0 B8R1.5 BrC1=CN=CN=C1I P11647 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.5 CC1=CC=NNC1=O 20227 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.5 CC1=CN=CN=C1Cl 72600 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.5 CC1=CN=NC=C1C C15709 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.5 CC1=NC=CN=C1I P10643 [0,0,0,0,0,0|1,0,0]=1 5 B8R1.5 CC1=[N+](C)C=CC=C1 D87448 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.5 FC1=CC=CN=C1S AT18759 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.5 FC1=NC=CN=C1I D76573 [0,0,0,0,0,0|2,0,0]=2 8 B8R1.5 IC1=NC=CN=C1I N13386 [0,0,0,0,0,0|2,0,0]=2 9 B8R1.5 OC1=C(Cl)C=NC=N1 25825 [0,0,0,0,0,0|4,0,0]=4 10 B8R1.5 OC1=[13C](O)C=CC=C1 D98565 [0,0,0,0,0,0|4,0,0]=4 11 B8R1.5 [2H]C1=C([2H])C=CC=C1 D97880 [0,0,0,0,0,0|4,0,0]=4 12 B7R1.3 ClC1=CN=NC=C1 F19795 [1,0,0,0,0,0|3,0,0]=4 13 B7R1.3 ClC1=NC=CC=N1 F20795 [1,0,0,0,0,0|3,0,0]=4 14 B7R1.3 ClC1=NC=NC=C1 F18311 [1,0,0,0,0,0|3,0,0]=4 15 B7R1.3 FC1=CN=CN=C1 F14737 [1,0,0,0,0,0|3,0,0]=4 16 B7R1.3 F[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 40525 [1,0,0,0,0,0|3,0,0]=4 17 B7R1.3 IC1=NC=NC=C1 C15557 [1,0,0,0,0,0|3,0,0]=4 18 B7R1.3 O=C1C=NN=CN1 F30273 [1,0,0,0,0,0|2,0,1]=4 19 B7R1.3 OC1=CN=NC=C1 O12057 [1,0,0,0,0,0|3,0,0]=4 20 B7R1.3 SC1=NN=CC=C1 AT13031 [1,0,0,0,0,0|3,0,0]=4 21 B7R1.3 [15NH2]C1=CC=CC=C1 41405 [1,0,0,0,0,0|3,0,0]=4 22 B7R1.3 [2H]C1=CC=CC=C1 D98570 [1,0,0,0,0,0|3,0,0]=4 23 B7R1.3 [2H]C1=NC=CC=C1 D98277 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.3 CC1=C(F)C(=O)NC=N1 54993 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.3 CC1=C(F)C(Br)=NC=N1 54994 [0,1,0,0,0,0|3,0,0]=4 26 B9R1.3 CC1=C(F)C(Cl)=NC=N1 C77032 [0,1,0,0,0,0|3,0,0]=4 27 B9R1.3 CC1=C(I)C(=O)C=CN1 D84797 [0,1,0,0,0,0|2,0,1]=4 28 B9R1.3 CC1=C(N)C(Cl)=NC=N1 W15310 [0,1,0,0,0,0|3,0,0]=4 29 B9R1.3 CC1=CC=CC(S)=C1C F20973 [0,1,0,0,0,0|2,0,0]=3 30 B9R1.3 CC1=CC=CC(S)=C1N AT19641 [0,1,0,0,0,0|3,0,0]=4 31 B9R1.3 CC1=CC=NC(C)=C1O F17537 [0,1,0,0,0,0|2,0,0]=3 32 B9R1.3 CC1=CC=NC(Cl)=C1I H11415 [0,1,0,0,0,0|3,0,0]=4 33 B9R1.3 CC1=CC=NC(F)=C1I AT21585 [0,1,0,0,0,0|3,0,0]=4 34 B9R1.3 CC1=CC=NC(N)=C1Cl D71951 [0,1,0,0,0,0|3,0,0]=4 35 B9R1.3 CC1=CC=NC(N)=C1I 65853 [0,1,0,0,0,0|3,0,0]=4 36 B9R1.3 CC1=NC=CC(Cl)=C1N O11210 [0,1,0,0,0,0|2,0,0]=3 37 B9R1.3 CC1=NC=CC(N)=C1Br D96170 [0,1,0,0,0,0|2,0,0]=3 38 B9R1.3 CC1=NC=C[N+]([O-])=C1Cl F18066 [0,1,0,0,0,0|1,0,1]=3 39 B9R1.3 CC1=NC=NC(C)=C1N AT18386 [0,1,0,0,0,0|3,0,0]=4 40 B9R1.3 CN1C(=O)C=CN=C1N AT13875 [0,1,0,0,0,0|3,0,0]=4 41 B9R1.3 CN1C=CN=C(Cl)C1=O AT19208 [0,1,0,0,0,0|2,0,1]=4 42 B9R1.3 CN1C=CN=C(N)C1=O AT13880 [0,1,0,0,0,0|2,0,1]=4 43 B9R1.3 CN1N=CC=C(Cl)C1=O 55553 [0,1,0,0,0,0|3,0,0]=4 44 B9R1.3 ClC1=CC=NC(Br)=C1I C11069 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.3 NC1=NC=CC(N)=C1N 98115 [0,1,0,0,0,0|3,0,0]=4 46 B9R1.3 NC1=NC=CC(N)=C1N CS1386 [0,1,0,0,0,0|3,0,0]=4 47 B9R1.3 OC1=CC=NC(F)=C1Cl 91690 [0,1,0,0,0,0|3,0,0]=4 48 B9R1.15 C#CC1=CC=CN=C1C AT12964 [0,1,0,0,0,0|1,0,1]=3 49 B9R1.15 C#CC1=CC=CN=C1Cl AT12435 [0,1,0,0,0,0|2,0,1]=4 50 B9R1.15 C#CC1=CC=CN=C1N 72370 [0,1,0,0,0,0|2,0,1]=4 51 B9R1.15 C#CC1=NC=CC=C1C 79080 [0,1,0,0,0,0|1,0,1]=3 52 B9R1.15 C#CC1=NC=CN=C1Cl N13059 [0,1,0,0,0,0|1,0,1]=3 53 B9R1.15 C=CC1=C(C)C=CC=C1 T72704 [0,1,0,0,0,0|2,0,1]=4 54 B9R1.15 C=CC1=CC=CN=C1F P13082 [0,1,0,0,0,0|2,0,1]=4 55 B9R1.15 CC1=C(C=O)C=NC=N1 O11269 [0,1,0,0,0,0|2,0,1]=4 56 B9R1.15 CC1=C(CBr)C=CC=N1 FD9046 [0,1,0,0,0,0|1,0,0]=2 57 B9R1.15 CC1=C(CBr)C=CC=N1 P11218 [0,1,0,0,0,0|1,0,0]=2 58 B9R1.15 CC1=C(CCl)C=CC=N1 P10970 [0,1,0,0,0,0|1,0,0]=2 59 B9R1.15 CC1=C(CCl)C=NC=C1 P10971 [0,1,0,0,0,0|3,0,0]=4 60 B9R1.15 CC1=C(CO)C=NC=N1 F31023 [0,1,0,0,0,0|2,0,0]=3 61 B9R1.15 CC1=C(NN)N=NC=C1 O11008 [0,1,0,0,0,0|3,0,0]=4 62 B9R1.15 CC1=CC=CN=C1CBr D97530 [0,1,0,0,0,0|1,0,0]=2 63 B9R1.15 CC1=CC=NN=C1C#N P12501 [0,1,0,0,0,0|2,0,1]=4 64 B9R1.15 CC1=CN=CN=C1C#N F53173 [0,1,0,0,0,0|2,0,1]=4 65 B9R1.15 CC1=NC=CN=C1CCl P17257 [0,1,0,0,0,0|0,0,0]=1 66 B9R1.15 CC1=NC=CN=C1CN 38702 [0,1,0,0,0,0|0,0,0]=1 67 B9R1.15 CCC1=C(N)N=NC=C1 S11451 [0,1,0,0,0,0|3,0,0]=4 68 B9R1.15 CCC1=CC=CN=C1C 75814 [0,1,0,0,0,0|1,0,0]=2 69 B9R1.15 CCC1=CN=CN=C1O C15413 [0,1,0,0,0,0|3,0,0]=4 70 B9R1.15 CNC1=C(F)C=NC=N1 AT18309 [0,1,0,0,0,0|3,0,0]=4 71 B9R1.15 CNC1=C(I)C=NC=N1 AT18314 [0,1,0,0,0,0|3,0,0]=4 72 B9R1.15 COC1=C(C)C=NC=C1 D74380 [0,1,0,0,0,0|3,0,0]=4 73 B9R1.15 COC1=CN=CN=C1Br O11184 [0,1,0,0,0,0|3,0,0]=4 74 B9R1.15 ClC1=CC=CN=C1CBr 79180 [0,1,0,0,0,0|2,0,0]=3 75 B9R1.15 ClC1=CC=CN=C1CBr 86640 [0,1,0,0,0,0|2,0,0]=3 76 B9R1.15 ClCC1=CC=CN=C1Br 55187 [0,1,0,0,0,0|2,0,0]=3 77 B9R1.15 FC1=C(CBr)C=CC=N1 AT20654 [0,1,0,0,0,0|2,0,0]=3 78 B9R1.15 NC1=C(CCl)C=CC=N1 89794 [0,1,0,0,0,0|2,0,0]=3 79 B9R1.15 NC1=C(CO)C=NC=N1 AT18389 [0,1,0,0,0,0|3,0,0]=4 80 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [0,1,0,0,0,0|3,0,0]=4 81 B9R1.15 NCC1=C(O)C=CC=N1 C73700 [0,1,0,0,0,0|2,0,0]=3 82 B9R1.15 NCC1=CC=CN=C1Cl 37571 [0,1,0,0,0,0|2,0,0]=3 83 B9R1.15 NCC1=CC=CN=C1N CL0345 [0,1,0,0,0,0|2,0,0]=3 84 B9R1.15 NNC1=C(Br)C=CC=N1 F30216 [0,1,0,0,0,0|3,0,0]=4 85 B9R1.15 NNC1=CC=CN=C1Cl D76828 [0,1,0,0,0,0|3,0,0]=4 86 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [0,1,0,0,0,0|3,0,0]=4 87 B9R1.15 [O-][N+]1=C(CCl)N=CC=C1 AT18290 [0,1,0,0,0,0|3,0,0]=4 88 B9R1.69 BrC1=CN=C(Br)C(Br)=N1 I10240 [0,1,0,0,0,0|2,0,0]=3 89 B9R1.69 BrC1=CN=C(I)C(Br)=C1 AT22131 [0,1,0,0,0,0|3,0,0]=4 90 B9R1.69 BrC1=CN=C(I)C(Br)=N1 D80054 [0,1,0,0,0,0|2,0,0]=3 91 B9R1.69 CC1=C(C)N=C(Br)C=C1 F16237 [0,1,0,0,0,0|1,0,0]=2 92 B9R1.69 CC1=C(C)N=C(O)C=C1 F51184 [0,1,0,0,0,0|1,0,0]=2 93 B9R1.69 CC1=C(C)NC(=O)C=C1 F52969 [0,1,0,0,0,0|1,0,1]=3 94 B9R1.69 CC1=C(Cl)C=C(Cl)C=N1 61810 [0,1,0,0,0,0|2,0,0]=3 95 B9R1.69 CC1=C(F)N=C(Br)C=C1 AT22416 [0,1,0,0,0,0|2,0,0]=3 96 B9R1.69 CC1=C(N)C=CC(S)=C1 AT20958 [0,1,0,0,0,0|3,0,0]=4 97 B9R1.69 CC1=C(O)N=C(Cl)N=C1 AC8001 [0,1,0,0,0,0|3,0,0]=4 98 B9R1.69 CC1=C(S)C=C(Br)C=C1 AT20875 [0,1,0,0,0,0|3,0,0]=4 99 B9R1.69 CC1=C(S)C=C(N)C=C1 AT20843 [0,1,0,0,0,0|3,0,0]=4 100 B9R1.69 CC1=C(S)C=CC(Br)=C1 AT20848 [0,1,0,0,0,0|3,0,0]=4 101 B9R1.69 CC1=C(S)N=C(S)N=C1 W17242 [0,1,0,0,0,0|3,0,0]=4 102 B9R1.69 CC1=CC(Br)=COC1=O E71746 [0,1,0,0,0,0|3,0,0]=4 103 B9R1.69 CC1=CC(Br)=NN=C1C AT17779 [0,1,0,0,0,0|2,0,0]=3 104 B9R1.69 CC1=CC(C)=C(N)N=N1 A51049 [0,1,0,0,0,0|3,0,0]=4 105 B9R1.69 CC1=CC(Cl)=NN=C1N AT17812 [0,1,0,0,0,0|3,0,0]=4 106 B9R1.69 CC1=CC(I)=C(Br)N=C1 I10150 [0,1,0,0,0,0|3,0,0]=4 107 B9R1.69 CC1=CC(I)=C(Cl)N=C1 I10136 [0,1,0,0,0,0|3,0,0]=4 108 B9R1.69 CC1=CC(S)=NN=C1C AT17808 [0,1,0,0,0,0|2,0,0]=3 109 B9R1.69 CC1=CC=C(Cl)N=C1Br O10690 [0,1,0,0,0,0|2,0,0]=3 110 B9R1.69 CC1=CC=C(N)C(N)=N1 C16371 [0,1,0,0,0,0|3,0,0]=4 111 B9R1.69 CC1=CC=C(N)C(O)=N1 68793 [0,1,0,0,0,0|3,0,0]=4 112 B9R1.69 CC1=CN=C(N)C(N)=C1 27799 [0,1,0,0,0,0|3,0,0]=4 113 B9R1.69 CC1=CN=C(O)C=C1C AT24357 [0,1,0,0,0,0|3,0,0]=4 114 B9R1.69 CC1=NC(Br)=CN=C1Br N13385 [0,1,0,0,0,0|1,0,0]=2 115 B9R1.69 ClC1=C(Cl)N=C(Br)C=C1 N12997 [0,1,0,0,0,0|3,0,0]=4 116 B9R1.69 ClC1=CC=C(Br)N=C1Br C15980 [0,1,0,0,0,0|3,0,0]=4 117 B9R1.69 FC1=CC(I)=C(Br)N=C1 AT19915 [0,1,0,0,0,0|3,0,0]=4 118 B9R1.69 FC1=CC(I)=C(Cl)N=C1 O10733 [0,1,0,0,0,0|3,0,0]=4 119 B9R1.69 NC1=C(Cl)C=C(O)C=N1 D87909 [0,1,0,0,0,0|3,0,0]=4 120 B9R1.69 NC1=C(O)N=CC(Cl)=N1 C91505 [0,1,0,0,0,0|2,0,0]=3 121 B9R1.69 NC1=CC(F)=CN=C1O AT11534 [0,1,0,0,0,0|3,0,0]=4 122 B9R1.69 NC1=CC=C(F)C(Cl)=N1 91518 [0,1,0,0,0,0|3,0,0]=4 123 B9R1.69 NC1=CC=C(F)C(F)=N1 N16971 [0,1,0,0,0,0|3,0,0]=4 124 B9R1.69 NC1=CN=C(Cl)C(N)=N1 93309 [0,1,0,0,0,0|2,0,0]=3 125 B9R1.69 NC1=NC(N)=C(Cl)C=C1 D87713 [0,1,0,0,0,0|3,0,0]=4 126 B9R1.69 NC1=NC=C(Cl)N=C1I N11852 [0,1,0,0,0,0|2,0,0]=3 127 B9R1.69 OC1=C(Cl)N=C(Br)C=C1 F30996 [0,1,0,0,0,0|3,0,0]=4 128 B9R1.69 OC1=C(I)C=C(F)C=N1 D74689 [0,1,0,0,0,0|3,0,0]=4 129 B9R1.69 OC1=C(I)C=CC(Cl)=N1 N10090 [0,1,0,0,0,0|3,0,0]=4 130 B9R1.69 OC1=CC(Cl)=CN=C1Cl 92617 [0,1,0,0,0,0|3,0,0]=4 131 B9R1.69 OC1=CC(Cl)=CN=C1I C92793 [0,1,0,0,0,0|3,0,0]=4 132 B9R1.69 OC1=CC(F)=CN=C1I C91418 [0,1,0,0,0,0|3,0,0]=4 133 B9R1.69 OC1=NC(Br)=C(I)C=C1 N10163 [0,1,0,0,0,0|3,0,0]=4 134 B9R1.69 OC1=NC(Cl)=C(Br)C=C1 AC3279 [0,1,0,0,0,0|3,0,0]=4 135 B7R1.4 BrC1=C(Br)SC=N1 C11305 [0,0,0,0,1,0|3,0,0]=4 136 B7R1.4 BrC1=C(I)C=CS1 AT16380 [0,0,0,0,1,0|3,0,0]=4 137 B7R1.4 CC1=C(Br)C=NN1 O11185 [0,0,0,0,1,0|2,0,1]=4 138 B7R1.4 CC1=C(Br)NN=N1 27531 [0,0,0,0,1,0|2,0,1]=4 139 B7R1.4 CC1=C(Br)OC=C1 F53471 [0,0,0,0,1,0|2,0,0]=3 140 B7R1.4 CC1=C(C)CNC1 AT22666 [0,0,0,0,1,0|2,0,1]=4 141 B7R1.4 CC1=C(I)NN=C1 72687 [0,0,0,0,1,0|2,0,1]=4 142 B7R1.4 CC1=C(N)C=NO1 AT19805 [0,0,0,0,1,0|3,0,0]=4 143 B7R1.4 CC1=C(N)N=CN1 C15418 [0,0,0,0,1,0|1,0,1]=3 144 B7R1.4 CC1=C(N)NN=C1 P11216 [0,0,0,0,1,0|2,0,1]=4 145 B7R1.4 CC1=C(S)C=CS1 A10974 [0,0,0,0,1,0|2,0,0]=3 146 B7R1.4 CC1=CNN=C1I 72684 [0,0,0,0,1,0|2,0,0]=3 147 B7R1.4 CC1=NN=NN1C F16819 [0,0,0,0,1,0|2,0,0]=3 148 B7R1.4 CC1=NNC=C1Cl AT10929 [0,0,0,0,1,0|2,0,0]=3 149 B7R1.4 CC1=NOC=C1N AT19806 [0,0,0,0,1,0|2,0,0]=3 150 B7R1.4 CN1C=NN=C1Cl C90502 [0,0,0,0,1,0|3,0,0]=4 151 B7R1.4 CN1C=NN=C1I 98649 [0,0,0,0,1,0|3,0,0]=4 152 B7R1.4 CN1C=NN=C1N AT21330 [0,0,0,0,1,0|3,0,0]=4 153 B7R1.4 CN1N=CC=C1Cl AT15843 [0,0,0,0,1,0|2,0,0]=3 154 B7R1.4 CN1N=CN=C1Cl AT12341 [0,0,0,0,1,0|2,0,0]=3 155 B7R1.4 CN1N=CNC1=O AT21264 [0,0,0,0,1,0|2,0,1]=4 156 B7R1.4 ClC1=C(Br)N=CN1 AT15551 [0,0,0,0,1,0|2,0,1]=4 157 B7R1.4 NC1=C(Br)C=CS1 C16366 [0,0,0,0,1,0|3,0,0]=4 158 B7R1.4 NC1=C(Cl)SC=C1 AT16569 [0,0,0,0,1,0|3,0,0]=4 159 B7R1.4 NC1=CNN=C1N 37367 [0,0,0,0,1,0|3,0,0]=4 160 B7R1.4 NC1=NOC=C1Cl A50064 [0,0,0,0,1,0|3,0,0]=4 161 B7R1.4 OC1=NSN=C1Cl AT12141 [0,0,0,0,1,0|3,0,0]=4 162 B8R1.2 BrCC1=CN=CN=C1 F52462 [1,1,0,0,0,0|2,0,0]=4 163 B8R1.2 BrCC1=NC=CC=N1 D79434 [1,1,0,0,0,0|2,0,0]=4 164 B8R1.2 C=CC1=CC=CN=C1 71366 [1,1,0,0,0,0|1,0,1]=4 165 B8R1.2 C=CC1=NC=CN=C1 T72447 [1,1,0,0,0,0|0,0,1]=3 166 B8R1.2 CNC1=CC=CN=N1 79165 [1,1,0,0,0,0|2,0,0]=4 167 B8R1.2 CSC1=NC=CC=N1 O10841 [1,1,0,0,0,0|2,0,0]=4 168 B8R1.2 ClCC1=NC=NC=C1 A10562 [1,1,0,0,0,0|2,0,0]=4 169 B8R1.2 NCC1=CC=CC=C1 T70846 [1,1,0,0,0,0|2,0,0]=4 170 B8R1.2 SCC1=NC=CN=C1 78318 [1,1,0,0,0,0|0,0,0]=2 171 B8R1.3 CC1=CN=C(C)N=C1 C15366 [1,1,0,0,0,0|2,0,0]=4 172 B8R1.3 CC1=CN=C(Cl)N=C1 F13414 [1,1,0,0,0,0|2,0,0]=4 173 B8R1.3 CC1=CN=C(I)N=C1 90174 [1,1,0,0,0,0|2,0,0]=4 174 B8R1.3 CC1=CN=C(O)N=C1 W10551 [1,1,0,0,0,0|2,0,0]=4 175 B8R1.3 CC1=NC=C(I)C=N1 82252 [1,1,0,0,0,0|2,0,0]=4 176 B8R1.3 NC1=CN=C(O)C=N1 N13380 [1,1,0,0,0,0|1,0,0]=3 177 B8R1.3 NC1=CN=C(S)C=C1 AT20609 [1,1,0,0,0,0|2,0,0]=4 178 B8R1.4 BrC1=CC(I)=NC=C1 A10666 [1,1,0,0,0,0|2,0,0]=4 179 B8R1.4 CC1=CC(I)=NC=C1 D87895 [1,1,0,0,0,0|2,0,0]=4 180 B8R1.4 CC1=CC=NC(I)=N1 N13215 [1,1,0,0,0,0|2,0,0]=4 181 B8R1.4 CC1=NC(N)=CN=N1 D86296 [1,1,0,0,0,0|1,0,0]=3 182 B8R1.4 ClC1=NC(Cl)=NN=C1 F53483 [1,1,0,0,0,0|2,0,0]=4 183 B8R1.4 NC1=NC(Cl)=NN=C1 92269 [1,1,0,0,0,0|2,0,0]=4 184 B8R1.4 OC1=CC(I)=CN=C1 D74429 [1,1,0,0,0,0|2,0,0]=4 185 B8R1.4 SC1=CC(Br)=CN=C1 P12662 [1,1,0,0,0,0|2,0,0]=4 186 B8R1.4 [2H]C1=CC=CC([2H])=N1 D98925 [1,1,0,0,0,0|2,0,0]=4 187 B8R1.11 C=CN1C=CN=C1C T72225 [0,1,0,0,1,0|1,0,1]=4 188 B8R1.11 CC1=C(C#N)C=CO1 AT17522 [0,1,0,0,1,0|1,0,1]=4 189 B8R1.11 CC1=C(C#N)N=CO1 58494 [0,1,0,0,1,0|1,0,1]=4 190 B8R1.11 CC1=C(C#N)SC=N1 AT15031 [0,1,0,0,1,0|1,0,1]=4 191 B8R1.11 CC1=C(C=O)C=CS1 AT16762 [0,1,0,0,1,0|1,0,1]=4 192 B8R1.11 CC1=C(C=O)N=CO1 AT18594 [0,1,0,0,1,0|1,0,1]=4 193 B8R1.11 CC1=C(CBr)SC=N1 AT24615 [0,1,0,0,1,0|1,0,0]=3 194 B8R1.11 CC1=C(CCl)C=NO1 AC2811 [0,1,0,0,1,0|2,0,0]=4 195 B8R1.11 CC1=C(CCl)N=CS1 AT15300 [0,1,0,0,1,0|1,0,0]=3 196 B8R1.11 CC1=C(CCl)OC=N1 C11081 [0,1,0,0,1,0|1,0,0]=3 197 B8R1.11 CC1=C(CCl)SC=N1 74336 [0,1,0,0,1,0|1,0,0]=3 198 B8R1.11 CC1=C(CCl)SC=N1 AT15073 [0,1,0,0,1,0|1,0,0]=3 199 B8R1.11 CC1=C(CN)C=CO1 AT17524 [0,1,0,0,1,0|1,0,0]=3 200 B8R1.11 CC1=C(CN)C=CO1 AT17541 [0,1,0,0,1,0|1,0,0]=3 201 B8R1.11 CC1=C(CN)C=CS1 AT16801 [0,1,0,0,1,0|1,0,0]=3 202 B8R1.11 CC1=C(CN)C=NO1 72465 [0,1,0,0,1,0|2,0,0]=4 203 B8R1.11 CC1=C(CN)C=NO1 W10068 [0,1,0,0,1,0|2,0,0]=4 204 B8R1.11 CC1=C(CN)N=CN1 AT15470 [0,1,0,0,1,0|0,0,1]=3 205 B8R1.11 CC1=C(CN)N=CO1 AT18605 [0,1,0,0,1,0|1,0,0]=3 206 B8R1.11 CC1=C(CN)NC=N1 F19544 [0,1,0,0,1,0|0,0,1]=3 207 B8R1.11 CC1=C(CN)OC=C1 AT17196 [0,1,0,0,1,0|1,0,0]=3 208 B8R1.11 CC1=C(CN)OC=N1 AT18687 [0,1,0,0,1,0|1,0,0]=3 209 B8R1.11 CC1=C(CN)SC=C1 71361 [0,1,0,0,1,0|1,0,0]=3 210 B8R1.11 CC1=C(CO)N=CS1 AT21447 [0,1,0,0,1,0|1,0,0]=3 211 B8R1.11 CC1=C(CO)ON=C1 A51017 [0,1,0,0,1,0|2,0,0]=4 212 B8R1.11 CC1=C(CO)SC=N1 74180 [0,1,0,0,1,0|1,0,0]=3 213 B8R1.11 CC1=CNN=C1CCl AT15943 [0,1,0,0,1,0|1,0,0]=3 214 B8R1.11 CC1=CON=C1C#N 95086 [0,1,0,0,1,0|1,0,1]=4 215 B8R1.11 CC1=CON=C1CO 95084 [0,1,0,0,1,0|1,0,0]=3 216 B8R1.11 CC1=CSC=C1CN AT16790 [0,1,0,0,1,0|2,0,0]=4 217 B8R1.11 CC1=NOC=C1CCl AT19032 [0,1,0,0,1,0|1,0,0]=3 218 B8R1.11 CC1=NON=C1CBr D74168 [0,1,0,0,1,0|1,0,0]=3 219 B8R1.11 CC1=NON=C1CCl 70874 [0,1,0,0,1,0|1,0,0]=3 220 B8R1.11 CC1=NON=C1CO D74169 [0,1,0,0,1,0|1,0,0]=3 221 B8R1.11 CC1=NSC=C1CO AT21132 [0,1,0,0,1,0|1,0,0]=3 222 B8R1.11 CCC1=C(N)SC=N1 W15853 [0,1,0,0,1,0|2,0,0]=4 223 B8R1.11 CCC1=CNN=C1N 24047 [0,1,0,0,1,0|2,0,0]=4 224 B8R1.11 CCC1=NNC=C1I I11378 [0,1,0,0,1,0|2,0,0]=4 225 B8R1.11 CCC1=NNC=C1N AT14204 [0,1,0,0,1,0|2,0,0]=4 226 B8R1.11 CCN1C=CN=C1C F16031 [0,1,0,0,1,0|1,0,0]=3 227 B8R1.11 CCN1C=CN=C1N AT15605 [0,1,0,0,1,0|2,0,0]=4 228 B8R1.11 CCN1N=CC=C1Br F17300 [0,1,0,0,1,0|2,0,0]=4 229 B8R1.11 CCN1N=CC=C1Cl AT15849 [0,1,0,0,1,0|2,0,0]=4 230 B8R1.11 CCN1N=CC=C1O AT14056 [0,1,0,0,1,0|2,0,0]=4 231 B8R1.11 CCN1N=CN=C1N AT12360 [0,1,0,0,1,0|2,0,0]=4 232 B8R1.11 CCN1N=CN=C1N AT12361 [0,1,0,0,1,0|2,0,0]=4 233 B8R1.11 CN1C=CN=C1CBr AT15680 [0,1,0,0,1,0|1,0,0]=3 234 B8R1.11 CN1C=CN=C1CN AT15625 [0,1,0,0,1,0|1,0,0]=3 235 B8R1.11 CN1C=NN=C1CCl 94779 [0,1,0,0,1,0|2,0,0]=4 236 B8R1.11 CN1C=NN=C1CN F10337 [0,1,0,0,1,0|2,0,0]=4 237 B8R1.11 CN1N=CC=C1CBr AT15925 [0,1,0,0,1,0|1,0,0]=3 238 B8R1.11 CN1N=CN=C1CO AT21385 [0,1,0,0,1,0|1,0,0]=3 239 B8R1.11 CN1N=CN=C1CO AT21388 [0,1,0,0,1,0|1,0,0]=3 240 B8R1.11 CN1N=NC=C1CN AT13362 [0,1,0,0,1,0|2,0,0]=4 241 B8R1.11 CNC1=CC=NN1C AT14117 [0,1,0,0,1,0|1,0,0]=3 242 B8R1.11 CNC1=CSN=C1C AT21113 [0,1,0,0,1,0|1,0,0]=3 243 B8R1.11 CNC1=NC=CN1C AT15602 [0,1,0,0,1,0|1,0,0]=3 244 B8R1.11 CNC1=NN=CN1C AT21331 [0,1,0,0,1,0|2,0,0]=4 245 B8R1.11 CNC1=NNC=C1C 57305 [0,1,0,0,1,0|1,0,0]=3 246 B8R1.11 COC1=C(Br)C=CS1 AT16340 [0,1,0,0,1,0|2,0,0]=4 247 B8R1.11 COC1=C(Br)SC=N1 AT14705 [0,1,0,0,1,0|2,0,0]=4 248 B8R1.11 COC1=C(C)C=CS1 91670 [0,1,0,0,1,0|1,0,0]=3 249 B8R1.11 C[S@H]1C=CC=C1CN AT17306 [0,1,0,0,1,0|2,0,0]=4 250 B8R1.11 ClC1=C(CBr)SC=N1 AT15037 [0,1,0,0,1,0|2,0,0]=4 251 B8R1.11 ClCC1=C(Br)C=CS1 AT16718 [0,1,0,0,1,0|2,0,0]=4 252 B8R1.11 ClCC1=C(Br)SC=N1 AT14723 [0,1,0,0,1,0|2,0,0]=4 253 B8R1.11 ClCC1=C(Cl)C=CS1 AT16716 [0,1,0,0,1,0|2,0,0]=4 254 B8R1.11 ClCC1=C(Cl)SC=C1 AT17068 [0,1,0,0,1,0|2,0,0]=4 255 B8R1.11 NCC1=C(Br)C=CS1 P10346 [0,1,0,0,1,0|2,0,0]=4 256 B8R1.11 OCC1=C(Cl)N=CS1 AT14780 [0,1,0,0,1,0|2,0,0]=4 257 B8R1.11 OCC1=C(Cl)SC=C1 AT16564 [0,1,0,0,1,0|2,0,0]=4 258 B8R1.18 CC1=C(C)OC(=O)N1 AT18454 [0,1,0,0,1,0|1,0,1]=4 259 B8R1.18 CC1=C(C)OC(Br)=N1 AT18457 [0,1,0,0,1,0|1,0,0]=3 260 B8R1.18 CC1=C(C)OC(S)=N1 AT18536 [0,1,0,0,1,0|1,0,0]=3 261 B8R1.18 CC1=C(C)SC(Br)=C1 95200 [0,1,0,0,1,0|1,0,0]=3 262 B8R1.18 CC1=C(Cl)N=C(Cl)S1 O10590 [0,1,0,0,1,0|2,0,0]=4 263 B8R1.18 CC1=CC(=O)NN1C AT14000 [0,1,0,0,1,0|1,0,1]=4 264 B8R1.18 CC1=CC(C)=C(S)S1 AT16553 [0,1,0,0,1,0|2,0,0]=4 265 B8R1.18 CC1=CC(I)=C(C)S1 CS2241 [0,1,0,0,1,0|2,0,0]=4 266 B8R1.18 CC1=CN(C)C(Br)=N1 71593 [0,1,0,0,1,0|2,0,0]=4 267 B8R1.18 CC1=NC(Cl)=NN1C AT12340 [0,1,0,0,1,0|1,0,0]=3 268 B8R1.18 CC1=NC(Cl)=NN1C D77148 [0,1,0,0,1,0|1,0,0]=3 269 B8R1.18 CC1=NC(N)=NN1C AT12440 [0,1,0,0,1,0|1,0,0]=3 270 B8R1.18 CC1=NN(C)C(Br)=N1 AT12326 [0,1,0,0,1,0|2,0,0]=4 271 B8R1.18 CC1=NN(C)C(Cl)=N1 AT12325 [0,1,0,0,1,0|2,0,0]=4 272 B8R1.18 CC1=NN(C)C(I)=C1 71879 [0,1,0,0,1,0|2,0,0]=4 273 B8R1.18 CC1=NN(C)C(N)=N1 AT12327 [0,1,0,0,1,0|2,0,0]=4 274 B8R1.18 CC1=NN(C)C=C1N CL3439 [0,1,0,0,1,0|2,0,0]=4 275 B8R1.18 CN1N=C(Br)N=C1Cl AT21298 [0,1,0,0,1,0|2,0,0]=4 276 B8R1.18 CN1N=C(Br)N=C1N AT21294 [0,1,0,0,1,0|2,0,0]=4 277 B8R1.18 CN1N=C(Cl)C=C1N P14551 [0,1,0,0,1,0|2,0,0]=4 278 B8R1.18 CN1N=C(I)C=C1F P15024 [0,1,0,0,1,0|2,0,0]=4 279 B8R1.18 CN1N=C(N)C=C1N F17296 [0,1,0,0,1,0|2,0,0]=4 280 B8R1.18 CN1N=C(N)N=C1N 32060 [0,1,0,0,1,0|2,0,0]=4 281 B8R1.50 CC1=C(C)C(O)=NO1 AT21054 [0,1,0,0,1,0|2,0,0]=4 282 B8R1.50 CC1=C(N)C=NN1C C10730 [0,1,0,0,1,0|1,0,0]=3 283 B8R1.50 CC1=NN=C(Br)N1C AT21290 [0,1,0,0,1,0|2,0,0]=4 284 B8R1.50 CC1=NOC(C)=C1Cl D76793 [0,1,0,0,1,0|2,0,0]=4 285 B8R1.50 CC1=NOC(N)=C1I AT19824 [0,1,0,0,1,0|2,0,0]=4 286 B8R1.50 CC1=NSC(N)=C1Br AT21089 [0,1,0,0,1,0|2,0,0]=4 287 B8R1.50 CC1=NSC(N)=C1Cl AT21116 [0,1,0,0,1,0|2,0,0]=4 288 B8R1.50 CC1=NSC(N)=C1I AT21119 [0,1,0,0,1,0|2,0,0]=4 289 B8R1.50 CN1C(Cl)=CN=C1Br AT15556 [0,1,0,0,1,0|2,0,0]=4 290 B8R1.50 CN1N=CC(I)=C1N AT14123 [0,1,0,0,1,0|2,0,0]=4 291 B8R1.50 CN1N=CC(N)=C1Br AT13634 [0,1,0,0,1,0|2,0,0]=4 292 B8R1.50 CN1N=CC(N)=C1Cl AT25123 [0,1,0,0,1,0|2,0,0]=4 293 B8R1.50 CN1N=CC(N)=C1N A10126 [0,1,0,0,1,0|2,0,0]=4 294 B10R1.2 CC1=C(Br)C=CN=C1NN AT18414 [0,2,0,0,0,0|2,0,0]=4 295 B10R1.2 CC1=C(C#N)C=CN=C1F 91188 [0,2,0,0,0,0|2,0,0]=4 296 B10R1.2 CC1=C(CCl)C=CC=[N+]1[O-] 96309 [0,2,0,0,0,0|1,0,1]=4 297 B10R1.2 CC1=C(F)C=CC=C1CN N12172 [0,2,0,0,0,0|2,0,0]=4 298 B10R1.2 CC1=C(O)C=CC=C1CO 56654 [0,2,0,0,0,0|2,0,0]=4 299 B10R1.2 CNC1=NC=CC(Cl)=C1N C92709 [0,2,0,0,0,0|2,0,0]=4 300 B10R1.2 COC1=C(Cl)C(O)=CC=N1 FD10667 [0,2,0,0,0,0|2,0,0]=4 301 B10R1.2 COC1=NC=CC(F)=C1N F53634 [0,2,0,0,0,0|2,0,0]=4 302 B10R1.2 COC1=NC=CC(I)=C1F N11837 [0,2,0,0,0,0|2,0,0]=4 303 B10R1.2 COC1=NC=NC(O)=C1C C14793 [0,2,0,0,0,0|2,0,0]=4 304 B10R1.2 CSC1=C(C)C(N)=CC=C1 AT20858 [0,2,0,0,0,0|2,0,0]=4 305 B10R1.2 CSC1=CC=CC(Br)=C1C AC7030 [0,2,0,0,0,0|2,0,0]=4 306 B10R1.22 CC1=C(C)C(Cl)=NC(N)=N1 C14798 [0,2,0,0,0,0|2,0,0]=4 307 B10R1.22 CC1=C(O)C(I)=CC(I)=N1 FD10658 [0,2,0,0,0,0|2,0,0]=4 308 B10R1.22 CC1=C(O)C=C(O)N=C1Cl C16631 [0,2,0,0,0,0|2,0,0]=4 309 B10R1.22 CC1=CC(Br)=NC(C)=C1Br C75336 [0,2,0,0,0,0|2,0,0]=4 310 B10R1.22 CC1=CC(C)=NC(C)=C1Br W12678 [0,2,0,0,0,0|2,0,0]=4 311 B10R1.22 CC1=CC(O)=C(N)C(C)=N1 C75076 [0,2,0,0,0,0|2,0,0]=4 312 B10R1.22 CC1=NC(N)=NC(N)=C1C C16270 [0,2,0,0,0,0|2,0,0]=4 313 B10R1.119 CC1=C(C)C(Br)=C(N)C=C1 AC4809 [0,2,0,0,0,0|2,0,0]=4 314 B10R1.119 CC1=C(C)C(Cl)=C(Cl)C=C1 AC6597 [0,2,0,0,0,0|2,0,0]=4 315 B10R1.119 CC1=C(C)C(N)=C(N)C=C1 77536 [0,2,0,0,0,0|2,0,0]=4 316 B10R1.119 CC1=C(N)C=CC(F)=C1C 34354 [0,2,0,0,0,0|2,0,0]=4 317 B10R1.245 CC1=CC=CC(Br)=C1CO D96259 [0,2,0,0,0,0|2,0,0]=4 318 B10R1.245 CC1=CC=CC(N)=C1CO AC6550 [0,2,0,0,0,0|2,0,0]=4 319 B10R1.245 CC1=NC=NC(C)=C1CO P11861 [0,2,0,0,0,0|2,0,0]=4 320 B10R1.245 COC1=C(C)N=CN=C1Cl AT18342 [0,2,0,0,0,0|2,0,0]=4 321 B10R1.245 COC1=C(Cl)C=CN=C1F 91699 [0,2,0,0,0,0|2,0,0]=4 322 B10R1.245 COC1=C(I)C=CN=C1Cl AT13793 [0,2,0,0,0,0|2,0,0]=4 323 B10R1.245 COC1=C(I)C=CN=C1F AT19119 [0,2,0,0,0,0|2,0,0]=4 324 B10R1.245 COC1=C(O)C=CN=C1F 91686 [0,2,0,0,0,0|2,0,0]=4 325 B10R1.245 NCC1=C(Cl)C=CN=C1N 81939 [0,2,0,0,0,0|2,0,0]=4 326 B10R1.245 OCC1=C(I)C=CN=C1Cl 77407 [0,2,0,0,0,0|2,0,0]=4 327 B10R1.4 CC1=C(CC=O)C=CC=C1 W16821 [0,2,0,0,0,0|2,0,0]=4 328 B10R1.4 CC1=C(CON)C=CC=C1 D77271 [0,2,0,0,0,0|2,0,0]=4 329 B10R1.4 CC1=CC=CN=C1CC#N C90297 [0,2,0,0,0,0|1,0,0]=3 330 B10R1.4 CC1=NC=CN=C1\C=N/O N10113 [0,2,0,0,0,0|0,0,1]=3 331 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [0,2,0,0,0,0|2,0,0]=4 332 B10R1.4 CCNC1=CC=CN=C1O F30124 [0,2,0,0,0,0|2,0,0]=4 333 B10R1.4 CCNC1=NC=CC=C1N AC7989 [0,2,0,0,0,0|2,0,0]=4 334 B10R1.4 CCNC1=NC=CN=C1Cl AT24639 [0,2,0,0,0,0|1,0,0]=3 335 B10R1.4 CCOC1=C(F)C=CC=N1 F53248 [0,2,0,0,0,0|2,0,0]=4 336 B10R1.4 CCOC1=CC=CN=C1Cl W17868 [0,2,0,0,0,0|2,0,0]=4 337 B10R1.4 CNCC1=C(F)C=CC=N1 P10655 [0,2,0,0,0,0|2,0,0]=4 338 B10R1.4 CNCC1=C(F)C=CC=N1 P20450 [0,2,0,0,0,0|2,0,0]=4 339 B10R1.20 CCC1=CC=CN=C1C#N 50481 [0,2,0,0,0,0|1,0,1]=4 340 B10R1.20 CNC1=C(CO)C=CC=C1 C74490 [0,2,0,0,0,0|2,0,0]=4 341 B10R1.20 CNC1=C(OC)C=CC=N1 77471 [0,2,0,0,0,0|1,0,0]=3 342 B10R1.20 CNC1=C(SC)C=CC=C1 AT20832 [0,2,0,0,0,0|2,0,0]=4 343 B10R1.20 COC1=C(CN)N=CC=C1 O10088 [0,2,0,0,0,0|1,0,0]=3 344 B10R1.20 COC1=C(SC)C=CC=N1 F50798 [0,2,0,0,0,0|1,0,0]=3 345 B10R1.20 COC1=CC=CN=C1CCl 27916 [0,2,0,0,0,0|1,0,0]=3 346 B10R1.20 COC1=NC=CC=C1CN 36590 [0,2,0,0,0,0|1,0,0]=3 347 B10R1.20 COC1=NC=CN=C1C=O P10873 [0,2,0,0,0,0|0,0,1]=3 348 B10R1.20 COC1=NC=CN=C1CN C71765 [0,2,0,0,0,0|0,0,0]=2 349 B10R1.20 N#CC1=NC=CC=C1CN 92898 [0,2,0,0,0,0|1,0,1]=4 350 B10R1.20 NNC1=C(CO)C=CC=N1 D77554 [0,2,0,0,0,0|2,0,0]=4 351 B10R1.25 C#CC1=C(C)N=C(F)C=C1 AT20062 [0,2,0,0,0,0|1,0,1]=4 352 B10R1.25 CC1=C(CBr)C=CC(N)=C1 98280 [0,2,0,0,0,0|2,0,0]=4 353 B10R1.25 CC1=C(CCl)C=CC(F)=N1 77960 [0,2,0,0,0,0|1,0,0]=3 354 B10R1.25 CC1=C(CN)C=NC(N)=N1 C15221 [0,2,0,0,0,0|2,0,0]=4 355 B10R1.25 CC1=C(CO)C=CC(Br)=N1 AT12929 [0,2,0,0,0,0|1,0,0]=3 356 B10R1.25 CC1=C(CO)C=CC(Cl)=C1 T70197 [0,2,0,0,0,0|2,0,0]=4 357 B10R1.25 CC1=C(CO)C=CC(Cl)=N1 F16741 [0,2,0,0,0,0|1,0,0]=3 358 B10R1.25 CC1=C(CO)C=CC(F)=C1 CK2474 [0,2,0,0,0,0|2,0,0]=4 359 B10R1.25 CC1=C(CO)C=CC(O)=C1 N13176 [0,2,0,0,0,0|2,0,0]=4 360 B10R1.25 CC1=CC(Cl)=CN=C1C=O 97693 [0,2,0,0,0,0|1,0,1]=4 361 B10R1.25 CC1=CC(F)=CN=C1C#N 55147 [0,2,0,0,0,0|1,0,1]=4 362 B10R1.25 CC1=CN=C(CBr)C(C)=C1 O10504 [0,2,0,0,0,0|1,0,0]=3 363 B10R1.25 CC1=CN=C(CN)C(C)=C1 D73748 [0,2,0,0,0,0|1,0,0]=3 364 B10R1.25 CC1=NC(C)=C(C=O)C=C1 F12423 [0,2,0,0,0,0|1,0,1]=4 365 B10R1.25 CC1=NC(C)=C(CN)C=N1 F53535 [0,2,0,0,0,0|2,0,0]=4 366 B10R1.25 CCC1=C(Br)C=C(Br)C=N1 F14393 [0,2,0,0,0,0|2,0,0]=4 367 B10R1.25 CNC1=C(Cl)N=C(I)C=N1 N10094 [0,2,0,0,0,0|1,0,0]=3 368 B10R1.25 CNC1=NC=C(C)C=C1N D75084 [0,2,0,0,0,0|2,0,0]=4 369 B10R1.25 CNC1=NC=C(Cl)C=C1F N10103 [0,2,0,0,0,0|2,0,0]=4 370 B10R1.25 COC1=C(Br)C=C(O)C=N1 C72194 [0,2,0,0,0,0|2,0,0]=4 371 B10R1.25 COC1=C(C)N=C(N)C=C1 F53499 [0,2,0,0,0,0|1,0,0]=3 372 B10R1.25 COC1=C(F)C=C(O)C=N1 91782 [0,2,0,0,0,0|2,0,0]=4 373 B10R1.25 COC1=NC=C(Br)N=C1Br 86827 [0,2,0,0,0,0|1,0,0]=3 374 B10R1.25 COC1=NC=C(C)C=C1N D74381 [0,2,0,0,0,0|2,0,0]=4 375 B10R1.25 COC1=NC=C(C)N=C1Br 93937 [0,2,0,0,0,0|1,0,0]=3 376 B10R1.25 COC1=NC=C(Cl)C=C1F N10102 [0,2,0,0,0,0|2,0,0]=4 377 B10R1.25 CSC1=NC=C(Br)C=C1C AT14138 [0,2,0,0,0,0|1,0,0]=3 378 B10R1.25 ClC1=CN=C(CBr)C(Cl)=C1 A51212 [0,2,0,0,0,0|2,0,0]=4 379 B10R1.25 ClCC1=C(Br)C=C(Cl)C=N1 BL010231 [0,2,0,0,0,0|2,0,0]=4 380 B10R1.25 NCC1=C(Br)C=C(Br)C=N1 C91443 [0,2,0,0,0,0|2,0,0]=4 381 B10R1.25 NCC1=C(Br)C=C(Cl)C=N1 C91442 [0,2,0,0,0,0|2,0,0]=4 382 B10R1.25 NCC1=C(F)C=C(F)C=N1 AC1076 [0,2,0,0,0,0|2,0,0]=4 383 B10R1.25 NCC1=C(F)C=C(F)C=N1 O10070 [0,2,0,0,0,0|2,0,0]=4 384 B10R1.25 NCC1=NC=C(Br)C=C1F P12061 [0,2,0,0,0,0|2,0,0]=4 385 B10R1.25 NCC1=NC=C(Cl)C=C1F W15622 [0,2,0,0,0,0|2,0,0]=4 386 B10R1.25 NCC1=NC=C(Cl)N=C1Cl W17941 [0,2,0,0,0,0|1,0,0]=3 387 B10R1.25 NNC1=C(Cl)N=C(Br)C=N1 E71743 [0,2,0,0,0,0|2,0,0]=4 388 B10R1.25 NNC1=NC=C(Cl)N=C1Br BL010277 [0,2,0,0,0,0|2,0,0]=4 389 B10R1.25 OCC1=C(Br)C=C(Br)C=N1 C14404 [0,2,0,0,0,0|2,0,0]=4 390 B10R1.25 OCC1=C(Cl)N=C(Br)C=C1 AT21654 [0,2,0,0,0,0|2,0,0]=4 391 B10R1.30 CC1=C(CBr)C=C(Cl)C=C1 73456 [0,2,0,0,0,0|2,0,0]=4 392 B10R1.30 CC1=C(CO)C=C(O)C=C1 AC3540 [0,2,0,0,0,0|2,0,0]=4 393 B10R1.30 CC1=C(CO)N=C(Br)C=C1 AT18411 [0,2,0,0,0,0|1,0,0]=3 394 B10R1.30 CC1=CC=C(C)C(C#N)=N1 Y10193 [0,2,0,0,0,0|1,0,1]=4 395 B10R1.30 CC1=CN=C(Cl)C(CO)=C1 D85930 [0,2,0,0,0,0|2,0,0]=4 396 B10R1.30 CC1=NC(CO)=C(F)C=C1 C91534 [0,2,0,0,0,0|2,0,0]=4 397 B10R1.30 CC1=NC=C(Br)C=C1CCl AC3206 [0,2,0,0,0,0|1,0,0]=3 398 B10R1.30 CC1=NC=C(F)C=C1C=O C16838 [0,2,0,0,0,0|1,0,1]=4 399 B10R1.30 CCC1=C(C)C=CC(C)=C1 T71937 [0,2,0,0,0,0|2,0,0]=4 400 B10R1.30 CNC1=NC(C)=CC=C1N S10557 [0,2,0,0,0,0|2,0,0]=4 401 B10R1.30 COC1=C(C)C=CC(O)=C1 AT19376 [0,2,0,0,0,0|2,0,0]=4 402 B10R1.30 COC1=C(Cl)C=CC(N)=N1 A12809 [0,2,0,0,0,0|2,0,0]=4 403 B10R1.30 COC1=C(I)C=CC(Cl)=N1 AT11606 [0,2,0,0,0,0|2,0,0]=4 404 B10R1.30 COC1=CC(Br)=CN=C1Br N12851 [0,2,0,0,0,0|2,0,0]=4 405 B10R1.30 ClC1=NC(CBr)=C(Br)C=C1 52492 [0,2,0,0,0,0|2,0,0]=4 406 B10R1.30 FC1=NC(CBr)=C(Br)C=C1 85647 [0,2,0,0,0,0|2,0,0]=4 407 B10R1.30 FCC1=C(F)C=CC(Br)=N1 C92966 [0,2,0,0,0,0|2,0,0]=4 408 B10R1.30 NC1=CN=C(Cl)C(CO)=C1 D88075 [0,2,0,0,0,0|2,0,0]=4 409 B10R1.30 NC1=NC=C(Br)C=C1CO 26758 [0,2,0,0,0,0|2,0,0]=4 410 B10R1.30 NCC1=CC(Br)=CN=C1F P12283 [0,2,0,0,0,0|2,0,0]=4 411 B10R1.30 NCC1=CC(Br)=CN=C1N AC3840 [0,2,0,0,0,0|2,0,0]=4 412 B10R1.30 NCC1=CC(Cl)=CN=C1O 79398 [0,2,0,0,0,0|2,0,0]=4 413 B10R1.30 OCC1=C(F)C=CC(Cl)=N1 A10682 [0,2,0,0,0,0|2,0,0]=4 414 B10R1.30 OCC1=CC(Br)=CN=C1F P11806 [0,2,0,0,0,0|2,0,0]=4 415 B10R1.30 OCC1=CC(F)=CN=C1Cl 85046 [0,2,0,0,0,0|2,0,0]=4 416 B10R1.30 OCC1=CC(F)=CN=C1F AT10048 [0,2,0,0,0,0|2,0,0]=4 417 B10R1.30 OCC1=NC(Br)=CN=C1Br 53048 [0,2,0,0,0,0|1,0,0]=3 418 B10R1.61 CC(=O)C1=NC=CN=C1N P10974 [0,2,0,0,0,0|1,0,0]=3 419 B10R1.61 CC(=O)C1=NC=NC=C1C O10307 [0,2,0,0,0,0|2,0,0]=4 420 B10R1.61 CC(C)C1=NC=CN=C1Cl AT24532 [0,2,0,0,0,0|1,0,0]=3 421 B10R1.61 CC(C)C1=NC=CN=C1N 60031 [0,2,0,0,0,0|1,0,0]=3 422 B10R1.61 CC(C)C1=NC=CN=C1N W15952 [0,2,0,0,0,0|1,0,0]=3 423 B10R1.61 CC1=C(C(C)C)C=CC=C1 T71005 [0,2,0,0,0,0|2,0,0]=4 424 B10R1.61 CC1=CC=CN=C1B([O-])O AT15845 [0,2,0,0,0,0|2,0,0]=4 425 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70081 [0,2,0,0,0,0|2,0,0]=4 426 B10R1.61 C[C@H](N)C1=C(O)C=CC=N1 N14916 [0,2,0,0,0,0|2,0,0]=4 427 B10R1.61 C[C@H](N)C1=CC=CN=C1N P19332 [0,2,0,0,0,0|2,0,0]=4 428 B10R1.61 C[C@H](O)C1=C(N)N=CC=C1 C10363 [0,2,0,0,0,0|2,0,0]=4 429 B10R1.61 FC(F)C1=CC=CN=C1Br 79327 [0,2,0,0,0,0|2,0,0]=4 430 B10R1.118 CC1=C(Br)N=C(Br)C(N)=C1 O10625 [0,2,0,0,0,0|2,0,0]=4 431 B10R1.118 CC1=C(N)N=C(Br)C(F)=C1 F19626 [0,2,0,0,0,0|2,0,0]=4 432 B10R1.118 CC1=CC(Cl)=C(I)C=C1C O10394 [0,2,0,0,0,0|2,0,0]=4 433 B10R1.118 CC1=CC(F)=C(Br)C=C1C D87743 [0,2,0,0,0,0|2,0,0]=4 434 B10R1.118 CC1=CC(I)=C(I)C=C1C S12295 [0,2,0,0,0,0|2,0,0]=4 435 B10R1.118 CC1=CC(O)=C(C)N=C1Br D80172 [0,2,0,0,0,0|2,0,0]=4 436 B10R1.118 CC1=NC(Cl)=C(Br)C=C1N C91671 [0,2,0,0,0,0|2,0,0]=4 437 B10R1.118 CC1=NC(N)=C(I)C=C1Br 82189 [0,2,0,0,0,0|2,0,0]=4 438 B10R1.118 CC1=NC(O)=C(C)N=C1O N13378 [0,2,0,0,0,0|1,0,0]=3 439 B10R1.118 ClC1=NC(Cl)=C(Cl)N=C1Br N11826 [0,2,0,0,0,0|2,0,0]=4 440 B10R1.118 NC1=C(Br)N=C(Br)C(Br)=N1 C76093 [0,2,0,0,0,0|2,0,0]=4 441 B10R1.118 [2H]C1=NC([2H])=C([2H])N=C1[2H] D98348 [0,2,0,0,0,0|2,0,0]=4 442 B10R1.176 CC1=C(Br)C=C(C=O)C=N1 C14264 [0,2,0,0,0,0|2,0,0]=4 443 B10R1.176 CC1=C(Br)C=CC(NN)=N1 80859 [0,2,0,0,0,0|2,0,0]=4 444 B10R1.176 CC1=C(C)N=C(C#N)C=C1 Y10192 [0,2,0,0,0,0|1,0,0]=3 445 B10R1.176 CC1=C(F)C=C(CO)C=N1 C77142 [0,2,0,0,0,0|2,0,0]=4 446 B10R1.176 CC1=C(F)C=CC(CO)=N1 O10128 [0,2,0,0,0,0|2,0,0]=4 447 B10R1.176 CC1=CC(CCl)=CN=C1Cl 97209 [0,2,0,0,0,0|2,0,0]=4 448 B10R1.176 CC1=CC(CO)=CN=C1C F53420 [0,2,0,0,0,0|1,0,0]=3 449 B10R1.176 CCC1=NC(C)=C(O)C=C1 76361 [0,2,0,0,0,0|2,0,0]=4 450 B10R1.176 CSC1=NC(C)=C(Br)C=C1 AT14158 [0,2,0,0,0,0|2,0,0]=4 451 B8R1.7 C=C(C)C1=NC=CS1 T71747 [0,0,1,1,0,0|2,0,0]=4 452 B8R1.7 N=C(N)C1=NC=CN1 38079 [0,0,1,1,0,0|2,0,0]=4 453 B8R1.7 N=C(N)C1=NC=CN1 P15498 [0,0,1,1,0,0|2,0,0]=4 454 B10R2.7 C1=CN=C2CNCC2=N1 F12463 [0,1,0,1,0,0|0,0,0]=2 455 B10R2.7 C1=CN=C2NCCC2=C1 C13729 [0,1,0,1,0,0|1,0,0]=3 456 B10R2.7 C1=CN=C2NCCC2=N1 P20982 [0,1,0,1,0,0|0,0,0]=2 457 B10R2.7 C1=NC=C2CCNC2=N1 93647 [0,1,0,1,0,0|2,0,0]=4 458 B10R2.7 C1=NC=C2CCNC2=N1 C90715 [0,1,0,1,0,0|2,0,0]=4 459 B10R2.320 N[C@H]1CC2=C1C=CC=C2 AT20398 [0,1,0,1,0,0|2,0,0]=4 460 B6R1.2 BrC1=CC=NS1 AT21099 [1,0,0,0,1,0|2,0,0]=4 461 B6R1.2 CC1=CN=CO1 C77581 [1,0,0,0,1,0|1,0,0]=3 462 B6R1.2 CC1=NC=CO1 O10838 [1,0,0,0,1,0|1,0,0]=3 463 B6R1.2 CC1=NSC=C1 AC6637 [1,0,0,0,1,0|1,0,0]=3 464 B6R1.2 ClC1=CSN=C1 F13704 [1,0,0,0,1,0|2,0,0]=4 465 B6R1.2 ClC1=NC=CO1 F20650 [1,0,0,0,1,0|2,0,0]=4 466 B6R1.2 ClC1=NC=NN1 O11392 [1,0,0,0,1,0|2,0,0]=4 467 B6R1.2 ClC1=NSC=C1 F19768 [1,0,0,0,1,0|2,0,0]=4 468 B6R1.2 ClC1=NSN=C1 AT12128 [1,0,0,0,1,0|2,0,0]=4 469 B6R1.2 NC1=CC=CS1 44128 [1,0,0,0,1,0|2,0,0]=4 470 B6R1.2 NC1=CC=CS1 F10359 [1,0,0,0,1,0|2,0,0]=4 471 B6R1.2 NC1=CC=NS1 W16800 [1,0,0,0,1,0|2,0,0]=4 472 B6R1.2 NC1=CNC=N1 P20245 [1,0,0,0,1,0|1,0,1]=4 473 B6R1.2 OC1=CON=C1 AT21052 [1,0,0,0,1,0|2,0,0]=4 474 B6R1.2 SC1=NC=CO1 AT18533 [1,0,0,0,1,0|2,0,0]=4