 CCC1=CN=CO1 C77473 [0,1,0,0,1,0|2,0,0]=4 96 B7R1.1 CNC1=CNN=C1 AT23101 [0,1,0,0,1,0|1,0,0]=3 97 B7R1.1 CNC1=NC=CS1 H11141 [0,1,0,0,1,0|2,0,0]=4 98 B7R1.1 CNC1=NN=CO1 AT18791 [0,1,0,0,1,0|2,0,0]=4 99 B7R1.1 CNC1=NN=CS1 71255 [0,1,0,0,1,0|2,0,0]=4 100 B7R1.1 ClCC1=CN=CS1 F13827 [0,1,0,0,1,0|2,0,0]=4 101 B7R1.1 ClCC1=CSC=C1 AT17055 [0,1,0,0,1,0|2,0,0]=4 102 B7R1.1 N#CC1=CNN=C1 O10410 [0,1,0,0,1,0|1,0,1]=4 103 B7R1.1 NCC1=CC=NN1 P10323 [0,1,0,0,1,0|1,0,0]=3 104 B7R1.1 NCC1=CC=NS1 AT13366 [0,1,0,0,1,0|1,0,0]=3 105 B7R1.1 NCC1=CNC=N1 C90275 [0,1,0,0,1,0|1,0,1]=4 106 B7R1.1 NCC1=CNN=C1 83328 [0,1,0,0,1,0|1,0,0]=3 107 B7R1.1 NCC1=COC=C1 61502 [0,1,0,0,1,0|1,0,0]=3 108 B7R1.1 NCC1=COC=N1 73632 [0,1,0,0,1,0|2,0,0]=4 109 B7R1.1 NCC1=CSN=C1 AT21214 [0,1,0,0,1,0|1,0,0]=3 110 B7R1.1 NCC1=NC=NN1 S10770 [0,1,0,0,1,0|2,0,0]=4 111 B7R1.1 NCC1=NN=CO1 AT18772 [0,1,0,0,1,0|2,0,0]=4 112 B7R1.1 NCC1=NSC=C1 P10783 [0,1,0,0,1,0|2,0,0]=4 113 B7R1.1 NNC1=CC=CS1 W17128 [0,1,0,0,1,0|1,0,0]=3 114 B7R1.1 NNC1=NC=CN1 25904 [0,1,0,0,1,0|2,0,0]=4 115 B7R1.1 NNC1=NC=CS1 D87841 [0,1,0,0,1,0|2,0,0]=4 116 B7R1.1 O=CC1=CSN=C1 83208 [0,1,0,0,1,0|2,0,0]=4 117 B7R1.1 OCC1=CC=CN1 AT16114 [0,1,0,0,1,0|2,0,0]=4 118 B7R1.1 OCC1=CC=NN1 H11417 [0,1,0,0,1,0|2,0,0]=4 119 B7R1.1 SCC1=CC=CS1 T72725 [0,1,0,0,1,0|2,0,0]=4 120 B7R1.2 BrC1=CN=C(I)N1 P17529 [0,1,0,0,1,0|2,0,0]=4 121 B7R1.2 BrC1=CN=C(I)S1 89501 [0,1,0,0,1,0|2,0,0]=4 122 B7R1.2 BrC1=CSC(I)=C1 F10349 [0,1,0,0,1,0|2,0,0]=4 123 B7R1.2 BrC1=NC=C(I)S1 F16091 [0,1,0,0,1,0|2,0,0]=4 124 B7R1.2 CC1=CC(Br)=CO1 I11460 [0,1,0,0,1,0|2,0,0]=4 125 B7R1.2 CC1=CC(N)=CS1 27442 [0,1,0,0,1,0|1,0,0]=3 126 B7R1.2 CC1=CC(N)=NS1 A51223 [0,1,0,0,1,0|2,0,0]=4 127 B7R1.2 CC1=CC=C(S)S1 AT16550 [0,1,0,0,1,0|2,0,0]=4 128 B7R1.2 CC1=CN=C(C)O1 AC5679 [0,1,0,0,1,0|2,0,0]=4 129 B7R1.2 CC1=CN=C(Cl)O1 AT18559 [0,1,0,0,1,0|2,0,0]=4 130 B7R1.2 CC1=CN=C(N)N1 27977 [0,1,0,0,1,0|2,0,0]=4 131 B7R1.2 CC1=CSC(N)=C1 N12877 [0,1,0,0,1,0|1,0,0]=3 132 B7R1.2 CC1=CSC(N)=C1 S11464 [0,1,0,0,1,0|1,0,0]=3 133 B7R1.2 CC1=CSC(S)=C1 AT16548 [0,1,0,0,1,0|2,0,0]=4 134 B7R1.2 CC1=NC(N)=CS1 AC2762 [0,1,0,0,1,0|2,0,0]=4 135 B7R1.2 CC1=NC=C(Br)O1 AT18670 [0,1,0,0,1,0|2,0,0]=4 136 B7R1.2 CC1=NC=C(Cl)S1 AT15021 [0,1,0,0,1,0|2,0,0]=4 137 B7R1.2 CC1=NC=C(N)S1 D85841 [0,1,0,0,1,0|1,0,0]=3 138 B7R1.2 CC1=NSC(I)=C1 W12926 [0,1,0,0,1,0|2,0,0]=4 139 B7R1.2 CC1=NSC(N)=C1 C77679 [0,1,0,0,1,0|1,0,0]=3 140 B7R1.2 CN1C=C(F)C=N1 D79458 [0,1,0,0,1,0|2,0,0]=4 141 B7R1.2 CN1C=CC(N)=C1 77871 [0,1,0,0,1,0|0,0,1]=3 142 B7R1.2 CN1C=NC(N)=C1 F13269 [0,1,0,0,1,0|1,0,1]=4 143 B7R1.2 CN1N=CC(N)=N1 F13454 [0,1,0,0,1,0|2,0,0]=4 144 B7R1.2 ClC1=CC=C(I)S1 C74472 [0,1,0,0,1,0|2,0,0]=4 145 B7R1.2 ClC1=CSC(Br)=C1 AT16371 [0,1,0,0,1,0|2,0,0]=4 146 B7R1.2 NC1=CC(N)=NN1 F17293 [0,1,0,0,1,0|1,0,0]=3 147 B7R1.2 NC1=CC(N)=NO1 AT19796 [0,1,0,0,1,0|1,0,0]=3 148 B7R1.2 NC1=CC=C(Cl)S1 D87671 [0,1,0,0,1,0|1,0,0]=3 149 B7R1.2 NC1=CN=C(N)S1 C90580 [0,1,0,0,1,0|1,0,0]=3 150 B7R1.2 NC1=CSC(Br)=N1 70972 [0,1,0,0,1,0|2,0,0]=4 151 B7R1.2 NC1=CSC(Cl)=C1 38492 [0,1,0,0,1,0|1,0,0]=3 152 B7R1.2 NC1=CSC(Cl)=C1 P13129 [0,1,0,0,1,0|1,0,0]=3 153 B7R1.2 NC1=NN=C(Cl)N1 AT12443 [0,1,0,0,1,0|2,0,0]=4 154 B7R1.2 SC1=NC=C(Cl)S1 AT15027 [0,1,0,0,1,0|2,0,0]=4 155 B7R1.2 [2H]C1=CC=C([2H])S1 D99575 [0,1,0,0,1,0|2,0,0]=4 156 B7R1.4 BrC1=C(Br)SC=N1 C11305 [0,1,0,0,1,0|2,0,0]=4 157 B7R1.4 BrC1=C(I)C=CS1 AT16380 [0,1,0,0,1,0|2,0,0]=4 158 B7R1.4 CC1=C(Br)C=NN1 O11185 [0,1,0,0,1,0|2,0,0]=4 159 B7R1.4 CC1=C(Br)OC=C1 F53471 [0,1,0,0,1,0|2,0,0]=4 160 B7R1.4 CC1=C(I)NN=C1 72687 [0,1,0,0,1,0|2,0,0]=4 161 B7R1.4 CC1=C(N)C=NO1 AT19805 [0,1,0,0,1,0|1,0,0]=3 162 B7R1.4 CC1=C(N)N=CN1 C15418 [0,1,0,0,1,0|1,0,1]=4 163 B7R1.4 CC1=C(N)NN=C1 P11216 [0,1,0,0,1,0|1,0,0]=3 164 B7R1.4 CC1=C(S)C=CS1 A10974 [0,1,0,0,1,0|2,0,0]=4 165 B7R1.4 CC1=CNN=C1I 72684 [0,1,0,0,1,0|2,0,0]=4 166 B7R1.4 CC1=NNC=C1Cl AT10929 [0,1,0,0,1,0|2,0,0]=4 167 B7R1.4 CC1=NOC=C1N AT19806 [0,1,0,0,1,0|1,0,0]=3 168 B7R1.4 CN1C=NN=C1N AT21330 [0,1,0,0,1,0|2,0,0]=4 169 B7R1.4 CN1N=CC=C1Cl AT15843 [0,1,0,0,1,0|2,0,0]=4 170 B7R1.4 ClC1=C(Br)N=CN1 AT15551 [0,1,0,0,1,0|2,0,0]=4 171 B7R1.4 NC1=C(Br)C=CS1 C16366 [0,1,0,0,1,0|1,0,0]=3 172 B7R1.4 NC1=C(Cl)SC=C1 AT16569 [0,1,0,0,1,0|1,0,0]=3 173 B7R1.4 NC1=C(F)C=NN1 D96709 [0,1,0,0,1,0|1,0,0]=3 174 B7R1.4 NC1=CNN=C1N 37367 [0,1,0,0,1,0|1,0,0]=3 175 B7R1.4 NC1=NOC=C1Cl A50064 [0,1,0,0,1,0|2,0,0]=4 176 B7R1.4 NN1C=NNC1=O AT21265 [0,1,0,0,1,0|2,0,0]=4 177 B9R1.1 CC1=NC=C(NN)C=C1 P10368 [0,2,0,0,0,0|2,0,0]=4 178 B9R1.1 CCN1C=CC(=S)C=C1 W16146 [0,2,0,0,0,0|1,0,1]=4 179 B9R1.1 CNC1=CC=C(N)C=C1 C78356 [0,2,0,0,0,0|1,0,0]=3 180 B9R1.1 CNC1=NC=C(N)C=C1 Y13586 [0,2,0,0,0,0|2,0,0]=4 181 B9R1.1 CSC1=NC=C(N)C=C1 D73901 [0,2,0,0,0,0|2,0,0]=4 182 B9R1.1 C[Se]C1=CC=C(Br)C=C1 97865 [0,2,0,0,0,0|2,0,0]=4 183 B9R1.1 NC1=NC=C(CCl)C=C1 AT22351 [0,2,0,0,0,0|2,0,0]=4 184 B9R1.1 NCC1=CC=C(F)C=C1 N12249 [0,2,0,0,0,0|1,0,0]=3 185 B9R1.1 NCC1=CC=C(S)C=C1 AT20992 [0,2,0,0,0,0|1,0,0]=3 186 B9R1.1 NCC1=NC=C(F)C=C1 83593 [0,2,0,0,0,0|2,0,0]=4 187 B9R1.1 NCC1=NC=C(I)C=C1 C91084 [0,2,0,0,0,0|2,0,0]=4 188 B9R1.1 NNC1=CN=C(Br)C=C1 68947 [0,2,0,0,0,0|2,0,0]=4 189 B9R1.1 NNC1=CN=C(Br)C=C1 W15223 [0,2,0,0,0,0|2,0,0]=4 190 B9R1.1 NNC1=NC=C(I)C=C1 C91520 [0,2,0,0,0,0|2,0,0]=4 191 B9R1.1 O=C1C=CC(=NCl)C=C1 T72753 [0,2,0,0,0,0|1,0,1]=4 192 B9R1.1 [2H]CC1=CC=C(F)C=C1 D98910 [0,2,0,0,0,0|2,0,0]=4 193 B9R1.2 C#CC1=CC=CC(N)=N1 C73323 [0,2,0,0,0,0|2,0,0]=4 194 B9R1.2 C#CC1=CC=NC(Cl)=N1 AT12429 [0,2,0,0,0,0|2,0,0]=4 195 B9R1.2 C#CC1=CN=CC(N)=C1 C76102 [0,2,0,0,0,0|2,0,0]=4 196 B9R1.2 C#CC1=NC(C)=CC=N1 AT18275 [0,2,0,0,0,0|2,0,0]=4 197 B9R1.2 C=CC1=CC=NC(N)=N1 AT12778 [0,2,0,0,0,0|2,0,0]=4 198 B9R1.2 CC1=CC(C=O)=NC=N1 AT18315 [0,2,0,0,0,0|2,0,0]=4 199 B9R1.2 CC1=CC(CCl)=NC=N1 F52607 [0,2,0,0,0,0|2,0,0]=4 200 B9R1.2 CC1=CC(CN)=NC=N1 AT18324 [0,2,0,0,0,0|1,0,0]=3 201 B9R1.2 CC1=CC=NC(CCl)=N1 P10964 [0,2,0,0,0,0|2,0,0]=4 202 B9R1.2 CC1=CC=NC(CN)=N1 P10960 [0,2,0,0,0,0|2,0,0]=4 203 B9R1.2 CC1=CN=NC(CN)=C1 P13788 [0,2,0,0,0,0|2,0,0]=4 204 B9R1.2 CC1=NC=CC(CCl)=N1 F53395 [0,2,0,0,0,0|2,0,0]=4 205 B9R1.2 CC1=NC=CC(CN)=N1 F14224 [0,2,0,0,0,0|1,0,0]=3 206 B9R1.2 CC1=NC=CC(NN)=C1 F16202 [0,2,0,0,0,0|0,0,0]=2 207 B9R1.2 CCC1=CC(Cl)=NN=C1 S11387 [0,2,0,0,0,0|2,0,0]=4 208 B9R1.2 CCC1=NC=CC(Cl)=N1 W12562 [0,2,0,0,0,0|2,0,0]=4 209 B9R1.2 CNC1=CC(Br)=NC=N1 AT18306 [0,2,0,0,0,0|1,0,0]=3 210 B9R1.2 CNC1=NC=CC(N)=C1 F12690 [0,2,0,0,0,0|0,0,0]=2 211 B9R1.2 COC1=CC(O)=NC=C1 F17762 [0,2,0,0,0,0|1,0,0]=3 212 B9R1.2 COC1=CN=CC(N)=C1 P11509 [0,2,0,0,0,0|2,0,0]=4 213 B9R1.2 CSC1=NC(N)=NC=C1 AT18329 [0,2,0,0,0,0|2,0,0]=4 214 B9R1.2 C\N=C1\C=C(C)C=CN1 W18359 [0,2,0,0,0,0|1,0,1]=4 215 B9R1.2 ClC1=NC=CC(CBr)=C1 C16429 [0,2,0,0,0,0|1,0,0]=3 216 B9R1.2 ClC1=NC=CC(CBr)=N1 F12213 [0,2,0,0,0,0|2,0,0]=4 217 B9R1.2 ClCC1=NC=CC(Cl)=C1 C13998 [0,2,0,0,0,0|1,0,0]=3 218 B9R1.2 FCC1=CC(Cl)=NC=N1 82110 [0,2,0,0,0,0|2,0,0]=4 219 B9R1.2 N#CC1=CC(Cl)=NN=C1 AT17811 [0,2,0,0,0,0|1,0,1]=4 220 B9R1.2 N#CC1=CC(I)=NC=C1 A11430 [0,2,0,0,0,0|0,0,1]=3 221 B9R1.2 N#CC1=NC=CC(I)=C1 P10625 [0,2,0,0,0,0|1,0,0]=3 222 B9R1.2 NC1=NC=CC(C=O)=C1 O10660 [0,2,0,0,0,0|1,0,0]=3 223 B9R1.2 NCC1=CC(=O)NC=C1 37540 [0,2,0,0,0,0|0,0,1]=3 224 B9R1.2 NCC1=CC(Br)=CN=C1 F19818 [0,2,0,0,0,0|2,0,0]=4 225 B9R1.2 NCC1=CC(F)=NC=C1 W18404 [0,2,0,0,0,0|0,0,0]=2 226 B9R1.2 NCC1=CC(N)=NC=C1 AC6477 [0,2,0,0,0,0|0,0,0]=2 227 B9R1.2 NCC1=CC=CC(Cl)=N1 C72946 [0,2,0,0,0,0|2,0,0]=4 228 B9R1.2 NCC1=CC=CC(I)=C1 CK2420 [0,2,0,0,0,0|1,0,0]=3 229 B9R1.2 NCC1=CC=CC(O)=N1 F10425 [0,2,0,0,0,0|2,0,0]=4 230 B9R1.2 NCC1=NC=CC(Br)=C1 26892 [0,2,0,0,0,0|1,0,0]=3 231 B9R1.2 NCC1=NC=CC(F)=C1 C71953 [0,2,0,0,0,0|1,0,0]=3 232 B9R1.2 NCC1=NC=CC(N)=C1 77886 [0,2,0,0,0,0|0,0,0]=2 233 B9R1.2 NNC1=CC=NC(O)=N1 S10644 [0,2,0,0,0,0|1,0,0]=3 234 B9R1.2 NNC1=NC(=O)NC=C1 H10062 [0,2,0,0,0,0|1,0,1]=4 235 B9R1.2 NNC1=NC(N)=CC=C1 C91519 [0,2,0,0,0,0|2,0,0]=4 236 B9R1.2 OCC1=CC(O)=NC=N1 59935 [0,2,0,0,0,0|2,0,0]=4 237 B9R1.2 [2H]CC1=CC=CC(F)=C1 D99661 [0,2,0,0,0,0|2,0,0]=4 238 B9R1.6 CN(C)C1=NC=NC=C1 O12006 [0,2,0,0,0,0|1,0,0]=3 239 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [0,2,0,0,0,0|2,0,0]=4 240 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [0,2,0,0,0,0|0,0,0]=2 241 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [0,2,0,0,0,0|2,0,0]=4 242 B9R1.6 C[C@H](N)C1=NC=NC=C1 N10689 [0,2,0,0,0,0|1,0,0]=3 243 B9R1.6 C[C@H](N)C1=NC=NC=C1 P10880 [0,2,0,0,0,0|1,0,0]=3 244 B9R1.6 C[C@H](O)C1=NC=NC=C1 AT18318 [0,2,0,0,0,0|2,0,0]=4 245 B9R1.6 N=C(N)C1=CC=NC=C1 71449 [0,2,0,0,0,0|0,0,0]=2 246 B9R1.6 N=C(N)C1=NC=NC=C1 F30402 [0,2,0,0,0,0|1,0,0]=3 247 B9R1.6 O=C(Cl)C1=CC=NC=C1 D78267 [0,2,0,0,0,0|1,0,0]=3 248 B9R1.6 O=[13C](O)C1=CC=CC=C1 F13987 [0,2,0,0,0,0|2,0,0]=4 249 B9R1.6 [2H]C(=C)C1=CC=CC=C1 D97969 [0,2,0,0,0,0|2,0,0]=4 250 B9R1.6 [2H]N([2H])C1=CC=CC=C1 D98688 [0,2,0,0,0,0|1,0,0]=3 251 B9R1.8 C#C[I+]C1=CC=CC=C1 T71678 [0,2,0,0,0,0|2,0,0]=4 252 B9R1.8 CNCC1=NC=NC=C1 C14477 [0,2,0,0,0,0|1,0,0]=3 253 B9R1.8 CNNC1=CC=CC=C1 C77159 [0,2,0,0,0,0|1,0,0]=3 254 B9R1.8 FCCC1=CC=CC=C1 75534 [0,2,0,0,0,0|2,0,0]=4 255 B9R1.8 IC#CC1=CC=CC=C1 N11813 [0,2,0,0,0,0|2,0,0]=4 256 B9R1.8 NCCC1=CC=CC=C1 T71816 [0,2,0,0,0,0|1,0,0]=3 257 B9R1.8 NCCC1=CC=CC=C1 T72591 [0,2,0,0,0,0|1,0,0]=3 258 B9R1.8 NCCC1=NC=NC=C1 P10950 [0,2,0,0,0,0|1,0,0]=3 259 B9R1.8 NNCC1=NC=CC=C1 P10521 [0,2,0,0,0,0|2,0,0]=4 260 B9R1.8 OCCC1=CC=NC=C1 T72404 [0,2,0,0,0,0|1,0,0]=3 261 B9R1.8 [C-]#[N+]CC1=CC=NC=C1 AC8779 [0,2,0,0,0,0|0,0,1]=3 262 B9R1.15 C#CC1=C(C)C=CN=C1 AT12962 [0,2,0,0,0,0|1,0,0]=3 263 B9R1.15 C#CC1=C(N)C=NC=C1 D83940 [0,2,0,0,0,0|1,0,0]=3 264 B9R1.15 C#CC1=CC=CN=C1N 72370 [0,2,0,0,0,0|2,0,0]=4 265 B9R1.15 C=CC1=C(C)C=CC=C1 T72704 [0,2,0,0,0,0|2,0,0]=4 266 B9R1.15 C=CC1=C(C)C=CN=C1 P11580 [0,2,0,0,0,0|1,0,0]=3 267 B9R1.15 CC1=C(C#N)C=NN=C1 P16129 [0,2,0,0,0,0|1,0,1]=4 268 B9R1.15 CC1=C(C=O)C=NC=N1 O11269 [0,2,0,0,0,0|2,0,0]=4 269 B9R1.15 CC1=C(CCl)C=NC=C1 P10971 [0,2,0,0,0,0|1,0,0]=3 270 B9R1.15 CC1=C(CO)C=NC=N1 F31023 [0,2,0,0,0,0|2,0,0]=4 271 B9R1.15 CC1=C(NN)N=NC=C1 O11008 [0,2,0,0,0,0|2,0,0]=4 272 B9R1.15 CC1=CC=NN=C1C#N P12501 [0,2,0,0,0,0|2,0,0]=4 273 B9R1.15 CC1=CN=CN=C1C#N F53173 [0,2,0,0,0,0|1,0,1]=4 274 B9R1.15 CCC1=C(Br)C=CN=C1 H11182 [0,2,0,0,0,0|1,0,0]=3 275 B9R1.15 CCC1=C(N)N=NC=C1 S11451 [0,2,0,0,0,0|2,0,0]=4 276 B9R1.15 CCC1=CN=CN=C1O C15413 [0,2,0,0,0,0|2,0,0]=4 277 B9R1.15 CNC1=C(F)C=NC=N1 AT18309 [0,2,0,0,0,0|1,0,0]=3 278 B9R1.15 CNC1=C(I)C=NC=N1 AT18314 [0,2,0,0,0,0|1,0,0]=3 279 B9R1.15 COC1=C(Br)C=CN=C1 F10479 [0,2,0,0,0,0|1,0,0]=3 280 B9R1.15 COC1=C(C)C=NC=C1 D74380 [0,2,0,0,0,0|1,0,0]=3 281 B9R1.15 COC1=CC=NNC1=O 76149 [0,2,0,0,0,0|2,0,0]=4 282 B9R1.15 COC1=CN=CN=C1Br O11184 [0,2,0,0,0,0|2,0,0]=4 283 B9R1.15 N#CC1=C(O)C=NC=C1 AT12828 [0,2,0,0,0,0|0,0,1]=3 284 B9R1.15 N#CC1=C(S)C=CC=C1 AT20892 [0,2,0,0,0,0|1,0,1]=4 285 B9R1.15 N#CC1=C(S)C=CN=C1 C77520 [0,2,0,0,0,0|1,0,0]=3 286 B9R1.15 NC1=C(C=O)C=NC=C1 W12249 [0,2,0,0,0,0|0,0,0]=2 287 B9R1.15 NC1=C(CCl)C=CC=N1 89794 [0,2,0,0,0,0|2,0,0]=4 288 B9R1.15 NC1=C(CO)C=NC=N1 AT18389 [0,2,0,0,0,0|1,0,0]=3 289 B9R1.15 NCC1=C(Br)C=NC=C1 98160 [0,2,0,0,0,0|0,0,0]=2 290 B9R1.15 NCC1=C(Cl)C=CN=C1 C11073 [0,2,0,0,0,0|1,0,0]=3 291 B9R1.15 NCC1=C(F)C=CN=C1 C90218 [0,2,0,0,0,0|1,0,0]=3 292 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [0,2,0,0,0,0|1,0,0]=3 293 B9R1.15 NCC1=C(O)C=CC=N1 C73700 [0,2,0,0,0,0|2,0,0]=4 294 B9R1.15 NCC1=C(O)C=CN=C1 AT18117 [0,2,0,0,0,0|1,0,0]=3 295 B9R1.15 NCC1=CC=CN=C1Cl 37571 [0,2,0,0,0,0|2,0,0]=4 296 B9R1.15 NCC1=CC=CN=C1N CL0345 [0,2,0,0,0,0|2,0,0]=4 297 B9R1.15 NCC1=[N+]([O-])C=CC=C1 D86206 [0,2,0,0,0,0|2,0,0]=4 298 B9R1.15 NNC1=C(Br)C=CC=N1 F30216 [0,2,0,0,0,0|2,0,0]=4 299 B9R1.15 NNC1=CC=CN=C1Cl D76828 [0,2,0,0,0,0|2,0,0]=4 300 B9R1.15 O=CC1=CNC=CC1=O O11278 [0,2,0,0,0,0|1,0,1]=4 301 B9R1.15 OCC1=C(F)C=CN=C1 P11878 [0,2,0,0,0,0|1,0,0]=3 302 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [0,2,0,0,0,0|2,0,0]=4 303 B9R1.15 [C-]#[N+]C1=C(Cl)C=CC=C1 AC9402 [0,2,0,0,0,0|1,0,1]=4 304 B9R1.69 BrC1=C(Br)C=C(I)C=C1 T73057 [0,2,0,0,0,0|2,0,0]=4 305 B9R1.69 CC1=C(N)C=CC(S)=C1 AT20958 [0,2,0,0,0,0|1,0,0]=3 306 B9R1.69 CC1=C(O)N=C(Cl)N=C1 AC8001 [0,2,0,0,0,0|2,0,0]=4 307 B9R1.69 CC1=C(S)C=C(Br)C=C1 AT20875 [0,2,0,0,0,0|2,0,0]=4 308 B9R1.69 CC1=C(S)C=C(N)C=C1 AT20843 [0,2,0,0,0,0|1,0,0]=3 309 B9R1.69 CC1=C(S)C=CC(Br)=C1 AT20848 [0,2,0,0,0,0|2,0,0]=4 310 B9R1.69 CC1=C(S)N=C(S)N=C1 W17242 [0,2,0,0,0,0|2,0,0]=4 311 B9R1.69 CC1=CC(Br)=NC=C1O 96317 [0,2,0,0,0,0|1,0,0]=3 312 B9R1.69 CC1=CC(Br)=NN=C1C AT17779 [0,2,0,0,0,0|2,0,0]=4 313 B9R1.69 CC1=CC(C)=C(N)N=N1 A51049 [0,2,0,0,0,0|2,0,0]=4 314 B9R1.69 CC1=CC(Cl)=NN=C1N AT17812 [0,2,0,0,0,0|2,0,0]=4 315 B9R1.69 CC1=CC(I)=C(O)C=N1 96425 [0,2,0,0,0,0|1,0,0]=3 316 B9R1.69 CC1=CC(I)=NC=C1N 80294 [0,2,0,0,0,0|1,0,0]=3 317 B9R1.69 CC1=CC(N)=C(S)C=C1 AT19644 [0,2,0,0,0,0|1,0,0]=3 318 B9R1.69 CC1=CC(S)=C(Cl)C=C1 AT20814 [0,2,0,0,0,0|2,0,0]=4 319 B9R1.69 CC1=CC(S)=C(N)C=C1 AT19639 [0,2,0,0,0,0|1,0,0]=3 320 B9R1.69 CC1=CC(S)=C(N)C=C1 AT19640 [0,2,0,0,0,0|1,0,0]=3 321 B9R1.69 CC1=CC(S)=C(N)N=N1 P10200 [0,2,0,0,0,0|2,0,0]=4 322 B9R1.69 CC1=CC(S)=NN=C1C AT17808 [0,2,0,0,0,0|2,0,0]=4 323 B9R1.69 CC1=CC=C(N)C(N)=N1 C16371 [0,2,0,0,0,0|2,0,0]=4 324 B9R1.69 CC1=CC=C(N)C(O)=N1 68793 [0,2,0,0,0,0|2,0,0]=4 325 B9R1.69 CC1=CN=C(Cl)C=C1F F18561 [0,2,0,0,0,0|1,0,0]=3 326 B9R1.69 CC1=CN=C(N)C(N)=C1 27799 [0,2,0,0,0,0|2,0,0]=4 327 B9R1.69 CC1=CN=C(O)C=C1C AT24357 [0,2,0,0,0,0|1,0,0]=3 328 B9R1.69 CC1=NC(Cl)=C(I)C=N1 O11217 [0,2,0,0,0,0|2,0,0]=4 329 B9R1.69 CC1=[N+]([O-])C=CC(Cl)=C1 AT14034 [0,2,0,0,0,0|1,0,1]=4 330 B9R1.69 CN1C=CC(=O)C=C1Br C73679 [0,2,0,0,0,0|1,0,1]=4 331 B9R1.69 ClC1=C(Br)C=C(Br)C=C1 N12666 [0,2,0,0,0,0|2,0,0]=4 332 B9R1.69 ClC1=CC(I)=C(Cl)N=N1 AC3694 [0,2,0,0,0,0|2,0,0]=4 333 B9R1.69 FC1=C(Br)C=C(S)C=C1 AT20850 [0,2,0,0,0,0|2,0,0]=4 334 B9R1.69 FC1=C(Br)C=NC(Cl)=N1 F51201 [0,2,0,0,0,0|2,0,0]=4 335 B9R1.69 FC1=C(I)C=C(I)C=C1 AT18537 [0,2,0,0,0,0|2,0,0]=4 336 B9R1.69 FC1=C(S)C=C(Br)C=C1 AT20849 [0,2,0,0,0,0|2,0,0]=4 337 B9R1.69 FC1=C(S)C=C(Cl)C=C1 AT20862 [0,2,0,0,0,0|2,0,0]=4 338 B9R1.69 FC1=CC(Br)=C(S)C=C1 AT20837 [0,2,0,0,0,0|2,0,0]=4 339 B9R1.69 FC1=CC(Cl)=C(I)C=N1 O11206 [0,2,0,0,0,0|1,0,0]=3 340 B9R1.69 FC1=CC(S)=C(Br)C=C1 AT20853 [0,2,0,0,0,0|2,0,0]=4 341 B9R1.69 N=C1NC(O)=NC=C1F H10295 [0,2,0,0,0,0|1,0,1]=4 342 B9R1.69 NC1=C(Cl)C=C(O)C=N1 D87909 [0,2,0,0,0,0|2,0,0]=4 343 B9R1.69 NC1=C(F)C=C(Br)C=C1 36801 [0,2,0,0,0,0|1,0,0]=3 344 B9R1.69 NC1=C(I)C=C(Br)N=N1 94920 [0,2,0,0,0,0|2,0,0]=4 345 B9R1.69 NC1=C(I)C=C(Cl)C=C1 F13699 [0,2,0,0,0,0|1,0,0]=3 346 B9R1.69 NC1=C(I)C=NC(F)=C1 W19621 [0,2,0,0,0,0|0,0,0]=2 347 B9R1.69 NC1=C(O)C=CC(I)=C1 I10250 [0,2,0,0,0,0|1,0,0]=3 348 B9R1.69 NC1=C(S)C=C(Br)C=C1 AT20886 [0,2,0,0,0,0|1,0,0]=3 349 B9R1.69 NC1=C(S)C=CC(F)=C1 C90392 [0,2,0,0,0,0|1,0,0]=3 350 B9R1.69 NC1=CC(Br)=C(S)C=C1 AT20835 [0,2,0,0,0,0|1,0,0]=3 351 B9R1.69 NC1=CC(Cl)=C(S)C=C1 AT20821 [0,2,0,0,0,0|1,0,0]=3 352 B9R1.69 NC1=CC(Cl)=NNC1=O W19056 [0,2,0,0,0,0|1,0,0]=3 353 B9R1.69 NC1=CC(F)=CN=C1O AT11534 [0,2,0,0,0,0|2,0,0]=4 354 B9R1.69 NC1=CC(F)=CNC1=O AT11533 [0,2,0,0,0,0|2,0,0]=4 355 B9R1.69 NC1=CC(I)=C(F)C=C1 98239 [0,2,0,0,0,0|1,0,0]=3 356 B9R1.69 NC1=CC(O)=C(Br)C=C1 C91066 [0,2,0,0,0,0|1,0,0]=3 357 B9R1.69 NC1=CC(S)=C(Cl)C=C1 AT20816 [0,2,0,0,0,0|1,0,0]=3 358 B9R1.69 NC1=CC=C(Br)C(=O)N1 AT18218 [0,2,0,0,0,0|2,0,0]=4 359 B9R1.69 NC1=CC=C(F)C(Cl)=N1 91518 [0,2,0,0,0,0|2,0,0]=4 360 B9R1.69 NC1=CC=C(F)C(F)=N1 N16971 [0,2,0,0,0,0|2,0,0]=4 361 B9R1.69 NC1=CN=C(Cl)C=C1N SC3001 [0,2,0,0,0,0|0,0,0]=2 362 B9R1.69 NC1=CNC(=O)C=C1Cl 94340 [0,2,0,0,0,0|1,0,1]=4 363 B9R1.69 NC1=CNC(=O)N=C1N W10167 [0,2,0,0,0,0|1,0,1]=4 364 B9R1.69 NC1=NC(N)=C(Cl)C=C1 D87713 [0,2,0,0,0,0|2,0,0]=4 365 B9R1.69 O=C1C=C(Cl)C(Br)=CN1 C90977 [0,2,0,0,0,0|1,0,1]=4 366 B9R1.69 O=C1C=C(O)C(Cl)=CN1 43948 [0,2,0,0,0,0|1,0,1]=4 367 B9R1.69 OC1=C(Br)C=NC(F)=C1 F30342 [0,2,0,0,0,0|1,0,0]=3 368 B9R1.69 OC1=C(I)C=C(F)N=C1 AT19114 [0,2,0,0,0,0|1,0,0]=3 369 B9R1.69 OC1=C(I)C=NC(F)=C1 E71631 [0,2,0,0,0,0|1,0,0]=3 370 B9R1.69 OC1=CC(Br)=NC=C1Br 94341 [0,2,0,0,0,0|1,0,0]=3 371 B9R1.69 OC1=CC(I)=C(F)C=C1 79298 [0,2,0,0,0,0|2,0,0]=4 372 B9R1.69 OC1=CC(S)=C(O)C=C1 79473 [0,2,0,0,0,0|2,0,0]=4 373 B9R1.69 SC1=C(Br)C=CC(Cl)=C1 AT20839 [0,2,0,0,0,0|2,0,0]=4 374 B9R1.69 SC1=C(Cl)C=C(Br)C=C1 AT20954 [0,2,0,0,0,0|2,0,0]=4 375 B9R1.69 SC1=CC(Cl)=C(Br)C=C1 AT20846 [0,2,0,0,0,0|2,0,0]=4 376 B9R1.69 [BH3-]C1=C(F)C=NC(N)=C1 AC8350 [0,2,0,0,0,0|1,0,0]=3 377 B9R1.69 [O-][N+]1=C(Cl)C=C(I)C=C1 W15291 [0,2,0,0,0,0|1,0,1]=4 378 B9R1.69 [O-][N+]1=CC(Br)=C(Cl)C=C1 O10961 [0,2,0,0,0,0|1,0,1]=4 379 B9R1.3 CC1=C(Br)C(=O)NC=C1 29620 [0,2,0,0,0,0|1,0,1]=4 380 B9R1.3 CC1=C(F)C(=O)NC=N1 54993 [0,2,0,0,0,0|2,0,0]=4 381 B9R1.3 CC1=C(F)C(Br)=NC=N1 54994 [0,2,0,0,0,0|2,0,0]=4 382 B9R1.3 CC1=C(F)C(Cl)=NC=N1 C77032 [0,2,0,0,0,0|2,0,0]=4 383 B9R1.3 CC1=C(F)C=NC=C1O AC4170 [0,2,0,0,0,0|1,0,0]=3 384 B9R1.3 CC1=C(I)C(=O)C=CN1 D84797 [0,2,0,0,0,0|1,0,1]=4 385 B9R1.3 CC1=C(N)C(Cl)=NC=N1 W15310 [0,2,0,0,0,0|2,0,0]=4 386 B9R1.3 CC1=CC=CC(S)=C1C F20973 [0,2,0,0,0,0|2,0,0]=4 387 B9R1.3 CC1=CC=CC(S)=C1N AT19641 [0,2,0,0,0,0|1,0,0]=3 388 B9R1.3 CC1=CC=NC(C)=C1O F17537 [0,2,0,0,0,0|1,0,0]=3 389 B9R1.3 CC1=CC=NC(Cl)=C1I H11415 [0,2,0,0,0,0|1,0,0]=3 390 B9R1.3 CC1=CC=NC(F)=C1I AT21585 [0,2,0,0,0,0|1,0,0]=3 391 B9R1.3 CC1=CC=NC(N)=C1Cl D71951 [0,2,0,0,0,0|1,0,0]=3 392 B9R1.3 CC1=CC=NC(N)=C1I 65853 [0,2,0,0,0,0|1,0,0]=3 393 B9R1.3 CC1=CN=NC(N)=C1Br AT10447 [0,2,0,0,0,0|2,0,0]=4 394 B9R1.3 CC1=NC=CC(Cl)=C1N O11210 [0,2,0,0,0,0|1,0,0]=3 395 B9R1.3 CC1=NC=CC(N)=C1Br D96170 [0,2,0,0,0,0|0,0,0]=2 396 B9R1.3 CC1=NC=C[N+]([O-])=C1Cl F18066 [0,2,0,0,0,0|2,0,0]=4 397 B9R1.3 CC1=NC=NC(C)=C1N AT18386 [0,2,0,0,0,0|2,0,0]=4 398 B9R1.3 CN1C(=O)C=CN=C1N AT13875 [0,2,0,0,0,0|2,0,0]=4 399 B9R1.3 CN1C=CN=C(Cl)C1=O AT19208 [0,2,0,0,0,0|2,0,0]=4 400 B9R1.3 CN1C=CN=C(N)C1=O AT13880 [0,2,0,0,0,0|2,0,0]=4 401 B9R1.3 CN1N=CC=C(Cl)C1=O 55553 [0,2,0,0,0,0|2,0,0]=4 402 B9R1.3 ClC1=CC=NC(Br)=C1I C11069 [0,2,0,0,0,0|1,0,0]=3 403 B9R1.3 ClC1=CN=CC(Br)=C1Br O10907 [0,2,0,0,0,0|1,0,0]=3 404 B9R1.3 FC1=CC=CC(Br)=C1S AT20836 [0,2,0,0,0,0|2,0,0]=4 405 B9R1.3 FC1=CC=CC(Cl)=C1S AT20825 [0,2,0,0,0,0|2,0,0]=4 406 B9R1.3 FC1=CN=CC(F)=C1Br 24292 [0,2,0,0,0,0|1,0,0]=3 407 B9R1.3 FC1=CN=CC(F)=C1F C76146 [0,2,0,0,0,0|1,0,0]=3 408 B9R1.3 NC1=C(Br)C(=O)NC=N1 H10162 [0,2,0,0,0,0|1,0,1]=4 409 B9R1.3 NC1=C(F)C(=O)NC=C1 F18691 [0,2,0,0,0,0|0,0,1]=3 410 B9R1.3 NC1=C(S)C=CC=C1F C16304 [0,2,0,0,0,0|1,0,0]=3 411 B9R1.3 NC1=C(S)N=CN=C1Cl C91546 [0,2,0,0,0,0|2,0,0]=4 412 B9R1.3 NC1=CC=CC(Cl)=C1S AT19651 [0,2,0,0,0,0|1,0,0]=3 413 B9R1.3 NC1=CC=CC(I)=C1Cl D96226 [0,2,0,0,0,0|1,0,0]=3 414 B9R1.3 NC1=CC=CC(N)=C1N C75845 [0,2,0,0,0,0|1,0,0]=3 415 B9R1.3 NC1=CC=CC(N)=C1O O10621 [0,2,0,0,0,0|1,0,0]=3 416 B9R1.3 NC1=CC=CC(O)=C1O 30915 [0,2,0,0,0,0|1,0,0]=3 417 B9R1.3 NC1=NC=CC(N)=C1N 98115 [0,2,0,0,0,0|0,0,0]=2 418 B9R1.3 NC1=NC=CC(N)=C1N CS1386 [0,2,0,0,0,0|0,0,0]=2 419 B9R1.3 NC1=NC=NC(N)=C1Cl P20502 [0,2,0,0,0,0|1,0,0]=3 420 B9R1.3 O=C1NC=CC(Br)=C1Br 91734 [0,2,0,0,0,0|1,0,1]=4 421 B9R1.3 OC1=CC=CC(I)=C1O D82483 [0,2,0,0,0,0|2,0,0]=4 422 B9R1.3 OC1=CC=NC(F)=C1Cl 91690 [0,2,0,0,0,0|1,0,0]=3 423 B9R1.3 OC1=CN=CC(Br)=C1F N16972 [0,2,0,0,0,0|1,0,0]=3 424 B9R1.3 OC1=NC=NC(O)=C1Cl S10271 [0,2,0,0,0,0|2,0,0]=4 425 B9R1.3 [2H]C1=CC=CC(I)=C1[2H] D97970 [0,2,0,0,0,0|2,0,0]=4 426 B9R1.34 CC1=CC(Cl)=CC(F)=N1 91500 [0,2,0,0,0,0|1,0,0]=3 427 B9R1.34 CC1=CC(F)=CC(F)=N1 C16435 [0,2,0,0,0,0|1,0,0]=3 428 B9R1.34 CC1=CC(F)=NC(N)=N1 92215 [0,2,0,0,0,0|2,0,0]=4 429 B9R1.34 CC1=CC(I)=CC(C)=N1 O11249 [0,2,0,0,0,0|1,0,0]=3 430 B9R1.34 CC1=CC(N)=CC(=O)O1 W11226 [0,2,0,0,0,0|1,0,0]=3 431 B9R1.34 CC1=CC(N)=CC(O)=N1 D80759 [0,2,0,0,0,0|0,0,0]=2 432 B9R1.34 CC1=CC(O)=CC(Cl)=N1 C15794 [0,2,0,0,0,0|1,0,0]=3 433 B9R1.34 ClC1=CC(I)=CC(Br)=N1 AT13204 [0,2,0,0,0,0|1,0,0]=3 434 B9R1.34 FC1=NC(Cl)=NC(Cl)=C1 A51075 [0,2,0,0,0,0|2,0,0]=4 435 B9R1.34 NC1=CC(Br)=CC(F)=N1 E71786 [0,2,0,0,0,0|1,0,0]=3 436 B9R1.34 NC1=CC(Br)=CC(O)=C1 53862 [0,2,0,0,0,0|1,0,0]=3 437 B9R1.34 NC1=CC(Cl)=NC(=O)N1 90675 [0,2,0,0,0,0|1,0,0]=3 438 B9R1.34 NC1=CC(I)=CC(I)=C1 59844 [0,2,0,0,0,0|1,0,0]=3 439 B9R1.34 NC1=CC(N)=NC(O)=N1 H10201 [0,2,0,0,0,0|1,0,0]=3 440 B9R1.34 NC1=CC(O)=CC(O)=C1 11229 [0,2,0,0,0,0|1,0,0]=3 441 B9R1.34 NC1=NC(I)=CC(I)=N1 F21429 [0,2,0,0,0,0|2,0,0]=4 442 B9R1.34 O=C1C=C(Cl)N=C(Cl)N1 26535 [0,2,0,0,0,0|2,0,0]=4 443 B9R1.34 OC1=CC(O)=NC(O)=N1 S12330 [0,2,0,0,0,0|2,0,0]=4 444 B9R1.34 SC1=CC(Br)=CC(Cl)=C1 AT20882 [0,2,0,0,0,0|2,0,0]=4 445 B9R1.34 SC1=CC(S)=CC(S)=C1 T70854 [0,2,0,0,0,0|2,0,0]=4 446 B9R1.34 [2H]C1=CC([2H])=CC(Cl)=C1 D99131 [0,2,0,0,0,0|2,0,0]=4 447 B9R1.34 [2H]C1=CC([2H])=CC(O)=C1 D99082 [0,2,0,0,0,0|2,0,0]=4 448 B5R1.1 C1=CNC=N1 AT25065 [1,0,0,0,1,0|1,0,0]=3 449 B5R1.1 C1=CNC=N1 T71525 [1,0,0,0,1,0|1,0,0]=3 450 B5R1.1 C1=CNC=N1 T72823 [1,0,0,0,1,0|1,0,0]=3