0 B8R1.2 BrCC1=CC=CC=C1 OR12905 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.2 BrCC1=CC=CN=C1 OR46547 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.2 BrCC1=CC=CN=N1 OR30652 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.2 BrCC1=NC=CN=C1 OR40084 [0,0,0,0,0,0|2,0,0]=2 4 B8R1.2 BrCC1=NC=CN=C1 OR46239 [0,0,0,0,0,0|2,0,0]=2 5 B8R1.2 Br[Mg]C1=CC=CC=C1 OR320049 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.2 Br[Mg]C1=CC=CC=C1 OR320050 [0,0,0,0,0,0|4,0,0]=4 7 B8R1.2 C#CC1=CC=CC=C1 OR8217 [0,0,0,0,0,0|3,0,1]=4 8 B8R1.2 C#CC1=NC=CC=C1 OR18606 [0,0,0,0,0,0|2,0,1]=3 9 B8R1.2 C#CC1=NC=CN=C1 OR53022 [0,0,0,0,0,0|1,0,1]=2 10 B8R1.2 C=CC1=CC=CN=C1 OR8894 [0,0,0,0,0,0|2,0,1]=3 11 B8R1.2 C=CC1=CN=CN=C1 OR18864 [0,0,0,0,0,0|3,0,1]=4 12 B8R1.2 C=CC1=NC=CC=C1 OR3144 [0,0,0,0,0,0|2,0,1]=3 13 B8R1.2 C=CC1=NC=CC=N1 OR18863 [0,0,0,0,0,0|3,0,1]=4 14 B8R1.2 C=CC1=NC=NC=C1 OR19570 [0,0,0,0,0,0|3,0,1]=4 15 B8R1.2 CCC1=CC=CC=C1 OR14988 [0,0,0,0,0,0|3,0,0]=3 16 B8R1.2 CCC1=CC=NC=C1 OR345107 [0,0,0,0,0,0|4,0,0]=4 17 B8R1.2 CNC1=CC=NC=C1 OR42108 [0,0,0,0,0,0|4,0,0]=4 18 B8R1.2 CNC1=CN=CN=C1 OR305382 [0,0,0,0,0,0|3,0,0]=3 19 B8R1.2 COC1=CC=CN=C1 OR4691 [0,0,0,0,0,0|1,0,0]=1 20 B8R1.2 COC1=CC=NC=C1 OR8764 [0,0,0,0,0,0|3,0,0]=3 21 B8R1.2 COC1=CCC=CC1 OR17014 [0,0,0,0,0,0|2,0,0]=2 22 B8R1.2 COC1=NC=CC=C1 OR13608 [0,0,0,0,0,0|1,0,0]=1 23 B8R1.2 CSC1=CC=CC=C1 OR2490 [0,0,0,0,0,0|2,1,0]=3 24 B8R1.2 CSC1=NC=CC=N1 OR15527 [0,0,0,0,0,0|2,1,0]=3 25 B8R1.2 ClCC1=CC=CC=C1 OR16493 [0,0,0,0,0,0|4,0,0]=4 26 B8R1.2 ClCC1=CC=CN=C1 OR0262 [0,0,0,0,0,0|3,0,0]=3 27 B8R1.2 ClCC1=NC=CC=C1 OR8686 [0,0,0,0,0,0|3,0,0]=3 28 B8R1.2 ClCC1=NC=CN=C1 OR40082 [0,0,0,0,0,0|2,0,0]=2 29 B8R1.2 ClCC1=NC=CN=C1 OR61057 [0,0,0,0,0,0|2,0,0]=2 30 B8R1.2 Cl[Mg]C1=CC=CC=C1 OR320052 [0,0,0,0,0,0|4,0,0]=4 31 B8R1.2 Cl[Mg]C1=CC=CC=C1 OR320053 [0,0,0,0,0,0|4,0,0]=4 32 B8R1.2 N#CC1=CC=CC=C1 OR46569 [0,0,0,0,0,0|4,0,0]=4 33 B8R1.2 N#CC1=CC=CC=C1 OR54377 [0,0,0,0,0,0|4,0,0]=4 34 B8R1.2 N#CC1=CC=CN=N1 OR48248 [0,0,0,0,0,0|4,0,0]=4 35 B8R1.2 N#CC1=CN=CN=C1 OR11333 [0,0,0,0,0,0|4,0,0]=4 36 B8R1.2 N#CC1=NC=CC=N1 OR9045 [0,0,0,0,0,0|4,0,0]=4 37 B8R1.2 N#CC1=NC=CN=C1 OR28727 [0,0,0,0,0,0|2,0,0]=2 38 B8R1.2 NCC1=CC=CC=C1 OR16591 [0,0,0,0,0,0|4,0,0]=4 39 B8R1.2 NCC1=CC=CC=C1 OR27725 [0,0,0,0,0,0|4,0,0]=4 40 B8R1.2 NCC1=CC=CN=C1 OR23063 [0,0,0,0,0,0|3,0,0]=3 41 B8R1.2 NCC1=NC=CC=C1 OR5031 [0,0,0,0,0,0|3,0,0]=3 42 B8R1.2 NCC1=NC=CC=N1 OR12993 [0,0,0,0,0,0|4,0,0]=4 43 B8R1.2 NCC1=NC=CC=N1 OR48262 [0,0,0,0,0,0|4,0,0]=4 44 B8R1.2 NCC1=NC=CN=C1 OR40048 [0,0,0,0,0,0|2,0,0]=2 45 B8R1.2 NCC1=NN=CC=C1 OR8924 [0,0,0,0,0,0|4,0,0]=4 46 B8R1.2 NNC1=CC=CN=C1 OR306302 [0,0,0,0,0,0|3,0,0]=3 47 B8R1.2 NNC1=CC=CN=N1 OR40349 [0,0,0,0,0,0|4,0,0]=4 48 B8R1.2 NNC1=CN=CC=N1 OR16081 [0,0,0,0,0,0|2,0,0]=2 49 B8R1.2 NNC1=NC=CC=C1 OR61068 [0,0,0,0,0,0|3,0,0]=3 50 B8R1.2 NNC1=NC=CC=N1 OR302061 [0,0,0,0,0,0|4,0,0]=4 51 B8R1.2 O=CC1=CC=CC=C1 OR45085 [0,0,0,0,0,0|4,0,0]=4 52 B8R1.2 O=CC1=CC=CN=C1 OR23059 [0,0,0,0,0,0|3,0,0]=3 53 B8R1.2 O=CC1=CN=CN=C1 OR7659 [0,0,0,0,0,0|4,0,0]=4 54 B8R1.2 O=CC1=CN=NC=C1 OR59872 [0,0,0,0,0,0|4,0,0]=4 55 B8R1.2 O=CC1=NC=CC=C1 OR5051 [0,0,0,0,0,0|3,0,0]=3 56 B8R1.2 O=CC1=NC=CC=N1 OR17838 [0,0,0,0,0,0|4,0,0]=4 57 B8R1.2 O=CC1=NC=CN=C1 OR1854 [0,0,0,0,0,0|2,0,0]=2 58 B8R1.2 O=CC1=NC=NC=C1 OR7987 [0,0,0,0,0,0|4,0,0]=4 59 B8R1.2 OCC1=CC=CC=C1 OR923999 [0,0,0,0,0,0|4,0,0]=4 60 B8R1.2 OCC1=CC=CN=C1 OR23061 [0,0,0,0,0,0|3,0,0]=3 61 B8R1.2 OCC1=CC=CN=N1 OR6428 [0,0,0,0,0,0|4,0,0]=4 62 B8R1.2 OCC1=CN=CN=C1 OR17898 [0,0,0,0,0,0|4,0,0]=4 63 B8R1.2 OCC1=NC=CC=C1 OR23056 [0,0,0,0,0,0|3,0,0]=3 64 B8R1.2 OCC1=NC=CC=N1 OR42130 [0,0,0,0,0,0|4,0,0]=4 65 B8R1.2 OCC1=NC=CN=C1 OR12341 [0,0,0,0,0,0|2,0,0]=2 66 B8R1.2 OCC1=NC=NC=C1 OR42131 [0,0,0,0,0,0|4,0,0]=4 67 B8R1.2 SCC1=CC=CN=C1 OR305406 [0,0,0,0,0,0|3,0,0]=3 68 B7R1.3 BrC1=CC=CC=C1 OR2446 [1,0,0,0,0,0|3,0,0]=4 69 B7R1.3 BrC1=CC=CN=C1 OR23062 [1,0,0,0,0,0|2,0,0]=3 70 B7R1.3 BrC1=CC=NC=N1 OR313001 [1,0,0,0,0,0|3,0,0]=4 71 B7R1.3 BrC1=CC=NC=N1 OR55159 [1,0,0,0,0,0|3,0,0]=4 72 B7R1.3 BrC1=CN=CN=C1 OR0101 [1,0,0,0,0,0|3,0,0]=4 73 B7R1.3 BrC1=NC=CC=C1 OR23057 [1,0,0,0,0,0|2,0,0]=3 74 B7R1.3 BrC1=NC=CC=N1 OR23100 [1,0,0,0,0,0|3,0,0]=4 75 B7R1.3 BrC1=NC=CN=C1 OR61107 [1,0,0,0,0,0|1,0,0]=2 76 B7R1.3 CC1=CN=CN=C1 OR8286 [1,0,0,0,0,0|2,0,0]=3 77 B7R1.3 CC1=CN=NC=C1 OR25618 [1,0,0,0,0,0|2,0,0]=3 78 B7R1.3 CC1=NC=CN=C1 OR52198 [1,0,0,0,0,0|0,0,0]=1 79 B7R1.3 ClC1=CC=CC=C1 OR8791 [1,0,0,0,0,0|3,0,0]=4 80 B7R1.3 ClC1=CC=CN=C1 OR5865 [1,0,0,0,0,0|2,0,0]=3 81 B7R1.3 ClC1=CC=CN=N1 OR2124 [1,0,0,0,0,0|3,0,0]=4 82 B7R1.3 ClC1=CC=CN=N1 OR40347 [1,0,0,0,0,0|3,0,0]=4 83 B7R1.3 ClC1=CN=CC=N1 OR11035 [1,0,0,0,0,0|1,0,0]=2 84 B7R1.3 ClC1=NC=CC=C1 OR9447 [1,0,0,0,0,0|2,0,0]=3 85 B7R1.3 ClC1=NC=CC=N1 OR0970 [1,0,0,0,0,0|3,0,0]=4 86 B7R1.3 ClC1=NC=NC=C1 OR53156 [1,0,0,0,0,0|3,0,0]=4 87 B7R1.3 IC1=CC=CC=C1 OR1085 [1,0,0,0,0,0|3,0,0]=4 88 B7R1.3 IC1=CC=CN=C1 OR13049 [1,0,0,0,0,0|2,0,0]=3 89 B7R1.3 IC1=CN=CN=C1 OR305385 [1,0,0,0,0,0|3,0,0]=4 90 B7R1.3 IC1=NC=CC=C1 OR5750 [1,0,0,0,0,0|2,0,0]=3 91 B7R1.3 IC1=NC=CC=N1 OR54388 [1,0,0,0,0,0|3,0,0]=4 92 B7R1.3 IC1=NC=CN=C1 OR3669 [1,0,0,0,0,0|1,0,0]=2 93 B7R1.3 NC1=CC=CC=C1 OR43506 [1,0,0,0,0,0|3,0,0]=4 94 B7R1.3 NC1=CC=CC=C1 OR8982 [1,0,0,0,0,0|3,0,0]=4 95 B7R1.3 NC1=CC=CC=C1 OR8983 [1,0,0,0,0,0|3,0,0]=4 96 B7R1.3 NC1=CC=CN=C1 OR9548 [1,0,0,0,0,0|2,0,0]=3 97 B7R1.3 NC1=CN=CN=C1 OR30751 [1,0,0,0,0,0|3,0,0]=4 98 B7R1.3 NC1=CN=NC=C1 OR60046 [1,0,0,0,0,0|3,0,0]=4 99 B7R1.3 NC1=NC=CC=C1 OR0015 [1,0,0,0,0,0|2,0,0]=3 100 B7R1.3 NC1=NC=CC=N1 OR5847 [1,0,0,0,0,0|3,0,0]=4 101 B7R1.3 NC1=NC=CN=C1 OR5470 [1,0,0,0,0,0|1,0,0]=2 102 B7R1.3 NC1=NC=CN=N1 OR17565 [1,0,0,0,0,0|2,0,0]=3 103 B7R1.3 NC1=NC=NC=C1 OR3288 [1,0,0,0,0,0|3,0,0]=4 104 B7R1.3 NC1=NC=NC=C1 OR8287 [1,0,0,0,0,0|3,0,0]=4 105 B7R1.3 NC1=NN=CC=C1 OR6130 [1,0,0,0,0,0|3,0,0]=4 106 B7R1.3 O=C1C=CC=NN1 OR2215 [1,0,0,0,0,0|2,0,1]=4 107 B7R1.3 OC1=CC=CN=C1 OR4752 [1,0,0,0,0,0|1,0,0]=2 108 B7R1.3 OC1=CC=NC=C1 OR1002 [1,0,0,0,0,0|3,0,0]=4 109 B7R1.3 OC1=CN=CN=C1 OR301100 [1,0,0,0,0,0|2,0,0]=3 110 B7R1.3 OC1=NC=CC=C1 OR11197 [1,0,0,0,0,0|1,0,0]=2 111 B7R1.3 OC1=NC=CC=N1 OR5850 [1,0,0,0,0,0|2,0,0]=3 112 B7R1.3 OC1=NC=CC=N1 OR61010 [1,0,0,0,0,0|2,0,0]=3 113 B7R1.3 OC1=NC=CN=C1 OR40046 [1,0,0,0,0,0|0,0,0]=1 114 B7R1.3 SC1=NC=CC=C1 OR9448 [1,0,0,0,0,0|1,1,0]=3 115 B7R1.3 SC1=NC=CC=N1 OR29835 [1,0,0,0,0,0|2,1,0]=4 116 B7R1.3 [SiH3]C1=CC=CC=C1 OR18813 [1,0,0,0,0,0|2,1,0]=4 117 B9R1.1 BrCC1=CC=C(Br)N=C1 OR315377 [0,1,0,0,0,0|3,0,0]=4 118 B9R1.1 C#CC1=NC=C(C)C=C1 OR53010 [0,1,0,0,0,0|2,0,1]=4 119 B9R1.1 C#CC1=NC=C(C)N=C1 OR53019 [0,1,0,0,0,0|1,0,1]=3 120 B9R1.1 C#CC1=NC=C(Cl)C=C1 OR53004 [0,1,0,0,0,0|2,0,1]=4 121 B9R1.1 CC1=CC=C(C#N)C=N1 OR29756 [0,1,0,0,0,0|3,0,0]=4 122 B9R1.1 CC1=CC=C(C=O)C=N1 OR46109 [0,1,0,0,0,0|3,0,0]=4 123 B9R1.1 CC1=CC=C(CCl)N=C1 OR310896 [0,1,0,0,0,0|3,0,0]=4 124 B9R1.1 CC1=CC=C(CO)C=N1 OR14843 [0,1,0,0,0,0|3,0,0]=4 125 B9R1.1 CC1=CN=C(C#N)C=C1 OR11739 [0,1,0,0,0,0|3,0,0]=4 126 B9R1.1 CC1=CN=C(C=O)C=N1 OR40083 [0,1,0,0,0,0|2,0,0]=3 127 B9R1.1 CC1=CN=C(CN)C=C1 OR306469 [0,1,0,0,0,0|3,0,0]=4 128 B9R1.1 CC1=CN=C(CN)C=N1 OR30690 [0,1,0,0,0,0|2,0,0]=3 129 B9R1.1 CC1=CN=C(NN)C=C1 OR60226 [0,1,0,0,0,0|3,0,0]=4 130 B9R1.1 CC1=CN=C(NN)C=N1 OR60218 [0,1,0,0,0,0|2,0,0]=3 131 B9R1.1 CCC1=CC=C(Br)C=C1 OR13057 [0,1,0,0,0,0|3,0,0]=4 132 B9R1.1 CCC1=CC=C(I)C=C1 OR4537 [0,1,0,0,0,0|3,0,0]=4 133 B9R1.1 CCC1=CC=C(S)C=C1 OR11377 [0,1,0,0,0,0|3,0,0]=4 134 B9R1.1 CCC1=CN=C(C)C=C1 OR3152 [0,1,0,0,0,0|2,0,0]=3 135 B9R1.1 CCC1=CN=C(Cl)N=C1 OR2912 [0,1,0,0,0,0|3,0,0]=4 136 B9R1.1 CNC1=CC=C(Cl)N=N1 OR11643 [0,1,0,0,0,0|3,0,0]=4 137 B9R1.1 CNC1=NC=C(Br)C=N1 OR7851 [0,1,0,0,0,0|3,0,0]=4 138 B9R1.1 COC1=CC=C(Br)C=C1 OR4283 [0,1,0,0,0,0|2,0,0]=3 139 B9R1.1 COC1=CC=C(Cl)C=C1 OR4349 [0,1,0,0,0,0|2,0,0]=3 140 B9R1.1 COC1=CC=C(Cl)N=N1 OR21479 [0,1,0,0,0,0|2,0,0]=3 141 B9R1.1 COC1=CC=C(I)C=C1 OR4677 [0,1,0,0,0,0|2,0,0]=3 142 B9R1.1 COC1=CC=C(I)N=N1 OR40348 [0,1,0,0,0,0|2,0,0]=3 143 B9R1.1 COC1=CC=C(N)N=C1 OR40515 [0,1,0,0,0,0|1,0,0]=2 144 B9R1.1 COC1=CC=C(N)N=N1 OR14965 [0,1,0,0,0,0|2,0,0]=3 145 B9R1.1 COC1=CC=C(O)C=C1 OR10915 [0,1,0,0,0,0|2,0,0]=3 146 B9R1.1 COC1=CC=C(S)C=C1 OR0774 [0,1,0,0,0,0|2,0,0]=3 147 B9R1.1 COC1=CC=[N+]([O-])C=C1 OR300626 [0,1,0,0,0,0|3,0,0]=4 148 B9R1.1 COC1=CN=C(Br)C=C1 OR3574 [0,1,0,0,0,0|1,0,0]=2 149 B9R1.1 COC1=CN=C(Br)C=N1 OR61105 [0,1,0,0,0,0|0,0,0]=1 150 B9R1.1 COC1=CN=C(Cl)N=C1 OR17107 [0,1,0,0,0,0|2,0,0]=3 151 B9R1.1 COC1=CN=C(N)C=N1 OR40076 [0,1,0,0,0,0|0,0,0]=1 152 B9R1.1 COC1=CN=C(N)N=C1 OR54119 [0,1,0,0,0,0|2,0,0]=3 153 B9R1.1 COC1=NC=C(Br)C=C1 OR1212 [0,1,0,0,0,0|1,0,0]=2 154 B9R1.1 COC1=NC=C(Br)C=N1 OR7810 [0,1,0,0,0,0|2,0,0]=3 155 B9R1.1 COC1=NC=C(Cl)C=C1 OR3476 [0,1,0,0,0,0|1,0,0]=2 156 B9R1.1 COC1=NC=C(N)C=C1 OR4654 [0,1,0,0,0,0|1,0,0]=2 157 B9R1.1 COC1=NC=C(N)C=N1 OR30959 [0,1,0,0,0,0|2,0,0]=3 158 B9R1.1 COC1=NC=C(O)C=C1 OR3808 [0,1,0,0,0,0|1,0,0]=2 159 B9R1.1 CSC1=CC=C(Br)C=C1 OR10389 [0,1,0,0,0,0|2,1,0]=4 160 B9R1.1 CSC1=CC=C(Br)C=N1 OR15634 [0,1,0,0,0,0|1,1,0]=3 161 B9R1.1 CSC1=CC=C(Cl)C=C1 OR3459 [0,1,0,0,0,0|2,1,0]=4 162 B9R1.1 CSC1=CC=C(N)C=C1 OR0773 [0,1,0,0,0,0|2,1,0]=4 163 B9R1.1 CSC1=CC=C(N)N=N1 OR14966 [0,1,0,0,0,0|2,1,0]=4 164 B9R1.1 CSC1=CC=C(O)C=C1 OR0778 [0,1,0,0,0,0|2,1,0]=4 165 B9R1.1 CSC1=CC=C(S)C=C1 OR11379 [0,1,0,0,0,0|2,1,0]=4 166 B9R1.1 CSC1=NC=C(Br)C=N1 OR8529 [0,1,0,0,0,0|2,1,0]=4 167 B9R1.1 ClCC1=CC=C(Cl)C=N1 OR303892 [0,1,0,0,0,0|3,0,0]=4 168 B9R1.1 ClCC1=CC=C(Cl)C=N1 OR54365 [0,1,0,0,0,0|3,0,0]=4 169 B9R1.1 ClCC1=CN=C(Cl)C=C1 OR11306 [0,1,0,0,0,0|3,0,0]=4 170 B9R1.1 N#CC1=CC=C(Cl)N=C1 OR29741 [0,1,0,0,0,0|3,0,0]=4 171 B9R1.1 N#CC1=CC=C(I)N=C1 OR3547 [0,1,0,0,0,0|3,0,0]=4 172 B9R1.1 N#CC1=CC=C(O)N=C1 OR3348 [0,1,0,0,0,0|3,0,0]=4 173 B9R1.1 N#CC1=CN=C(Br)C=C1 OR5716 [0,1,0,0,0,0|3,0,0]=4 174 B9R1.1 N#CC1=CN=C(Br)C=N1 OR18105 [0,1,0,0,0,0|2,0,0]=3 175 B9R1.1 N#CC1=CN=C(N)C=C1 OR6119 [0,1,0,0,0,0|3,0,0]=4 176 B9R1.1 N#CC1=CN=C(N)C=N1 OR18000 [0,1,0,0,0,0|2,0,0]=3 177 B9R1.1 N#CC1=NC=C(Br)C=C1 OR11382 [0,1,0,0,0,0|3,0,0]=4 178 B9R1.1 N#CC1=NC=C(Cl)C=C1 OR11381 [0,1,0,0,0,0|3,0,0]=4 179 B9R1.1 N#CC1=NC=C(Cl)N=C1 OR43502 [0,1,0,0,0,0|2,0,0]=3 180 B9R1.1 N#CC1=NC=C(I)C=C1 OR322789 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.1 N#CC1=NC=C(O)C=C1 OR42158 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.1 NC1=CC=C(CO)C=N1 OR14503 [0,1,0,0,0,0|3,0,0]=4 183 B9R1.1 NCC1=CN=C(Cl)C=C1 OR6199 [0,1,0,0,0,0|3,0,0]=4 184 B9R1.1 NCC1=CN=C(N)C=C1 OR41126 [0,1,0,0,0,0|3,0,0]=4 185 B9R1.1 NCC1=NC=C(Br)C=C1 OR52328 [0,1,0,0,0,0|3,0,0]=4 186 B9R1.1 NCC1=NC=C(Cl)C=C1 OR60126 [0,1,0,0,0,0|3,0,0]=4 187 B9R1.1 NCC1=NC=C(O)C=C1 OR51778 [0,1,0,0,0,0|3,0,0]=4 188 B9R1.1 NNC1=NC=C(Br)C=C1 OR3769 [0,1,0,0,0,0|3,0,0]=4 189 B9R1.1 NNC1=NC=C(Cl)C=C1 OR12065 [0,1,0,0,0,0|3,0,0]=4 190 B9R1.1 NNC1=NC=C(Cl)N=C1 OR55438 [0,1,0,0,0,0|2,0,0]=3 191 B9R1.1 NNC1=NC=C(Cl)N=C1 OR60232 [0,1,0,0,0,0|2,0,0]=3 192 B9R1.1 O=CC1=CC=C(Cl)N=C1 OR6178 [0,1,0,0,0,0|3,0,0]=4 193 B9R1.1 O=CC1=CC=C(O)C=N1 OR51764 [0,1,0,0,0,0|3,0,0]=4 194 B9R1.1 O=CC1=CC=C(O)N=C1 OR4910 [0,1,0,0,0,0|3,0,0]=4 195 B9R1.1 O=CC1=CN=C(Br)C=C1 OR3271 [0,1,0,0,0,0|3,0,0]=4 196 B9R1.1 O=CC1=NC=C(Br)C=C1 OR6176 [0,1,0,0,0,0|3,0,0]=4 197 B9R1.1 O=CC1=NC=C(Cl)C=C1 OR16864 [0,1,0,0,0,0|3,0,0]=4 198 B9R1.1 OCC1=CN=C(Cl)C=C1 OR11307 [0,1,0,0,0,0|3,0,0]=4 199 B9R1.1 OCC1=NC=C(Br)C=C1 OR13061 [0,1,0,0,0,0|3,0,0]=4 200 B9R1.1 OCC1=NC=C(Cl)C=C1 OR16865 [0,1,0,0,0,0|3,0,0]=4 201 B9R1.1 OCC1=NC=C(Cl)N=C1 OR313042 [0,1,0,0,0,0|2,0,0]=3 202 B9R1.2 BrCC1=NC(Br)=CC=C1 OR303708 [0,1,0,0,0,0|3,0,0]=4 203 B9R1.2 C#CC1=CC(Br)=CN=C1 OR53006 [0,1,0,0,0,0|2,0,1]=4 204 B9R1.2 C#CC1=CC(C)=CN=C1 OR53005 [0,1,0,0,0,0|2,0,1]=4 205 B9R1.2 C#CC1=CN=CC(Cl)=N1 OR53054 [0,1,0,0,0,0|1,0,1]=3 206 B9R1.2 C#CC1=NC(C)=CN=C1 OR53018 [0,1,0,0,0,0|1,0,1]=3 207 B9R1.2 C#CC1=NC(Cl)=CC=C1 OR53011 [0,1,0,0,0,0|2,0,1]=4 208 B9R1.2 CC1=CC(C#N)=NC=C1 OR9027 [0,1,0,0,0,0|3,0,0]=4 209 B9R1.2 CC1=CC(C=O)=NC=C1 OR6171 [0,1,0,0,0,0|3,0,0]=4 210 B9R1.2 CC1=CC(CN)=CN=C1 OR306426 [0,1,0,0,0,0|3,0,0]=4 211 B9R1.2 CC1=CC(CN)=NC=C1 OR40440 [0,1,0,0,0,0|3,0,0]=4 212 B9R1.2 CC1=CC(CN)=NC=C1 OR6198 [0,1,0,0,0,0|3,0,0]=4 213 B9R1.2 CC1=CC(NN)=NC=C1 OR60231 [0,1,0,0,0,0|3,0,0]=4 214 B9R1.2 CC1=CC=CC(C#N)=N1 OR13606 [0,1,0,0,0,0|3,0,0]=4 215 B9R1.2 CC1=CC=CC(C=O)=N1 OR12003 [0,1,0,0,0,0|3,0,0]=4 216 B9R1.2 CC1=CC=CC(CO)=N1 OR0530 [0,1,0,0,0,0|3,0,0]=4 217 B9R1.2 CC1=CN=CC(C#N)=C1 OR13616 [0,1,0,0,0,0|3,0,0]=4 218 B9R1.2 CC1=CN=CC(CCl)=C1 OR13615 [0,1,0,0,0,0|3,0,0]=4 219 B9R1.2 CC1=CN=CC(NN)=N1 OR60229 [0,1,0,0,0,0|2,0,0]=3 220 B9R1.2 CC1=NC(CCl)=CC=C1 OR450025 [0,1,0,0,0,0|3,0,0]=4 221 B9R1.2 CCC1=CC=CC(Br)=C1 OR30209 [0,1,0,0,0,0|3,0,0]=4 222 B9R1.2 CCC1=CC=CC(N)=N1 OR22212 [0,1,0,0,0,0|2,0,0]=3 223 B9R1.2 CCC1=NC(Cl)=NC=C1 OR17114 [0,1,0,0,0,0|3,0,0]=4 224 B9R1.2 CNC1=CC(Cl)=CC=C1 OR30117 [0,1,0,0,0,0|3,0,0]=4 225 B9R1.2 CNC1=NC(Cl)=CN=C1 OR59340 [0,1,0,0,0,0|1,0,0]=2 226 B9R1.2 CNC1=NC(Cl)=NC=C1 OR18111 [0,1,0,0,0,0|3,0,0]=4 227 B9R1.2 COC1=CC(Br)=CC=C1 OR2108 [0,1,0,0,0,0|2,0,0]=3 228 B9R1.2 COC1=CC(Br)=CN=C1 OR5842 [0,1,0,0,0,0|1,0,0]=2 229 B9R1.2 COC1=CC(Br)=NC=C1 OR61413 [0,1,0,0,0,0|3,0,0]=4 230 B9R1.2 COC1=CC(C)=CC=C1 OR4683 [0,1,0,0,0,0|2,0,0]=3 231 B9R1.2 COC1=CC(Cl)=CC=C1 OR1078 [0,1,0,0,0,0|2,0,0]=3 232 B9R1.2 COC1=CC(Cl)=CC=N1 OR315215 [0,1,0,0,0,0|1,0,0]=2 233 B9R1.2 COC1=CC(Cl)=NC=C1 OR5617 [0,1,0,0,0,0|3,0,0]=4 234 B9R1.2 COC1=CC(Cl)=NC=N1 OR15518 [0,1,0,0,0,0|2,0,0]=3 235 B9R1.2 COC1=CC(I)=NC=N1 OR15524 [0,1,0,0,0,0|2,0,0]=3 236 B9R1.2 COC1=CC(N)=CC=C1 OR28775 [0,1,0,0,0,0|2,0,0]=3 237 B9R1.2 COC1=CC(N)=CC=N1 OR30557 [0,1,0,0,0,0|1,0,0]=2 238 B9R1.2 COC1=CC(N)=NC=C1 OR13856 [0,1,0,0,0,0|3,0,0]=4 239 B9R1.2 COC1=CC(N)=NC=N1 OR5359 [0,1,0,0,0,0|2,0,0]=3 240 B9R1.2 COC1=CC(O)=CN=C1 OR46115 [0,1,0,0,0,0|1,0,0]=2 241 B9R1.2 COC1=CC=CC(Br)=N1 OR2983 [0,1,0,0,0,0|1,0,0]=2 242 B9R1.2 COC1=CC=CC(C)=N1 OR9940 [0,1,0,0,0,0|1,0,0]=2 243 B9R1.2 COC1=CC=CC(I)=C1 OR14264 [0,1,0,0,0,0|2,0,0]=3 244 B9R1.2 COC1=CC=CC(N)=N1 OR5984 [0,1,0,0,0,0|1,0,0]=2 245 B9R1.2 COC1=CC=CC(S)=C1 OR0120 [0,1,0,0,0,0|2,0,0]=3 246 B9R1.2 COC1=CN=CC(Br)=N1 OR40079 [0,1,0,0,0,0|0,0,0]=1 247 B9R1.2 COC1=CN=CC(N)=C1 OR301042 [0,1,0,0,0,0|1,0,0]=2 248 B9R1.2 COC1=CN=CC(N)=N1 OR301157 [0,1,0,0,0,0|0,0,0]=1 249 B9R1.2 COC1=NC(Br)=CC=N1 OR30540 [0,1,0,0,0,0|2,0,0]=3 250 B9R1.2 COC1=NC(Cl)=CC=C1 OR3143 [0,1,0,0,0,0|1,0,0]=2 251 B9R1.2 COC1=NC(Cl)=CC=N1 OR30545 [0,1,0,0,0,0|2,0,0]=3 252 B9R1.2 COC1=NC(Cl)=NC=C1 OR46001 [0,1,0,0,0,0|2,0,0]=3 253 B9R1.2 COC1=NC(N)=CC=N1 OR16620 [0,1,0,0,0,0|2,0,0]=3 254 B9R1.2 COC1=NC(N)=NC=C1 OR40024 [0,1,0,0,0,0|2,0,0]=3 255 B9R1.2 COC1=NC(O)=CC=N1 OR30542 [0,1,0,0,0,0|2,0,0]=3 256 B9R1.2 COC1=NC=CC(Br)=C1 OR11605 [0,1,0,0,0,0|1,0,0]=2 257 B9R1.2 CSC1=CC(Br)=CC=C1 OR4652 [0,1,0,0,0,0|2,1,0]=4 258 B9R1.2 CSC1=CC(Cl)=CC=C1 OR9711 [0,1,0,0,0,0|2,1,0]=4 259 B9R1.2 CSC1=CC=CC(Br)=N1 OR15633 [0,1,0,0,0,0|1,1,0]=3 260 B9R1.2 CSC1=CC=CC(N)=C1 OR4782 [0,1,0,0,0,0|2,1,0]=4 261 B9R1.2 CSC1=CN=CC(Br)=C1 OR3600 [0,1,0,0,0,0|1,1,0]=3 262 B9R1.2 CSC1=NC(=O)C=NN1 OR28167 [0,1,0,0,0,0|1,1,0]=3 263 B9R1.2 CSC1=NC(C)=CC=N1 OR60031 [0,1,0,0,0,0|2,1,0]=4 264 B9R1.2 CSC1=NC(Cl)=NC=C1 OR15519 [0,1,0,0,0,0|2,1,0]=4 265 B9R1.2 CSC1=NC=CC(Cl)=N1 OR6414 [0,1,0,0,0,0|2,1,0]=4 266 B9R1.2 CSC1=NC=CC(I)=N1 OR15525 [0,1,0,0,0,0|2,1,0]=4 267 B9R1.2 CSC1=NC=CC(N)=N1 OR59797 [0,1,0,0,0,0|2,1,0]=4 268 B9R1.2 ClCC1=CN=CC(Br)=C1 OR14923 [0,1,0,0,0,0|3,0,0]=4 269 B9R1.2 ClCC1=CN=CC(Cl)=C1 OR40752 [0,1,0,0,0,0|3,0,0]=4 270 B9R1.2 ClCC1=NC(Cl)=CC=C1 OR303732 [0,1,0,0,0,0|3,0,0]=4 271 B9R1.2 N#CC1=CC(Br)=CN=C1 OR3918 [0,1,0,0,0,0|3,0,0]=4 272 B9R1.2 N#CC1=CC(Cl)=CC=N1 OR300669 [0,1,0,0,0,0|3,0,0]=4 273 B9R1.2 N#CC1=CC(Cl)=CN=C1 OR46037 [0,1,0,0,0,0|3,0,0]=4 274 B9R1.2 N#CC1=CC=CC(Cl)=N1 OR4835 [0,1,0,0,0,0|3,0,0]=4 275 B9R1.2 N#CC1=CC=CC(N)=N1 OR302542 [0,1,0,0,0,0|3,0,0]=4 276 B9R1.2 N#CC1=CN=CC(O)=C1 OR301211 [0,1,0,0,0,0|3,0,0]=4 277 B9R1.2 N#CC1=NC(Br)=CC=C1 OR2804 [0,1,0,0,0,0|3,0,0]=4 278 B9R1.2 N#CC1=NC(Cl)=CN=C1 OR18116 [0,1,0,0,0,0|2,0,0]=3 279 B9R1.2 N#CC1=NC=CC(Br)=C1 OR17101 [0,1,0,0,0,0|3,0,0]=4 280 B9R1.2 N#CC1=NC=CC(I)=C1 OR3544 [0,1,0,0,0,0|3,0,0]=4 281 B9R1.2 NCC1=CC(Br)=CN=C1 OR14911 [0,1,0,0,0,0|3,0,0]=4 282 B9R1.2 NCC1=NC(O)=CC=C1 OR60161 [0,1,0,0,0,0|3,0,0]=4 283 B9R1.2 NCC1=NC=CC(Br)=C1 OR52531 [0,1,0,0,0,0|3,0,0]=4 284 B9R1.2 NNC1=CC=CC(Cl)=N1 OR2830 [0,1,0,0,0,0|3,0,0]=4 285 B9R1.2 NNC1=NC(Br)=CC=C1 OR13857 [0,1,0,0,0,0|3,0,0]=4 286 B9R1.2 NNC1=NC(Cl)=CN=C1 OR60236 [0,1,0,0,0,0|2,0,0]=3 287 B9R1.2 O=CC1=CC(Br)=CN=C1 OR4712 [0,1,0,0,0,0|3,0,0]=4 288 B9R1.2 O=CC1=CC(Cl)=CN=C1 OR61039 [0,1,0,0,0,0|3,0,0]=4 289 B9R1.2 O=CC1=CC(O)=CN=C1 OR53003 [0,1,0,0,0,0|3,0,0]=4 290 B9R1.2 O=CC1=NC(Br)=CC=C1 OR1460 [0,1,0,0,0,0|3,0,0]=4 291 B9R1.2 O=CC1=NC(Cl)=CC=C1 OR51757 [0,1,0,0,0,0|3,0,0]=4 292 B9R1.2 O=CC1=NC(O)=CC=C1 OR59433 [0,1,0,0,0,0|3,0,0]=4 293 B9R1.2 O=CC1=NC=CC(Br)=C1 OR302555 [0,1,0,0,0,0|3,0,0]=4 294 B9R1.2 OCC1=CC=CC(Br)=N1 OR3668 [0,1,0,0,0,0|3,0,0]=4 295 B9R1.2 OCC1=CC=CC(Cl)=N1 OR303659 [0,1,0,0,0,0|3,0,0]=4 296 B9R1.2 OCC1=CN=CC(Br)=C1 OR3285 [0,1,0,0,0,0|3,0,0]=4 297 B9R1.2 OCC1=NC=CC(Br)=C1 OR53132 [0,1,0,0,0,0|3,0,0]=4 298 B9R1.2 OCC1=NC=CC(Cl)=C1 OR3538 [0,1,0,0,0,0|3,0,0]=4 299 B9R1.6 CC(=O)C1=CC=CN=C1 OR5046 [0,1,0,0,0,0|2,0,0]=3 300 B9R1.6 CC(=O)C1=CN=CN=C1 OR30703 [0,1,0,0,0,0|3,0,0]=4 301 B9R1.6 CC(=O)C1=NC=CC=C1 OR5045 [0,1,0,0,0,0|2,0,0]=3 302 B9R1.6 CC(=O)C1=NC=CC=N1 OR16083 [0,1,0,0,0,0|3,0,0]=4 303 B9R1.6 CC(=O)C1=NC=CN=C1 OR5593 [0,1,0,0,0,0|1,0,0]=2 304 B9R1.6 CC(Br)C1=CC=CC=C1 OR315258 [0,1,0,0,0,0|3,0,0]=4 305 B9R1.6 CC(Br)C1=CC=CN=C1 OR46058 [0,1,0,0,0,0|2,0,0]=3 306 B9R1.6 CC(Cl)C1=CC=CC=C1 OR9525 [0,1,0,0,0,0|3,0,0]=4 307 B9R1.6 CC(N)C1=CN=CC=C1 OR01562 [0,1,0,0,0,0|2,0,0]=3 308 B9R1.6 CC(N)C1=NC=CC=C1 OR01560 [0,1,0,0,0,0|2,0,0]=3 309 B9R1.6 CC(O)C1=CC=CC=N1 OR01623 [0,1,0,0,0,0|2,0,0]=3 310 B9R1.6 CC(O)C1=CC=CN=C1 OR01622 [0,1,0,0,0,0|2,0,0]=3 311 B9R1.6 CN(C)C1=CC=CC=C1 OR61405 [0,1,0,0,0,0|3,0,0]=4 312 B9R1.6 CN(C)C1=NC=CC=C1 OR13607 [0,1,0,0,0,0|2,0,0]=3 313 B9R1.6 CN(N)C1=CC=CC=C1 OR55581 [0,1,0,0,0,0|3,0,0]=4 314 B9R1.6 CS(=O)C1=CC=CC=C1 OR30635 [0,1,0,0,0,0|2,1,0]=4 315 B9R1.6 C[C@@H](N)C1=CC=CC=C1 OR5862 [0,1,0,0,0,0|3,0,0]=4 316 B9R1.6 C[C@@H](N)C1=NC=CC=C1 OR70108 [0,1,0,0,0,0|2,0,0]=3 317 B9R1.6 C[C@@H](O)C1=CC=CC=C1 OR315316 [0,1,0,0,0,0|3,0,0]=4 318 B9R1.6 C[C@H](N)C1=CC=CC=C1 OR28829 [0,1,0,0,0,0|3,0,0]=4 319 B9R1.6 C[C@H](N)C1=NC=CC=C1 OR46602 [0,1,0,0,0,0|2,0,0]=3 320 B9R1.6 N=C(N)C1=CC=CN=C1 OR9026 [0,1,0,0,0,0|3,0,0]=4 321 B9R1.6 N=C(N)C1=NC=CC=C1 OR1303 [0,1,0,0,0,0|3,0,0]=4 322 B9R1.6 N=C(N)C1=NC=CN=C1 OR3402 [0,1,0,0,0,0|2,0,0]=3 323 B9R1.6 NC(=O)C1=NC=CN=C1 OR9043 [0,1,0,0,0,0|2,0,0]=3 324 B9R1.6 NC(=S)C1=NC=CN=C1 OR29190 [0,1,0,0,0,0|2,0,0]=3 325 B9R1.6 O=C(Cl)C1=CC=CN=C1 OR46575 [0,1,0,0,0,0|3,0,0]=4 326 B9R1.6 O=C(Cl)C1=NC=CC=C1 OR20043 [0,1,0,0,0,0|3,0,0]=4 327 B9R1.6 O=C(Cl)C1=NC=CC=C1 OR6370 [0,1,0,0,0,0|3,0,0]=4 328 B9R1.6 O=C(O)C1=NC=CC=C1 OR23054 [0,1,0,0,0,0|3,0,0]=4 329 B9R1.6 O=C(O)C1=NC=CN=C1 OR11036 [0,1,0,0,0,0|2,0,0]=3 330 B9R1.6 O=C([O-])C1=NC=CN=N1 OR45150 [0,1,0,0,0,0|3,0,0]=4 331 B9R1.6 O=[N+]([O-])C1=CC=CC=N1 OR16075 [0,1,0,0,0,0|3,0,0]=4 332 B9R1.6 O=[N+]([O-])C1=CN=CC=C1 OR345060 [0,1,0,0,0,0|3,0,0]=4 333 B9R1.6 OB(O)C1=CC=CN=C1 OR4119 [0,1,0,0,0,0|3,0,0]=4 334 B9R1.8 BrCCC1=CC=CC=C1 OR46084 [0,1,0,0,0,0|3,0,0]=4 335 B9R1.8 CCNC1=CC=CC=C1 OR8988 [0,1,0,0,0,0|3,0,0]=4 336 B9R1.8 CCOC1=NC=CC=C1 OR40436 [0,1,0,0,0,0|1,0,0]=2 337 B9R1.8 CNCC1=CC=CC=C1 OR12500 [0,1,0,0,0,0|3,0,0]=4 338 B9R1.8 CNCC1=CC=CN=C1 OR30155 [0,1,0,0,0,0|2,0,0]=3 339 B9R1.8 CNCC1=NC=CC=C1 OR12501 [0,1,0,0,0,0|2,0,0]=3 340 B9R1.8 CNCC1=NC=CC=C1 OR51995 [0,1,0,0,0,0|2,0,0]=3 341 B9R1.8 COCC1=NC=CC=C1 OR13609 [0,1,0,0,0,0|1,0,0]=2 342 B9R1.8 ClCCC1=NC=CC=C1 OR303592 [0,1,0,0,0,0|2,0,0]=3 343 B9R1.8 ClCSC1=CC=CC=C1 OR0789 [0,1,0,0,0,0|2,1,0]=4 344 B9R1.8 N#CCC1=NC=CC=C1 OR28680 [0,1,0,0,0,0|2,0,1]=4 345 B9R1.8 NCCC1=NC=CC=C1 OR28599 [0,1,0,0,0,0|2,0,0]=3 346 B9R1.8 NCCC1=NC=CN=C1 OR1046 [0,1,0,0,0,0|1,0,0]=2 347 B9R1.8 NOCC1=CC=CC=C1 OR15742 [0,1,0,0,0,0|3,0,0]=4 348 B9R1.8 NOCC1=CC=CC=C1 OR30224 [0,1,0,0,0,0|3,0,0]=4 349 B9R1.8 O=C=NC1=CC=CC=N1 OR52645 [0,1,0,0,0,0|2,0,1]=4 350 B9R1.8 O=C=NC1=CC=CN=C1 OR41050 [0,1,0,0,0,0|2,0,1]=4 351 B9R1.8 OCCC1=CC=CN=C1 OR0520 [0,1,0,0,0,0|2,0,0]=3 352 B9R1.8 OCCC1=NC=CC=C1 OR13610 [0,1,0,0,0,0|2,0,0]=3 353 B9R1.8 O\N=C\C1=NC=CC=C1 OR2013 [0,1,0,0,0,0|3,0,0]=4 354 B9R1.8 O\N=C\C1=NC=CC=C1 OR24107 [0,1,0,0,0,0|3,0,0]=4 355 B9R1.8 S=C=NC1=CC=CN=C1 OR1254 [0,1,0,0,0,0|2,0,1]=4 356 B9R1.8 SCCC1=NC=CC=C1 OR305591 [0,1,0,0,0,0|2,0,0]=3 357 B9R1.15 BrCC1=CC=CN=C1Br OR60069 [0,1,0,0,0,0|3,0,0]=4 358 B9R1.15 C#CC1=NC=CC=C1Br OR19508 [0,1,0,0,0,0|2,0,1]=4 359 B9R1.15 C#CC1=NC=CC=C1C OR53007 [0,1,0,0,0,0|2,0,1]=4 360 B9R1.15 C#CC1=NC=CN=C1C OR53020 [0,1,0,0,0,0|1,0,1]=3 361 B9R1.15 C#CC1=NC=CN=C1Cl OR53015 [0,1,0,0,0,0|1,0,1]=3 362 B9R1.15 CC1=C(C#N)C=NC=C1 OR3147 [0,1,0,0,0,0|3,0,0]=4 363 B9R1.15 CC1=C(C=O)N=CC=C1 OR60091 [0,1,0,0,0,0|3,0,0]=4 364 B9R1.15 CC1=CC=CN=C1C#N OR11740 [0,1,0,0,0,0|3,0,0]=4 365 B9R1.15 CC1=CC=CN=C1CN OR52052 [0,1,0,0,0,0|3,0,0]=4 366 B9R1.15 CC1=NC=CN=C1NN OR60215 [0,1,0,0,0,0|2,0,0]=3 367 B9R1.15 CCC1=C(Br)C=CC=C1 OR4187 [0,1,0,0,0,0|3,0,0]=4 368 B9R1.15 CCC1=C(Br)C=NC=N1 OR11580 [0,1,0,0,0,0|3,0,0]=4 369 B9R1.15 CCC1=C(O)C=CC=C1 OR16005 [0,1,0,0,0,0|3,0,0]=4 370 B9R1.15 CCC1=CC=CC=C1I OR30075 [0,1,0,0,0,0|3,0,0]=4 371 B9R1.15 CNC1=C(Br)C=CC=C1 OR11598 [0,1,0,0,0,0|3,0,0]=4 372 B9R1.15 CNC1=C(O)C=CC=C1 OR5095 [0,1,0,0,0,0|3,0,0]=4 373 B9R1.15 CNC1=CC=CC=C1Cl OR30110 [0,1,0,0,0,0|3,0,0]=4 374 B9R1.15 CNC1=CC=CC=C1N OR30623 [0,1,0,0,0,0|3,0,0]=4 375 B9R1.15 COC1=C(C)C=CC=C1 OR9430 [0,1,0,0,0,0|2,0,0]=3 376 B9R1.15 COC1=C(I)C=CC=C1 OR4678 [0,1,0,0,0,0|2,0,0]=3 377 B9R1.15 COC1=C(N)C=CN=C1 OR46502 [0,1,0,0,0,0|1,0,0]=2 378 B9R1.15 COC1=C(N)C=NC=C1 OR42156 [0,1,0,0,0,0|3,0,0]=4 379 B9R1.15 COC1=C(O)C=NC=C1 OR51782 [0,1,0,0,0,0|3,0,0]=4 380 B9R1.15 COC1=C(O)N=CC=C1 OR20000 [0,1,0,0,0,0|1,0,0]=2 381 B9R1.15 COC1=C(S)C=CC=C1 OR4848 [0,1,0,0,0,0|2,0,0]=3 382 B9R1.15 COC1=CC=CC=C1Br OR28661 [0,1,0,0,0,0|2,0,0]=3 383 B9R1.15 COC1=CC=CC=C1O OR10036 [0,1,0,0,0,0|2,0,0]=3 384 B9R1.15 COC1=CC=CN=C1Br OR7550 [0,1,0,0,0,0|1,0,0]=2 385 B9R1.15 COC1=CC=CN=C1Cl OR2800 [0,1,0,0,0,0|1,0,0]=2 386 B9R1.15 COC1=CC=CN=C1N OR8879 [0,1,0,0,0,0|1,0,0]=2 387 B9R1.15 COC1=CN=CC=C1O OR51777 [0,1,0,0,0,0|1,0,0]=2 388 B9R1.15 COC1=NC=CC=C1Br OR59385 [0,1,0,0,0,0|1,0,0]=2 389 B9R1.15 COC1=NC=CC=C1Cl OR8560 [0,1,0,0,0,0|1,0,0]=2 390 B9R1.15 COC1=NC=CC=C1N OR5833 [0,1,0,0,0,0|1,0,0]=2 391 B9R1.15 COC1=NC=CN=C1Cl OR61101 [0,1,0,0,0,0|0,0,0]=1 392 B9R1.15 COC1=NC=CN=C1N OR301247 [0,1,0,0,0,0|0,0,0]=1 393 B9R1.15 COC1=NC=NC=C1N OR30754 [0,1,0,0,0,0|2,0,0]=3 394 B9R1.15 CSC1=C(Br)C=CC=C1 OR30479 [0,1,0,0,0,0|2,1,0]=4 395 B9R1.15 CSC1=C(Cl)C=CC=C1 OR0032 [0,1,0,0,0,0|2,1,0]=4 396 B9R1.15 CSC1=C(N)C=CC=C1 OR4955 [0,1,0,0,0,0|2,1,0]=4 397 B9R1.15 ClCC1=CC=CN=C1Cl OR346119 [0,1,0,0,0,0|3,0,0]=4 398 B9R1.15 N#CC1=C(Br)C=CN=C1 OR40273 [0,1,0,0,0,0|3,0,0]=4 399 B9R1.15 N#CC1=C(O)N=CC=C1 OR21405 [0,1,0,0,0,0|3,0,0]=4 400 B9R1.15 N#CC1=CC=CN=C1Br OR46203 [0,1,0,0,0,0|3,0,0]=4 401 B9R1.15 N#CC1=CC=CN=C1Cl OR8401 [0,1,0,0,0,0|3,0,0]=4 402 B9R1.15 N#CC1=CC=CN=C1I OR3354 [0,1,0,0,0,0|3,0,0]=4 403 B9R1.15 N#CC1=CC=CN=C1N OR8628 [0,1,0,0,0,0|3,0,0]=4 404 B9R1.15 N#CC1=NC=CC=C1Br OR2027 [0,1,0,0,0,0|3,0,0]=4 405 B9R1.15 N#CC1=NC=CC=C1Cl OR6622 [0,1,0,0,0,0|3,0,0]=4 406 B9R1.15 N#CC1=NC=CC=C1N OR40675 [0,1,0,0,0,0|3,0,0]=4 407 B9R1.15 N#CC1=NC=CC=C1O OR7552 [0,1,0,0,0,0|3,0,0]=4 408 B9R1.15 N#CC1=NC=CN=C1Cl OR3400 [0,1,0,0,0,0|2,0,0]=3 409 B9R1.15 NC1=C(C=O)C=CC=N1 OR40471 [0,1,0,0,0,0|3,0,0]=4 410 B9R1.15 NC1=CC=NC=C1C=O OR4048 [0,1,0,0,0,0|3,0,0]=4 411 B9R1.15 NC1=NC=CC=C1CO OR6117 [0,1,0,0,0,0|3,0,0]=4 412 B9R1.15 NCC1=NC=CC=C1Br OR307010 [0,1,0,0,0,0|3,0,0]=4 413 B9R1.15 NCC1=NC=CC=C1Br OR55277 [0,1,0,0,0,0|3,0,0]=4 414 B9R1.15 NCC1=NC=CN=C1Cl OR301313 [0,1,0,0,0,0|2,0,0]=3 415 B9R1.15 NCC1=NC=CN=C1Cl OR54357 [0,1,0,0,0,0|2,0,0]=3 416 B9R1.15 NCC1=NC=CN=C1Cl OR61103 [0,1,0,0,0,0|2,0,0]=3 417 B9R1.15 NNC1=NC=CC=C1Cl OR6108 [0,1,0,0,0,0|3,0,0]=4 418 B9R1.15 NNC1=NC=CN=C1Cl OR61106 [0,1,0,0,0,0|2,0,0]=3 419 B9R1.15 O=CC1=C(Br)C=CN=C1 OR17534 [0,1,0,0,0,0|3,0,0]=4 420 B9R1.15 O=CC1=C(Cl)C=CN=C1 OR46034 [0,1,0,0,0,0|3,0,0]=4 421 B9R1.15 O=CC1=CC=CN=C1Br OR6170 [0,1,0,0,0,0|3,0,0]=4 422 B9R1.15 O=CC1=CC=CN=C1Cl OR59474 [0,1,0,0,0,0|3,0,0]=4 423 B9R1.15 O=CC1=NC=CC=C1Br OR3272 [0,1,0,0,0,0|3,0,0]=4 424 B9R1.15 O=CC1=NC=CC=C1Cl OR51758 [0,1,0,0,0,0|3,0,0]=4 425 B9R1.15 O=CC1=NC=CC=C1O OR0151 [0,1,0,0,0,0|3,0,0]=4 426 B9R1.15 OCC1=C(Cl)C=CN=C1 OR13855 [0,1,0,0,0,0|3,0,0]=4 427 B9R1.15 OCC1=CC=CN=C1Cl OR1462 [0,1,0,0,0,0|3,0,0]=4 428 B9R1.15 OCC1=NC=CC=C1Br OR60200 [0,1,0,0,0,0|3,0,0]=4 429 B9R1.15 OCC1=NC=CC=C1Cl OR303685 [0,1,0,0,0,0|3,0,0]=4 430 B9R1.15 OCC1=NC=CC=C1O OR2259 [0,1,0,0,0,0|3,0,0]=4 431 B9R1.15 OCC1=NC=CN=C1Cl OR321372 [0,1,0,0,0,0|2,0,0]=3 432 B7R0.1 CC\C=C\C=C\C=O OR6046 [0,0,1,0,0,0|3,0,0]=4 433 B7R1.1 BrCC1=CN=CO1 OR59852 [0,0,0,0,1,0|3,0,0]=4 434 B7R1.1 BrCC1=COC=C1 OR400006 [0,0,0,0,1,0|3,0,0]=4 435 B7R1.1 BrCC1=COC=N1 OR59848 [0,0,0,0,1,0|3,0,0]=4 436 B7R1.1 BrCC1=CSC=C1 OR43653 [0,0,0,0,1,0|3,0,0]=4 437 B7R1.1 BrCC1=CSC=N1 OR400168 [0,0,0,0,1,0|3,0,0]=4 438 B7R1.1 C#CC1=CC=CS1 OR9291 [0,0,0,0,1,0|2,0,1]=4 439 B7R1.1 C#CC1=CSC=C1 OR40642 [0,0,0,0,1,0|2,0,1]=4 440 B7R1.1 C=CC1=CC=CO1 OR400374 [0,0,0,0,1,0|2,0,1]=4 441 B7R1.1 C=CC1=CC=CS1 OR400376 [0,0,0,0,1,0|2,0,1]=4 442 B7R1.1 C=CC1=COC=C1 OR400372 [0,0,0,0,1,0|2,0,1]=4 443 B7R1.1 C=CC1=CSC=C1 OR400379 [0,0,0,0,1,0|2,0,1]=4 444 B7R1.1 C=CN1C=CN=C1 OR2901 [0,0,0,0,1,0|2,0,1]=4 445 B7R1.1 CCC1=CC=CN1 OR42007 [0,0,0,0,1,0|1,0,1]=3 446 B7R1.1 CCC1=CC=CO1 OR6028 [0,0,0,0,1,0|2,0,0]=3 447 B7R1.1 CCC1=CC=CS1 OR7250 [0,0,0,0,1,0|2,0,0]=3 448 B7R1.1 CCC1=CSC=N1 OR303339 [0,0,0,0,1,0|2,0,0]=3 449 B7R1.1 CCC1=NC=CN1 OR2906 [0,0,0,0,1,0|1,0,1]=3 450 B7R1.1 CCN1C=CC=N1 OR61206 [0,0,0,0,1,0|2,0,0]=3 451 B7R1.1 CCN1C=CN=C1 OR2905 [0,0,0,0,1,0|2,0,0]=3 452 B7R1.1 COC1=CSC=C1 OR6628 [0,0,0,0,1,0|1,0,0]=2 453 B7R1.1 CSC1=CC=CS1 OR4091 [0,0,0,0,1,0|1,1,0]=3 454 B7R1.1 CSC1=CSC=C1 OR25457 [0,0,0,0,1,0|1,1,0]=3 455 B7R1.1 CSC1=NN=CN1 OR019167 [0,0,0,0,1,0|1,1,1]=4 456 B7R1.1 ClCC1=CC=CO1 OR310257 [0,0,0,0,1,0|3,0,0]=4 457 B7R1.1 ClCC1=CC=CS1 OR305427 [0,0,0,0,1,0|3,0,0]=4 458 B7R1.1 ClCC1=CNC=N1 OR15569 [0,0,0,0,1,0|2,0,1]=4 459 B7R1.1 ClCC1=CSC=C1 OR6634 [0,0,0,0,1,0|3,0,0]=4 460 B7R1.1 ClCC1=CSC=N1 OR15568 [0,0,0,0,1,0|3,0,0]=4 461 B7R1.1 ClCC1=NC=CN1 OR7713 [0,0,0,0,1,0|2,0,1]=4 462 B7R1.1 ClCC1=NC=CO1 OR301217 [0,0,0,0,1,0|3,0,0]=4 463 B7R1.1 ClCC1=NOC=N1 OR1286 [0,0,0,0,1,0|3,0,0]=4 464 B7R1.1 N#CC1=CC=CN1 OR60193 [0,0,0,0,1,0|2,0,1]=4 465 B7R1.1 N#CC1=CC=CO1 OR30131 [0,0,0,0,1,0|3,0,0]=4 466 B7R1.1 N#CC1=CC=CS1 OR18362 [0,0,0,0,1,0|3,0,0]=4 467 B7R1.1 N#CC1=CNC=N1 OR55181 [0,0,0,0,1,0|2,0,1]=4 468 B7R1.1 N#CC1=CNN=C1 OR61205 [0,0,0,0,1,0|3,0,0]=4 469 B7R1.1 N#CC1=COC=C1 OR40038 [0,0,0,0,1,0|3,0,0]=4 470 B7R1.1 N#CC1=COC=N1 OR60008 [0,0,0,0,1,0|3,0,0]=4 471 B7R1.1 N#CC1=CSC=C1 OR0832 [0,0,0,0,1,0|3,0,0]=4 472 B7R1.1 N#CC1=NNC=N1 OR11327 [0,0,0,0,1,0|3,0,0]=4 473 B7R1.1 N#CC1=NSC=C1 OR40802 [0,0,0,0,1,0|3,0,0]=4 474 B7R1.1 N#CN1C=CN=C1 OR8175T [0,0,0,0,1,0|3,0,0]=4 475 B7R1.1 NCC1=CC=CO1 OR23026 [0,0,0,0,1,0|3,0,0]=4 476 B7R1.1 NCC1=CC=CS1 OR6799 [0,0,0,0,1,0|3,0,0]=4 477 B7R1.1 NCC1=CN=CO1 OR59854 [0,0,0,0,1,0|3,0,0]=4 478 B7R1.1 NCC1=CN=CS1 OR20040 [0,0,0,0,1,0|3,0,0]=4 479 B7R1.1 NCC1=CN=CS1 OR30800 [0,0,0,0,1,0|3,0,0]=4 480 B7R1.1 NCC1=COC=C1 OR12311 [0,0,0,0,1,0|3,0,0]=4 481 B7R1.1 NCC1=COC=C1 OR23031 [0,0,0,0,1,0|3,0,0]=4 482 B7R1.1 NCC1=COC=N1 OR17028 [0,0,0,0,1,0|3,0,0]=4 483 B7R1.1 NCC1=COC=N1 OR59850 [0,0,0,0,1,0|3,0,0]=4 484 B7R1.1 NCC1=CSC=C1 OR23203 [0,0,0,0,1,0|3,0,0]=4 485 B7R1.1 NCC1=NC=CN1 OR6209 [0,0,0,0,1,0|2,0,1]=4 486 B7R1.1 NCC1=NC=CO1 OR313058 [0,0,0,0,1,0|3,0,0]=4 487 B7R1.1 NCC1=NC=CS1 OR59828 [0,0,0,0,1,0|3,0,0]=4 488 B7R1.1 NCC1=NC=CS1 OR61043 [0,0,0,0,1,0|3,0,0]=4 489 B7R1.1 NCC1=NOC=N1 OR6210 [0,0,0,0,1,0|3,0,0]=4 490 B7R1.1 O=CC1=CC=CN1 OR23112 [0,0,0,0,1,0|2,0,1]=4 491 B7R1.1 O=CC1=CC=CO1 OR23023 [0,0,0,0,1,0|3,0,0]=4 492 B7R1.1 O=CC1=CC=CS1 OR5053 [0,0,0,0,1,0|3,0,0]=4 493 B7R1.1 O=CC1=CC=NN1 OR301050 [0,0,0,0,1,0|3,0,0]=4 494 B7R1.1 O=CC1=CC=NO1 OR1858 [0,0,0,0,1,0|3,0,0]=4 495 B7R1.1 O=CC1=CC=NS1 OR18559 [0,0,0,0,1,0|3,0,0]=4 496 B7R1.1 O=CC1=CN=CO1 OR52173 [0,0,0,0,1,0|3,0,0]=4 497 B7R1.1 O=CC1=CN=CS1 OR10588 [0,0,0,0,1,0|3,0,0]=4 498 B7R1.1 O=CC1=CNC=C1 OR6181 [0,0,0,0,1,0|2,0,1]=4 499 B7R1.1 O=CC1=CNC=N1 OR2743 [0,0,0,0,1,0|2,0,1]=4 500 B7R1.1 O=CC1=CNN=C1 OR301063 [0,0,0,0,1,0|3,0,0]=4 501 B7R1.1 O=CC1=COC=C1 OR23028 [0,0,0,0,1,0|3,0,0]=4 502 B7R1.1 O=CC1=COC=N1 OR12860 [0,0,0,0,1,0|3,0,0]=4 503 B7R1.1 O=CC1=CSC=C1 OR5054 [0,0,0,0,1,0|3,0,0]=4 504 B7R1.1 O=CC1=CSC=N1 OR13153 [0,0,0,0,1,0|3,0,0]=4 505 B7R1.1 O=CC1=CSN=C1 OR52174 [0,0,0,0,1,0|3,0,0]=4 506 B7R1.1 O=CC1=NC=CN1 OR0497 [0,0,0,0,1,0|2,0,1]=4 507 B7R1.1 O=CC1=NC=CO1 OR14993 [0,0,0,0,1,0|3,0,0]=4 508 B7R1.1 O=CC1=NC=CS1 OR14343 [0,0,0,0,1,0|3,0,0]=4 509 B7R1.1 O=CC1=NNC=C1 OR46247 [0,0,0,0,1,0|3,0,0]=4 510 B7R1.1 OCC1=CC=CO1 OR23024 [0,0,0,0,1,0|3,0,0]=4 511 B7R1.1 OCC1=CC=CS1 OR59889 [0,0,0,0,1,0|3,0,0]=4 512 B7R1.1 OCC1=CC=NS1 OR18560 [0,0,0,0,1,0|3,0,0]=4 513 B7R1.1 OCC1=CN=CO1 OR3790 [0,0,0,0,1,0|3,0,0]=4 514 B7R1.1 OCC1=CN=CS1 OR5597 [0,0,0,0,1,0|3,0,0]=4 515 B7R1.1 OCC1=CNC=N1 OR2014 [0,0,0,0,1,0|2,0,1]=4 516 B7R1.1 OCC1=CNC=N1 OR6427 [0,0,0,0,1,0|2,0,1]=4 517 B7R1.1 OCC1=CNN=C1 OR302030 [0,0,0,0,1,0|3,0,0]=4 518 B7R1.1 OCC1=COC=C1 OR23029 [0,0,0,0,1,0|3,0,0]=4 519 B7R1.1 OCC1=COC=N1 OR59847 [0,0,0,0,1,0|3,0,0]=4 520 B7R1.1 OCC1=CSC=C1 OR10141 [0,0,0,0,1,0|3,0,0]=4 521 B7R1.1 OCC1=CSC=N1 OR5598 [0,0,0,0,1,0|3,0,0]=4 522 B7R1.1 OCC1=NC=CN1 OR23115 [0,0,0,0,1,0|2,0,1]=4 523 B7R1.1 OCC1=NC=CN1 OR6415 [0,0,0,0,1,0|2,0,1]=4 524 B7R1.1 OCC1=NC=CO1 OR59845 [0,0,0,0,1,0|3,0,0]=4 525 B7R1.1 OCC1=NC=CS1 OR14307 [0,0,0,0,1,0|3,0,0]=4 526 B7R1.1 OCC1=NNC=C1 OR52395 [0,0,0,0,1,0|3,0,0]=4 527 B7R1.1 OCC1=NOC=C1 OR305308 [0,0,0,0,1,0|3,0,0]=4 528 B7R1.1 SCC1=CC=CS1 OR51965 [0,0,0,0,1,0|3,0,0]=4 529 B6R0.6 C\C=C\C=C\C=O OR6049 [1,0,1,0,0,0|2,0,0]=4 530 B6R1.1 C1=CC=NC=C1 OR10003 [2,0,0,0,0,0|1,0,0]=3 531 B6R1.1 C1=CC=NC=C1 OR13635 [2,0,0,0,0,0|1,0,0]=3 532 B6R1.1 C1=CC=NC=C1 OR13636 [2,0,0,0,0,0|1,0,0]=3 533 B6R1.1 C1=CC=NC=C1 OR15023 [2,0,0,0,0,0|1,0,0]=3 534 B6R1.1 C1=CC=NC=C1 OR24145 [2,0,0,0,0,0|1,0,0]=3 535 B6R1.1 C1=CC=NC=C1 OR41162 [2,0,0,0,0,0|1,0,0]=3 536 B6R1.1 C1=CC=[NH+]C=C1 OR0728 [2,0,0,0,0,0|1,0,1]=4 537 B6R1.1 C1=CN=CC=N1 OR24901 [2,0,0,0,0,0|0,0,0]=2 538 B8R1.3 BrC1=CN=C(Br)C=C1 OR12002 [1,1,0,0,0,0|2,0,0]=4 539 B8R1.3 BrC1=CN=C(Br)C=N1 OR12499 [1,1,0,0,0,0|1,0,0]=3 540 B8R1.3 BrC1=CN=C(I)C=C1 OR1964 [1,1,0,0,0,0|2,0,0]=4 541 B8R1.3 BrC1=CN=C(I)C=N1 OR2986 [1,1,0,0,0,0|1,0,0]=3 542 B8R1.3 CC1=CC=C(Br)C=C1 OR1485 [1,1,0,0,0,0|2,0,0]=4 543 B8R1.3 CC1=CC=C(Cl)C=C1 OR3751 [1,1,0,0,0,0|2,0,0]=4 544 B8R1.3 CC1=CC=C(Cl)N=N1 OR21484 [1,1,0,0,0,0|2,0,0]=4 545 B8R1.3 CC1=CC=C(I)C=C1 OR8875 [1,1,0,0,0,0|2,0,0]=4 546 B8R1.3 CC1=CC=C(I)N=N1 OR20044 [1,1,0,0,0,0|2,0,0]=4 547 B8R1.3 CC1=CC=C(N)N=N1 OR30962 [1,1,0,0,0,0|2,0,0]=4 548 B8R1.3 CC1=CC=C(O)C=C1 OR6012 [1,1,0,0,0,0|2,0,0]=4 549 B8R1.3 CC1=CC=C(O)C=N1 OR13853 [1,1,0,0,0,0|1,0,0]=3 550 B8R1.3 CC1=CC=C(O)N=C1 OR40330 [1,1,0,0,0,0|1,0,0]=3 551 B8R1.3 CC1=CC=C(O)N=N1 OR5828 [1,1,0,0,0,0|2,0,0]=4 552 B8R1.3 CC1=CC=C(S)C=C1 OR43548 [1,1,0,0,0,0|2,0,0]=4 553 B8R1.3 CC1=CN=C(Br)C=C1 OR0845 [1,1,0,0,0,0|1,0,0]=3 554 B8R1.3 CC1=CN=C(C)C=C1 OR13598 [1,1,0,0,0,0|1,0,0]=3 555 B8R1.3 CC1=CN=C(C)C=N1 OR6021 [1,1,0,0,0,0|0,0,0]=2 556 B8R1.3 CC1=CN=C(Cl)C=C1 OR13605 [1,1,0,0,0,0|1,0,0]=3 557 B8R1.3 CC1=CN=C(Cl)C=N1 OR40049 [1,1,0,0,0,0|0,0,0]=2 558 B8R1.3 CC1=CN=C(Cl)N=C1 OR46244 [1,1,0,0,0,0|2,0,0]=4 559 B8R1.3 CC1=CN=C(N)C=C1 OR28779 [1,1,0,0,0,0|1,0,0]=3 560 B8R1.3 CC1=CN=C(N)C=N1 OR16560 [1,1,0,0,0,0|0,0,0]=2 561 B8R1.3 CC1=CN=C(O)C=N1 OR40054 [1,1,0,0,0,0|0,0,0]=2 562 B8R1.3 CC1=NC=C(Br)C=C1 OR6948 [1,1,0,0,0,0|1,0,0]=3 563 B8R1.3 CC1=NC=C(Br)C=N1 OR59447 [1,1,0,0,0,0|2,0,0]=4 564 B8R1.3 CC1=NC=C(N)C=C1 OR5274 [1,1,0,0,0,0|1,0,0]=3 565 B8R1.3 CC1=NNC(=O)C=C1 OR21483 [1,1,0,0,0,0|2,0,0]=4 566 B8R1.3 CC1=NNC(=O)C=C1 OR52459 [1,1,0,0,0,0|2,0,0]=4 567 B8R1.3 ClC1=CN=C(Br)C=C1 OR5182 [1,1,0,0,0,0|2,0,0]=4 568 B8R1.3 ClC1=CN=C(Br)C=N1 OR60106 [1,1,0,0,0,0|1,0,0]=3 569 B8R1.3 ClC1=CN=C(Cl)C=C1 OR4274 [1,1,0,0,0,0|2,0,0]=4 570 B8R1.3 ClC1=CN=C(Cl)C=N1 OR16998 [1,1,0,0,0,0|1,0,0]=3 571 B8R1.3 ClC1=CN=C(I)C=C1 OR59920 [1,1,0,0,0,0|2,0,0]=4 572 B8R1.3 ClC1=NC=C(Br)C=C1 OR5181 [1,1,0,0,0,0|2,0,0]=4 573 B8R1.3 ClC1=NC=C(I)C=C1 OR15739 [1,1,0,0,0,0|2,0,0]=4 574 B8R1.3 NC1=CC=C(Cl)C=N1 OR13201 [1,1,0,0,0,0|2,0,0]=4 575 B8R1.3 NC1=CC=C(O)C=C1 OR8828 [1,1,0,0,0,0|2,0,0]=4 576 B8R1.3 NC1=CN=C(Br)C=C1 OR5471 [1,1,0,0,0,0|2,0,0]=4 577 B8R1.3 NC1=CN=C(Cl)C=C1 OR1348 [1,1,0,0,0,0|2,0,0]=4 578 B8R1.3 NC1=CN=C(N)C=C1 OR6458 [1,1,0,0,0,0|2,0,0]=4 579 B8R1.3 NC1=CN=C(O)C=C1 OR60068 [1,1,0,0,0,0|1,0,0]=3 580 B8R1.3 NC1=NC=C(Br)C=C1 OR12001 [1,1,0,0,0,0|2,0,0]=4 581 B8R1.3 NC1=NC=C(Br)N=C1 OR13181 [1,1,0,0,0,0|1,0,0]=3 582 B8R1.3 NC1=NC=C(Cl)N=C1 OR61102 [1,1,0,0,0,0|1,0,0]=3 583 B8R1.3 NC1=NC=C(I)C=C1 OR5567 [1,1,0,0,0,0|2,0,0]=4 584 B8R1.3 NC1=NC=C(O)C=C1 OR16984 [1,1,0,0,0,0|1,0,0]=3 585 B8R1.3 NC1=NC=C(O)C=C1 OR2889 [1,1,0,0,0,0|1,0,0]=3 586 B8R1.3 NC1=NC=C(O)C=N1 OR61304 [1,1,0,0,0,0|2,0,0]=4 587 B8R1.3 OC1=CC=C(Br)C=C1 OR10618 [1,1,0,0,0,0|2,0,0]=4 588 B8R1.3 OC1=CC=C(Cl)C=C1 OR8830 [1,1,0,0,0,0|2,0,0]=4 589 B8R1.3 OC1=CC=C(I)C=C1 OR5400 [1,1,0,0,0,0|2,0,0]=4 590 B8R1.3 OC1=CC=C(S)C=C1 OR4561 [1,1,0,0,0,0|2,0,0]=4 591 B8R1.3 OC1=CN=C(Br)C=C1 OR4713 [1,1,0,0,0,0|1,0,0]=3 592 B8R1.3 OC1=CN=C(Cl)C=C1 OR8994 [1,1,0,0,0,0|1,0,0]=3 593 B8R1.3 OC1=CN=C(Cl)N=C1 OR40574 [1,1,0,0,0,0|2,0,0]=4 594 B8R1.3 OC1=CN=C(O)N=C1 OR315275 [1,1,0,0,0,0|2,0,0]=4 595 B8R1.3 OC1=NC=C(Br)C=C1 OR4273 [1,1,0,0,0,0|1,0,0]=3 596 B8R1.3 OC1=NC=C(Br)C=N1 OR8863 [1,1,0,0,0,0|2,0,0]=4 597 B8R1.3 OC1=NC=C(Br)N=C1 OR01486 [1,1,0,0,0,0|0,0,0]=2 598 B8R1.3 OC1=NC=C(Cl)C=C1 OR6406 [1,1,0,0,0,0|1,0,0]=3 599 B8R1.3 OC1=NC=C(Cl)N=C1 OR301051 [1,1,0,0,0,0|0,0,0]=2 600 B8R1.3 OC1=NC=C(I)C=C1 OR46204 [1,1,0,0,0,0|1,0,0]=3 601 B8R1.3 SC1=NC=C(Cl)C=C1 OR3682 [1,1,0,0,0,0|1,1,0]=4 602 B8R1.4 BrC1=CC(Br)=NC=C1 OR8632 [1,1,0,0,0,0|2,0,0]=4 603 B8R1.4 BrC1=CC=CC(Br)=N1 OR28767 [1,1,0,0,0,0|2,0,0]=4 604 B8R1.4 BrC1=CN=CC(Br)=C1 OR1947 [1,1,0,0,0,0|2,0,0]=4 605 B8R1.4 BrC1=CN=CC(Br)=N1 OR40072 [1,1,0,0,0,0|1,0,0]=3 606 B8R1.4 BrC1=CN=CC(I)=C1 OR6617 [1,1,0,0,0,0|2,0,0]=4 607 B8R1.4 BrC1=NC(I)=CC=C1 OR5748 [1,1,0,0,0,0|2,0,0]=4 608 B8R1.4 BrC1=NC=CC(I)=C1 OR4479 [1,1,0,0,0,0|2,0,0]=4 609 B8R1.4 CC1=CC(=O)NN=C1 OR2216 [1,1,0,0,0,0|2,0,0]=4 610 B8R1.4 CC1=CC(Br)=CC=C1 OR4938 [1,1,0,0,0,0|2,0,0]=4 611 B8R1.4 CC1=CC(Br)=NC=C1 OR6454 [1,1,0,0,0,0|2,0,0]=4 612 B8R1.4 CC1=CC(C)=NC=C1 OR13597 [1,1,0,0,0,0|1,0,0]=3 613 B8R1.4 CC1=CC(Cl)=CN=C1 OR315112 [1,1,0,0,0,0|1,0,0]=3 614 B8R1.4 CC1=CC(Cl)=NC=C1 OR13604 [1,1,0,0,0,0|2,0,0]=4 615 B8R1.4 CC1=CC(Cl)=NC=N1 OR60081 [1,1,0,0,0,0|2,0,0]=4 616 B8R1.4 CC1=CC(I)=CC=C1 OR15022 [1,1,0,0,0,0|2,0,0]=4 617 B8R1.4 CC1=CC(I)=CC=C1 OR4134 [1,1,0,0,0,0|2,0,0]=4 618 B8R1.4 CC1=CC(N)=NC=C1 OR28757 [1,1,0,0,0,0|2,0,0]=4 619 B8R1.4 CC1=CC(O)=NC=N1 OR301252 [1,1,0,0,0,0|2,0,0]=4 620 B8R1.4 CC1=CC=CC(Br)=N1 OR6451 [1,1,0,0,0,0|1,0,0]=3 621 B8R1.4 CC1=CC=CC(C)=N1 OR5334 [1,1,0,0,0,0|1,0,0]=3 622 B8R1.4 CC1=CC=CC(Cl)=N1 OR8825 [1,1,0,0,0,0|1,0,0]=3 623 B8R1.4 CC1=CC=CC(N)=C1 OR5362 [1,1,0,0,0,0|2,0,0]=4 624 B8R1.4 CC1=CC=CC(O)=N1 OR524 [1,1,0,0,0,0|1,0,0]=3 625 B8R1.4 CC1=CC=CC(S)=C1 OR5559 [1,1,0,0,0,0|2,0,0]=4 626 B8R1.4 CC1=CC=C[N+]([O-])=C1 OR13628 [1,1,0,0,0,0|1,0,1]=4 627 B8R1.4 CC1=CN=CC(Br)=C1 OR3203 [1,1,0,0,0,0|1,0,0]=3 628 B8R1.4 CC1=CN=CC(Br)=N1 OR15020 [1,1,0,0,0,0|0,0,0]=2 629 B8R1.4 CC1=CN=CC(C)=C1 OR5347 [1,1,0,0,0,0|1,0,0]=3 630 B8R1.4 CC1=CN=CC(Cl)=N1 OR9783 [1,1,0,0,0,0|0,0,0]=2 631 B8R1.4 CC1=CN=CC(N)=C1 OR59324 [1,1,0,0,0,0|1,0,0]=3 632 B8R1.4 CC1=CN=CC(N)=C1 OR7004 [1,1,0,0,0,0|1,0,0]=3 633 B8R1.4 CC1=CN=CC(N)=N1 OR6126 [1,1,0,0,0,0|0,0,0]=2 634 B8R1.4 CC1=CN=CC(O)=C1 OR40438 [1,1,0,0,0,0|1,0,0]=3 635 B8R1.4 CC1=CN=CC(O)=N1 OR40069 [1,1,0,0,0,0|0,0,0]=2 636 B8R1.4 CC1=CN=NC(Cl)=C1 OR2988 [1,1,0,0,0,0|2,0,0]=4 637 B8R1.4 CC1=CN=NC(N)=C1 OR61037 [1,1,0,0,0,0|2,0,0]=4 638 B8R1.4 CC1=NC(Cl)=NC=C1 OR12067 [1,1,0,0,0,0|2,0,0]=4 639 B8R1.4 CC1=NC(N)=NC=C1 OR18316 [1,1,0,0,0,0|2,0,0]=4 640 B8R1.4 CC1=NC(O)=NC=C1 OR59839 [1,1,0,0,0,0|2,0,0]=4 641 B8R1.4 CC1=NC(S)=NC=C1 OR59840 [1,1,0,0,0,0|2,0,0]=4 642 B8R1.4 CC1=NC=CC(Br)=C1 OR9191 [1,1,0,0,0,0|1,0,0]=3 643 B8R1.4 CC1=NC=CC(Cl)=C1 OR2849 [1,1,0,0,0,0|1,0,0]=3 644 B8R1.4 CC1=NC=CC(N)=C1 OR6421 [1,1,0,0,0,0|1,0,0]=3 645 B8R1.4 ClC1=CC(Br)=NC=C1 OR15630 [1,1,0,0,0,0|2,0,0]=4 646 B8R1.4 ClC1=CC(Cl)=NC=C1 OR6843 [1,1,0,0,0,0|2,0,0]=4 647 B8R1.4 ClC1=CC=CC(Br)=N1 OR5747 [1,1,0,0,0,0|2,0,0]=4 648 B8R1.4 ClC1=CC=CC(Cl)=N1 OR1491 [1,1,0,0,0,0|2,0,0]=4 649 B8R1.4 ClC1=CN=CC(Br)=C1 OR9579 [1,1,0,0,0,0|2,0,0]=4 650 B8R1.4 ClC1=CN=CC(Cl)=C1 OR5363 [1,1,0,0,0,0|2,0,0]=4 651 B8R1.4 ClC1=CN=CC(Cl)=N1 OR11034 [1,1,0,0,0,0|1,0,0]=3 652 B8R1.4 ClC1=NC=CC(Br)=C1 OR9753 [1,1,0,0,0,0|2,0,0]=4 653 B8R1.4 ClC1=NC=CC(I)=C1 OR5643 [1,1,0,0,0,0|2,0,0]=4 654 B8R1.4 NC1=CC(Br)=CN=C1 OR9578 [1,1,0,0,0,0|2,0,0]=4 655 B8R1.4 NC1=CC(Br)=NC=C1 OR13064 [1,1,0,0,0,0|2,0,0]=4 656 B8R1.4 NC1=CC(Cl)=NC=C1 OR10317 [1,1,0,0,0,0|2,0,0]=4 657 B8R1.4 NC1=CC(O)=CC=C1 OR16952 [1,1,0,0,0,0|2,0,0]=4 658 B8R1.4 NC1=CC(O)=CN=C1 OR41178 [1,1,0,0,0,0|1,0,0]=3 659 B8R1.4 NC1=CC=CC(N)=N1 OR13639 [1,1,0,0,0,0|2,0,0]=4 660 B8R1.4 NC1=CN=CC(Cl)=C1 OR40335 [1,1,0,0,0,0|2,0,0]=4 661 B8R1.4 NC1=CN=CC(I)=C1 OR345311 [1,1,0,0,0,0|2,0,0]=4 662 B8R1.4 NC1=NC(Br)=CC=C1 OR7768 [1,1,0,0,0,0|2,0,0]=4 663 B8R1.4 NC1=NC(Cl)=CC=C1 OR5749 [1,1,0,0,0,0|2,0,0]=4 664 B8R1.4 NC1=NC(Cl)=CN=C1 OR11609 [1,1,0,0,0,0|1,0,0]=3 665 B8R1.4 NC1=NC(O)=CC=C1 OR4269 [1,1,0,0,0,0|1,0,0]=3 666 B8R1.4 NC1=NC=CC(Br)=C1 OR4774 [1,1,0,0,0,0|2,0,0]=4 667 B8R1.4 NC1=NC=CC(Cl)=C1 OR5114 [1,1,0,0,0,0|2,0,0]=4 668 B8R1.4 NC1=NC=CC(I)=C1 OR302288 [1,1,0,0,0,0|2,0,0]=4 669 B8R1.4 NC1=NC=CC(O)=C1 OR46212 [1,1,0,0,0,0|2,0,0]=4 670 B8R1.4 NC1=NC=NC(O)=C1 OR11321 [1,1,0,0,0,0|2,0,0]=4 671 B8R1.4 OC1=CC(Br)=CC=C1 OR18331 [1,1,0,0,0,0|2,0,0]=4 672 B8R1.4 OC1=CC(Cl)=CC=C1 OR8225 [1,1,0,0,0,0|2,0,0]=4 673 B8R1.4 OC1=CC(Cl)=CN=C1 OR28675 [1,1,0,0,0,0|1,0,0]=3 674 B8R1.4 OC1=CC(Cl)=NC=C1 OR60066 [1,1,0,0,0,0|2,0,0]=4 675 B8R1.4 OC1=CC(Cl)=NC=N1 OR350089 [1,1,0,0,0,0|2,0,0]=4 676 B8R1.4 OC1=CC(I)=CC=C1 OR5426 [1,1,0,0,0,0|2,0,0]=4 677 B8R1.4 OC1=CC(I)=CC=N1 OR12279 [1,1,0,0,0,0|1,0,0]=3 678 B8R1.4 OC1=CC(O)=NC=N1 OR11295 [1,1,0,0,0,0|2,0,0]=4 679 B8R1.4 OC1=CC=CC(S)=C1 OR0777 [1,1,0,0,0,0|2,0,0]=4 680 B8R1.4 OC1=CC=NC(O)=C1 OR29968 [1,1,0,0,0,0|1,0,0]=3 681 B8R1.4 OC1=CN=CC(Br)=C1 OR8631 [1,1,0,0,0,0|1,0,0]=3 682 B8R1.4 OC1=NC(S)=NC=C1 OR22723 [1,1,0,0,0,0|2,0,0]=4 683 B8R1.4 OC1=NC=CC(Br)=C1 OR40285 [1,1,0,0,0,0|1,0,0]=3 684 B8R1.5 BrC1=C(I)C=CC=N1 OR400475 [1,1,0,0,0,0|2,0,0]=4 685 B8R1.5 BrC1=CC=CN=C1Br OR4486 [1,1,0,0,0,0|2,0,0]=4 686 B8R1.5 BrC1=CC=CN=C1I OR8711 [1,1,0,0,0,0|2,0,0]=4 687 B8R1.5 BrC1=CC=NC=C1Br OR345020 [1,1,0,0,0,0|2,0,0]=4 688 B8R1.5 BrC1=CC=NC=C1I OR345446 [1,1,0,0,0,0|2,0,0]=4 689 B8R1.5 BrC1=NC=CN=C1Br OR301382 [1,1,0,0,0,0|1,0,0]=3 690 B8R1.5 CC1=C(Br)C=CC=C1 OR4737 [1,1,0,0,0,0|2,0,0]=4 691 B8R1.5 CC1=C(Br)C=CN=C1 OR1050 [1,1,0,0,0,0|1,0,0]=3 692 B8R1.5 CC1=C(Br)C=NC=C1 OR6455 [1,1,0,0,0,0|2,0,0]=4 693 B8R1.5 CC1=C(C)C=NC=C1 OR13611 [1,1,0,0,0,0|1,0,0]=3 694 B8R1.5 CC1=C(Cl)C=CC=C1 OR5337 [1,1,0,0,0,0|2,0,0]=4 695 B8R1.5 CC1=C(Cl)N=NC=C1 OR42178 [1,1,0,0,0,0|2,0,0]=4 696 B8R1.5 CC1=C(I)C=CC=C1 OR4542 [1,1,0,0,0,0|2,0,0]=4 697 B8R1.5 CC1=C(N)C=CN=C1 OR8895 [1,1,0,0,0,0|1,0,0]=3 698 B8R1.5 CC1=C(N)C=NC=C1 OR2023 [1,1,0,0,0,0|2,0,0]=4 699 B8R1.5 CC1=C(O)C=CN=C1 OR42109 [1,1,0,0,0,0|1,0,0]=3 700 B8R1.5 CC1=C(O)C=NC=C1 OR51773 [1,1,0,0,0,0|1,0,0]=3 701 B8R1.5 CC1=C(O)N=CC=C1 OR23858 [1,1,0,0,0,0|1,0,0]=3 702 B8R1.5 CC1=C(S)C=CC=C1 OR9990 [1,1,0,0,0,0|2,0,0]=4 703 B8R1.5 CC1=CC=CC=[N+]1N OR55004 [1,1,0,0,0,0|1,0,1]=4 704 B8R1.5 CC1=CC=CN=C1Br OR4270 [1,1,0,0,0,0|1,0,0]=3 705 B8R1.5 CC1=CC=CN=C1C OR13595 [1,1,0,0,0,0|1,0,0]=3 706 B8R1.5 CC1=CC=CN=C1Cl OR13603 [1,1,0,0,0,0|1,0,0]=3 707 B8R1.5 CC1=CC=CN=C1N OR5258 [1,1,0,0,0,0|1,0,0]=3 708 B8R1.5 CC1=NC=CC=C1Br OR13032 [1,1,0,0,0,0|1,0,0]=3 709 B8R1.5 CC1=NC=CC=C1N OR8878 [1,1,0,0,0,0|1,0,0]=3 710 B8R1.5 CC1=NC=CC=C1O OR13617 [1,1,0,0,0,0|1,0,0]=3 711 B8R1.5 CC1=NC=CN=C1Br OR321322 [1,1,0,0,0,0|0,0,0]=2 712 B8R1.5 CC1=NC=CN=C1C OR6020 [1,1,0,0,0,0|0,0,0]=2 713 B8R1.5 CC1=[N+]([O-])C=CC=C1 OR13626 [1,1,0,0,0,0|1,0,1]=4 714 B8R1.5 ClC1=C(Br)C=CN=C1 OR46036 [1,1,0,0,0,0|2,0,0]=4 715 B8R1.5 ClC1=C(Br)C=NC=C1 OR2306 [1,1,0,0,0,0|2,0,0]=4 716 B8R1.5 ClC1=C(Cl)C=NC=C1 OR8832 [1,1,0,0,0,0|2,0,0]=4 717 B8R1.5 ClC1=C(I)C=NC=C1 OR301298 [1,1,0,0,0,0|2,0,0]=4 718 B8R1.5 ClC1=CC=CN=C1Br OR8849 [1,1,0,0,0,0|2,0,0]=4 719 B8R1.5 ClC1=CC=CN=C1Cl OR13040 [1,1,0,0,0,0|2,0,0]=4 720 B8R1.5 ClC1=CC=CN=C1I OR30950 [1,1,0,0,0,0|2,0,0]=4 721 B8R1.5 ClC1=CN=CC=C1I OR2982 [1,1,0,0,0,0|2,0,0]=4 722 B8R1.5 ClC1=NC=CC=C1Br OR5180 [1,1,0,0,0,0|2,0,0]=4 723 B8R1.5 ClC1=NC=CC=C1I OR2342 [1,1,0,0,0,0|2,0,0]=4 724 B8R1.5 ClC1=NC=CN=C1Cl OR9580 [1,1,0,0,0,0|1,0,0]=3 725 B8R1.5 IC1=C(I)N=CC=C1 OR345418 [1,1,0,0,0,0|2,0,0]=4 726 B8R1.5 NC1=C(Br)C=CN=C1 OR302394 [1,1,0,0,0,0|2,0,0]=4 727 B8R1.5 NC1=C(Br)C=NC=C1 OR2801 [1,1,0,0,0,0|2,0,0]=4 728 B8R1.5 NC1=C(Cl)C=CN=C1 OR8424 [1,1,0,0,0,0|2,0,0]=4 729 B8R1.5 NC1=C(Cl)C=NC=C1 OR6413 [1,1,0,0,0,0|2,0,0]=4 730 B8R1.5 NC1=C(I)C=CN=C1 OR52091 [1,1,0,0,0,0|2,0,0]=4 731 B8R1.5 NC1=C(I)C=NC=C1 OR4266 [1,1,0,0,0,0|2,0,0]=4 732 B8R1.5 NC1=C(N)C=NC=C1 OR6459 [1,1,0,0,0,0|2,0,0]=4 733 B8R1.5 NC1=C(N)N=CC=C1 OR0033 [1,1,0,0,0,0|2,0,0]=4 734 B8R1.5 NC1=C(O)C=CC=C1 OR40733 [1,1,0,0,0,0|2,0,0]=4 735 B8R1.5 NC1=C(O)C=CN=C1 OR3719 [1,1,0,0,0,0|2,0,0]=4 736 B8R1.5 NC1=C(O)C=NC=C1 OR3715 [1,1,0,0,0,0|1,0,0]=3 737 B8R1.5 NC1=C(O)C=NC=C1 OR5796 [1,1,0,0,0,0|1,0,0]=3 738 B8R1.5 NC1=C(O)N=CC=C1 OR13432 [1,1,0,0,0,0|1,0,0]=3 739 B8R1.5 NC1=CC=CN=C1Br OR2264 [1,1,0,0,0,0|2,0,0]=4 740 B8R1.5 NC1=CC=CN=C1Cl OR6543 [1,1,0,0,0,0|2,0,0]=4 741 B8R1.5 NC1=CC=CN=C1O OR315027 [1,1,0,0,0,0|1,0,0]=3 742 B8R1.5 NC1=NC=CC=C1Br OR59810 [1,1,0,0,0,0|2,0,0]=4 743 B8R1.5 NC1=NC=CC=C1Cl OR30948 [1,1,0,0,0,0|2,0,0]=4 744 B8R1.5 NC1=NC=CC=C1I OR7027 [1,1,0,0,0,0|2,0,0]=4 745 B8R1.5 NC1=NC=CC=C1O OR0493 [1,1,0,0,0,0|1,0,0]=3 746 B8R1.5 NC1=NC=CN=C1Br OR315104 [1,1,0,0,0,0|1,0,0]=3 747 B8R1.5 NC1=NC=CN=C1Cl OR6127 [1,1,0,0,0,0|1,0,0]=3 748 B8R1.5 OC1=C(Br)C=CC=C1 OR5397 [1,1,0,0,0,0|2,0,0]=4 749 B8R1.5 OC1=C(Br)C=CN=C1 OR301092 [1,1,0,0,0,0|1,0,0]=3 750 B8R1.5 OC1=C(Br)C=NC=C1 OR51772 [1,1,0,0,0,0|2,0,0]=4 751 B8R1.5 OC1=C(Cl)C=CC=C1 OR52255 [1,1,0,0,0,0|2,0,0]=4 752 B8R1.5 OC1=C(Cl)C=CN=C1 OR301168 [1,1,0,0,0,0|1,0,0]=3 753 B8R1.5 OC1=C(Cl)C=NC=C1 OR51765 [1,1,0,0,0,0|2,0,0]=4 754 B8R1.5 OC1=C(I)C=CC=C1 OR4682 [1,1,0,0,0,0|2,0,0]=4 755 B8R1.5 OC1=C(I)C=NC=C1 OR41171 [1,1,0,0,0,0|2,0,0]=4 756 B8R1.5 OC1=C(O)C=NC=C1 OR59831 [1,1,0,0,0,0|1,0,0]=3 757 B8R1.5 OC1=C(S)C=CC=C1 OR5576 [1,1,0,0,0,0|2,0,0]=4 758 B8R1.5 OC1=CC=CN=C1Br OR6410 [1,1,0,0,0,0|1,0,0]=3 759 B8R1.5 OC1=CC=CN=C1Cl OR28674 [1,1,0,0,0,0|1,0,0]=3 760 B8R1.5 OC1=CC=CN=C1I OR24642 [1,1,0,0,0,0|1,0,0]=3 761 B8R1.5 OC1=CC=CN=C1O OR315025 [1,1,0,0,0,0|1,0,0]=3 762 B8R1.5 OC1=NC=CC=C1Br OR40206 [1,1,0,0,0,0|1,0,0]=3 763 B8R1.5 OC1=NC=CC=C1Cl OR13614 [1,1,0,0,0,0|1,0,0]=3 764 B8R1.5 SC1=NC=CC=C1Cl OR3681 [1,1,0,0,0,0|1,1,0]=4 765 B8R1.5 [BH3-][N+]1=C(C)C=CC=C1 OR55051 [1,1,0,0,0,0|1,0,1]=4 766 B8R1.1 CCC1=NC(Br)=CS1 OR53030 [0,1,0,0,1,0|2,0,0]=4 767 B8R1.1 CCC1=NC(C)=CN1 OR2904 [0,1,0,0,1,0|1,0,1]=4 768 B8R1.1 CCC1=NC(C)=CS1 OR6036 [0,1,0,0,1,0|2,0,0]=4 769 B8R1.1 CCN1C=C(Br)C=N1 OR59380 [0,1,0,0,1,0|2,0,0]=4 770 B8R1.1 CCN1C=C(N)C=N1 OR110643 [0,1,0,0,1,0|2,0,0]=4 771 B8R1.1 COC1=CC=C(Br)S1 OR48244 [0,1,0,0,1,0|1,0,0]=3 772 B8R1.1 COC1=NC(Br)=CS1 OR15560 [0,1,0,0,1,0|1,0,0]=3 773 B8R1.1 COC1=NC=C(Br)S1 OR15561 [0,1,0,0,1,0|1,0,0]=3 774 B8R1.1 CSC1=NC(Br)=CS1 OR15564 [0,1,0,0,1,0|1,1,0]=4 775 B8R1.1 CSC1=NC(N)=NN1 OR27257 [0,1,0,0,1,0|1,1,0]=4 776 B8R1.1 CSC1=NC=C(N)S1 OR51949 [0,1,0,0,1,0|1,1,0]=4 777 B8R1.7 CC(=O)C1=CC=CN1 OR21519 [0,1,0,0,1,0|1,0,1]=4 778 B8R1.7 CC(=O)C1=CC=CO1 OR28745 [0,1,0,0,1,0|2,0,0]=4 779 B8R1.7 CC(=O)C1=CC=CS1 OR10140 [0,1,0,0,1,0|2,0,0]=4 780 B8R1.7 CC(=O)C1=CC=NN1 OR29765 [0,1,0,0,1,0|2,0,0]=4 781 B8R1.7 CC(=O)C1=CNC=C1 OR10314 [0,1,0,0,1,0|1,0,1]=4 782 B8R1.7 CC(=O)C1=COC=C1 OR16082 [0,1,0,0,1,0|2,0,0]=4 783 B8R1.7 CC(=O)C1=CSC=C1 OR5739 [0,1,0,0,1,0|2,0,0]=4 784 B8R1.7 CC(=O)C1=NC=CN1 OR313011 [0,1,0,0,1,0|1,0,1]=4 785 B8R1.7 CC(=O)C1=NC=CS1 OR4953 [0,1,0,0,1,0|2,0,0]=4 786 B8R1.7 CC(C)=C1C=CC=C1 OR52345 [0,1,0,0,1,0|2,0,0]=4 787 B8R1.7 CC(N)C1=CC=CO1 OR01656 [0,1,0,0,1,0|2,0,0]=4 788 B8R1.7 CC(N)C1=CC=CS1 OR01764 [0,1,0,0,1,0|2,0,0]=4 789 B8R1.8 CCCC1=CC=CO1 OR3221 [0,1,0,0,1,0|2,0,0]=4 790 B8R1.8 CCCC1=NC=CS1 OR8147 [0,1,0,0,1,0|2,0,0]=4 791 B8R1.8 CNCC1=CN=CO1 OR59855 [0,1,0,0,1,0|2,0,0]=4 792 B8R1.8 CNCC1=COC=N1 OR59851 [0,1,0,0,1,0|2,0,0]=4 793 B8R1.8 NCCC1=CC=CS1 OR10144 [0,1,0,0,1,0|2,0,0]=4 794 B8R1.8 NCCC1=CNC=N1 OR28842 [0,1,0,0,1,0|1,0,1]=4 795 B8R1.8 NCCC1=CSC=C1 OR40114 [0,1,0,0,1,0|2,0,0]=4 796 B8R1.8 NCCC1=NC=CN1 OR305182 [0,1,0,0,1,0|1,0,1]=4 797 B8R1.8 NCCN1C=CN=C1 OR12977 [0,1,0,0,1,0|2,0,0]=4 798 B8R1.8 NCCN1C=CN=C1 OR1390 [0,1,0,0,1,0|2,0,0]=4 799 B8R1.8 NCCN1C=NC=N1 OR16420 [0,1,0,0,1,0|2,0,0]=4 800 B8R1.8 NCCN1C=NC=N1 OR7106 [0,1,0,0,1,0|2,0,0]=4 801 B8R1.8 OCCC1=CC=CS1 OR6571 [0,1,0,0,1,0|2,0,0]=4 802 B8R1.8 OCCC1=CNN=C1 OR46067 [0,1,0,0,1,0|2,0,0]=4 803 B8R1.8 OCCC1=CSC=C1 OR13899 [0,1,0,0,1,0|2,0,0]=4 804 B8R1.8 OCCN1C=CC=N1 OR11946 [0,1,0,0,1,0|2,0,0]=4 805 B8R1.11 CCC1=CNN=C1N OR60148 [0,1,0,0,1,0|2,0,0]=4 806 B8R1.11 CCN1N=CC=C1N OR61338 [0,1,0,0,1,0|2,0,0]=4 807 B8R1.11 COC1=C(N)C=CS1 OR200023 [0,1,0,0,1,0|1,0,0]=3 808 B10R1.1 CCOC1=CC=C(Br)C=C1 OR13193 [0,2,0,0,0,0|2,0,0]=4 809 B10R1.1 CCOC1=CC=C(I)C=C1 OR2134 [0,2,0,0,0,0|2,0,0]=4 810 B10R1.1 CCOC1=CC=C(N)C=C1 OR6686 [0,2,0,0,0,0|2,0,0]=4 811 B10R1.1 CCOC1=CN=C(Br)C=C1 OR3575 [0,2,0,0,0,0|1,0,0]=3 812 B10R1.1 CCOC1=CN=C(N)C=N1 OR40077 [0,2,0,0,0,0|0,0,0]=2 813 B10R1.1 CCOC1=NC=C(Br)C=C1 OR13065 [0,2,0,0,0,0|1,0,0]=3 814 B10R1.1 CCOC1=NC=C(Br)C=N1 OR15514 [0,2,0,0,0,0|2,0,0]=4 815 B10R1.1 CNCC1=NC=C(Br)C=C1 OR6090 [0,2,0,0,0,0|2,0,0]=4 816 B10R1.3 C#CC1=CC=C(OC)C=C1 OR21951 [0,2,0,0,0,0|2,0,0]=4 817 B10R1.3 C#CC1=NC=C(OC)N=C1 OR53017 [0,2,0,0,0,0|0,0,0]=2 818 B10R1.3 C=CC1=CC=C(OC)C=C1 OR42010 [0,2,0,0,0,0|2,0,0]=4 819 B10R1.3 C=CC1=CC=C(OC)C=N1 OR18868 [0,2,0,0,0,0|1,0,0]=3 820 B10R1.3 C=CC1=CC=C(OC)N=C1 OR18869 [0,2,0,0,0,0|1,0,0]=3 821 B10R1.3 CNC1=CC=C(C#N)C=N1 OR12120 [0,2,0,0,0,0|2,0,0]=4 822 B10R1.3 CNC1=NC=C(C=O)C=C1 OR303656 [0,2,0,0,0,0|2,0,0]=4 823 B10R1.3 COC1=CC=C(C#N)C=C1 OR23419 [0,2,0,0,0,0|2,0,0]=4 824 B10R1.3 COC1=CC=C(C#N)C=N1 OR2738 [0,2,0,0,0,0|1,0,0]=3 825 B10R1.3 COC1=CC=C(C=O)C=C1 OR52390 [0,2,0,0,0,0|2,0,0]=4 826 B10R1.3 COC1=CC=C(CBr)C=C1 OR16607 [0,2,0,0,0,0|2,0,0]=4 827 B10R1.3 COC1=CC=C(CCl)C=C1 OR25768 [0,2,0,0,0,0|2,0,0]=4 828 B10R1.3 COC1=CC=C(CN)C=C1 OR5028 [0,2,0,0,0,0|2,0,0]=4 829 B10R1.3 COC1=CC=C(CO)C=C1 OR18325 [0,2,0,0,0,0|2,0,0]=4 830 B10R1.3 COC1=CC=C(NN)C=C1 OR2845 [0,2,0,0,0,0|2,0,0]=4 831 B10R1.3 COC1=CC=C(OC)C=C1 OR4908 [0,2,0,0,0,0|2,0,0]=4 832 B10R1.3 COC1=CN=C(C#N)C=C1 OR8848 [0,2,0,0,0,0|1,0,0]=3 833 B10R1.3 COC1=CN=C(C=O)C=C1 OR313046 [0,2,0,0,0,0|1,0,0]=3 834 B10R1.3 COC1=CN=C(C=O)N=C1 OR54436 [0,2,0,0,0,0|2,0,0]=4 835 B10R1.3 COC1=CN=C(CN)C=C1 OR306425 [0,2,0,0,0,0|1,0,0]=3 836 B10R1.3 COC1=CN=C(NN)C=N1 OR60234 [0,2,0,0,0,0|0,0,0]=2 837 B10R1.3 COC1=NC=C(C=O)C=C1 OR3477 [0,2,0,0,0,0|1,0,0]=3 838 B10R1.3 COC1=NC=C(C=O)C=N1 OR2778 [0,2,0,0,0,0|2,0,0]=4 839 B10R1.3 COC1=NC=C(CN)C=C1 OR52039 [0,2,0,0,0,0|1,0,0]=3 840 B10R1.13 CC(=O)C1=CC=C(C)N=C1 OR345083 [0,2,0,0,0,0|2,0,0]=4 841 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 OR25927 [0,2,0,0,0,0|2,0,0]=4 842 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 OR14930 [0,2,0,0,0,0|2,0,0]=4 843 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 OR51752 [0,2,0,0,0,0|2,0,0]=4 844 B10R1.13 CC1=NC=C(C(=O)O)N=C1 OR28728 [0,2,0,0,0,0|2,0,0]=4 845 B10R1.13 CC1=NC=C(C(N)=O)N=C1 OR40050 [0,2,0,0,0,0|2,0,0]=4 846 B10R1.13 CN(C)C1=CN=C(Cl)C=N1 OR42255 [0,2,0,0,0,0|1,0,0]=3 847 B10R1.13 CN(C)C1=NC=C(Br)C=C1 OR7730 [0,2,0,0,0,0|2,0,0]=4 848 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 OR59462 [0,2,0,0,0,0|2,0,0]=4 849 B10R1.13 O=C(O)C1=CN=C(O)C=N1 OR40051 [0,2,0,0,0,0|2,0,0]=4 850 B10R1.13 OB(O)C1=CN=C(Cl)C=N1 OR40070 [0,2,0,0,0,0|2,0,0]=4 851 B10R1.25 C#CC1=NC=C(C)N=C1C OR53021 [0,2,0,0,0,0|1,0,1]=4 852 B10R1.25 CNC1=NC=C(N)C=C1Cl OR62059 [0,2,0,0,0,0|2,0,0]=4 853 B10R1.25 COC1=C(Br)C=C(Br)C=C1 OR4511 [0,2,0,0,0,0|2,0,0]=4 854 B10R1.25 COC1=C(Br)C=C(C)C=C1 OR3050 [0,2,0,0,0,0|2,0,0]=4 855 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 OR1469 [0,2,0,0,0,0|2,0,0]=4 856 B10R1.25 COC1=C(Br)C=C(I)C=C1 OR45120 [0,2,0,0,0,0|2,0,0]=4 857 B10R1.25 COC1=C(Br)C=C(N)C=C1 OR45122 [0,2,0,0,0,0|2,0,0]=4 858 B10R1.25 COC1=C(Br)C=C(O)C=C1 OR399010 [0,2,0,0,0,0|2,0,0]=4 859 B10R1.25 COC1=C(C)C=C(Br)C=C1 OR1076 [0,2,0,0,0,0|2,0,0]=4 860 B10R1.25 COC1=C(C)C=C(Cl)C=C1 OR1079 [0,2,0,0,0,0|2,0,0]=4 861 B10R1.25 COC1=C(Cl)C=C(N)C=C1 OR26465 [0,2,0,0,0,0|2,0,0]=4 862 B10R1.25 COC1=C(I)C=C(N)C=C1 OR5428 [0,2,0,0,0,0|2,0,0]=4 863 B10R1.25 COC1=C(N)C=C(Br)C=C1 OR41052 [0,2,0,0,0,0|2,0,0]=4 864 B10R1.25 COC1=C(N)C=C(I)C=C1 OR51812 [0,2,0,0,0,0|2,0,0]=4 865 B10R1.25 COC1=C(N)C=C(N)C=C1 OR54554 [0,2,0,0,0,0|2,0,0]=4 866 B10R1.25 COC1=C(O)C=C(Br)C=C1 OR8907 [0,2,0,0,0,0|2,0,0]=4 867 B10R1.25 COC1=C(O)C=C(Cl)C=C1 OR60133 [0,2,0,0,0,0|2,0,0]=4 868 B10R1.25 COC1=CC=C(Br)C=C1I OR45119 [0,2,0,0,0,0|2,0,0]=4 869 B10R1.25 COC1=CC=C(Cl)C=C1N OR21760 [0,2,0,0,0,0|2,0,0]=4 870 B10R1.25 COC1=CC=C(I)N=C1Br OR61061 [0,2,0,0,0,0|1,0,0]=3 871 B10R1.25 COC1=CC=C(I)N=C1Cl OR303607 [0,2,0,0,0,0|1,0,0]=3 872 B10R1.25 COC1=CC=C(O)C=C1O OR305005 [0,2,0,0,0,0|2,0,0]=4 873 B10R1.25 COC1=CN=C(Br)C=C1O OR51781 [0,2,0,0,0,0|1,0,0]=3 874 B10R1.25 COC1=CN=C(Cl)N=C1Cl OR5184 [0,2,0,0,0,0|2,0,0]=4 875 B10R1.25 COC1=NC=C(Br)C=C1Br OR3713 [0,2,0,0,0,0|1,0,0]=3 876 B10R1.25 COC1=NC=C(Br)C=C1N OR42139 [0,2,0,0,0,0|1,0,0]=3 877 B10R1.25 COC1=NC=C(Br)C=C1O OR51784 [0,2,0,0,0,0|1,0,0]=3 878 B10R1.25 COC1=NC=C(Cl)C=C1Br OR3242 [0,2,0,0,0,0|1,0,0]=3 879 B10R1.25 COC1=NC=C(N)C=C1Br OR8426 [0,2,0,0,0,0|1,0,0]=3 880 B10R1.25 N#CC1=NC=C(Cl)N=C1Cl OR45109 [0,2,0,0,0,0|2,0,0]=4 881 B10R1.25 N#CC1=NC=C(Cl)N=C1N OR40081 [0,2,0,0,0,0|2,0,0]=4 882 B10R1.25 NNC1=NC=C(Br)N=C1Cl OR60219 [0,2,0,0,0,0|2,0,0]=4 883 B10R1.25 NNC1=NC=C(Cl)N=C1Br OR60230 [0,2,0,0,0,0|2,0,0]=4 884 B10R1.25 O=CC1=NC=C(Cl)N=C1Cl OR20012 [0,2,0,0,0,0|2,0,0]=4 885 B10R1.176 COC1=CC(Br)=C(Cl)C=C1 OR8887 [0,2,0,0,0,0|2,0,0]=4 886 B10R1.176 COC1=CC(Br)=C(I)C=C1 OR61448 [0,2,0,0,0,0|2,0,0]=4 887 B10R1.176 COC1=CC(Br)=C(N)C=C1 OR61502 [0,2,0,0,0,0|2,0,0]=4 888 B10R1.176 COC1=CC(Br)=C(O)C=C1 OR14191 [0,2,0,0,0,0|2,0,0]=4 889 B10R1.176 COC1=CC(C)=C(Br)C=C1 OR4933 [0,2,0,0,0,0|2,0,0]=4 890 B10R1.176 COC1=CC(C)=C(C)C=C1 OR2170 [0,2,0,0,0,0|2,0,0]=4 891 B10R1.176 COC1=CC(C)=C(N)C=C1 OR12498 [0,2,0,0,0,0|2,0,0]=4 892 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 OR5424 [0,2,0,0,0,0|2,0,0]=4 893 B10R1.176 COC1=CC(Cl)=C(O)C=C1 OR0024 [0,2,0,0,0,0|2,0,0]=4 894 B10R1.176 COC1=CC(I)=C(Br)C=C1 OR40681 [0,2,0,0,0,0|2,0,0]=4 895 B10R1.176 COC1=CC(I)=C(Cl)C=C1 OR46039 [0,2,0,0,0,0|2,0,0]=4 896 B10R1.176 COC1=CC(N)=C(Br)C=C1 OR59916 [0,2,0,0,0,0|2,0,0]=4 897 B10R1.176 COC1=CC(N)=C(Cl)C=C1 OR4502 [0,2,0,0,0,0|2,0,0]=4 898 B10R1.176 COC1=CC(N)=C(Cl)C=C1 OR4503 [0,2,0,0,0,0|2,0,0]=4 899 B10R1.176 COC1=CC(N)=C(N)C=C1 OR21113 [0,2,0,0,0,0|2,0,0]=4 900 B10R1.176 COC1=CC(N)=C(S)C=C1 OR70225 [0,2,0,0,0,0|2,0,0]=4 901 B10R1.176 COC1=CC(O)=C(Br)C=C1 OR399007 [0,2,0,0,0,0|2,0,0]=4 902 B10R1.176 COC1=CC(O)=C(Cl)C=C1 OR3294 [0,2,0,0,0,0|2,0,0]=4 903 B10R1.176 COC1=CC(O)=C(N)C=C1 OR110697 [0,2,0,0,0,0|2,0,0]=4 904 B10R1.176 COC1=CC=C(I)C(Cl)=C1 OR55156 [0,2,0,0,0,0|2,0,0]=4 905 B10R1.176 COC1=CC=C(O)C(N)=C1 OR01962 [0,2,0,0,0,0|2,0,0]=4 906 B10R1.176 COC1=CC=C(O)C(O)=C1 OR305004 [0,2,0,0,0,0|2,0,0]=4 907 B10R1.176 COC1=NC(Br)=C(N)C=C1 OR315074 [0,2,0,0,0,0|1,0,0]=3 908 B10R1.176 COC1=NC(C)=C(Br)C=C1 OR01795 [0,2,0,0,0,0|1,0,0]=3 909 B10R1.176 COC1=NC(Cl)=C(Cl)C=C1 OR345420 [0,2,0,0,0,0|1,0,0]=3 910 B10R1.176 COC1=NC=C(Br)C(Cl)=C1 OR301297 [0,2,0,0,0,0|1,0,0]=3 911 B10R1.176 COC1=NC=C(Cl)C(C)=C1 OR01796 [0,2,0,0,0,0|1,0,0]=3 912 B10R1.176 COC1=NC=C(N)C(C)=C1 OR01794 [0,2,0,0,0,0|1,0,0]=3 913 B10R1.2 COC1=C(Br)C(Br)=CC=C1 OR2660 [0,2,0,0,0,0|2,0,0]=4 914 B10R1.2 COC1=C(Br)C(C)=CC=N1 OR315079 [0,2,0,0,0,0|1,0,0]=3 915 B10R1.2 COC1=C(C)C(Br)=CN=C1 OR302226 [0,2,0,0,0,0|1,0,0]=3 916 B10R1.2 COC1=C(Cl)C(=O)NN=C1 OR40504 [0,2,0,0,0,0|2,0,0]=4 917 B10R1.2 COC1=C(I)C(Br)=CC=C1 OR45121 [0,2,0,0,0,0|2,0,0]=4 918 B10R1.2 COC1=C(I)C(N)=CC=N1 OR303714 [0,2,0,0,0,0|1,0,0]=3 919 B10R1.2 COC1=C(N)C(Cl)=NC=N1 OR18113 [0,2,0,0,0,0|2,0,0]=4 920 B10R1.2 COC1=C(N)C(N)=CC=C1 OR400685 [0,2,0,0,0,0|2,0,0]=4 921 B10R1.2 COC1=C(O)C(O)=CC=C1 OR52178 [0,2,0,0,0,0|2,0,0]=4 922 B10R1.2 COC1=CC=CC(Br)=C1C OR301007 [0,2,0,0,0,0|2,0,0]=4 923 B10R1.2 COC1=CC=CC(Br)=C1N OR3368 [0,2,0,0,0,0|2,0,0]=4 924 B10R1.2 COC1=CC=CC(Br)=C1O OR399008 [0,2,0,0,0,0|2,0,0]=4 925 B10R1.2 COC1=CC=CC(C)=C1O OR21227 [0,2,0,0,0,0|2,0,0]=4 926 B10R1.2 COC1=CC=CC(Cl)=C1Br OR400506 [0,2,0,0,0,0|2,0,0]=4 927 B10R1.2 COC1=CC=CC(I)=C1Br OR70126 [0,2,0,0,0,0|2,0,0]=4 928 B10R1.2 COC1=CC=CC(I)=C1N OR43627 [0,2,0,0,0,0|2,0,0]=4 929 B10R1.2 COC1=CC=CC(N)=C1Br OR70043 [0,2,0,0,0,0|2,0,0]=4 930 B10R1.2 COC1=CC=CC(N)=C1Cl OR70133 [0,2,0,0,0,0|2,0,0]=4 931 B10R1.2 COC1=CC=CC(O)=C1Br OR399006 [0,2,0,0,0,0|2,0,0]=4 932 B10R1.2 COC1=CC=CC(O)=C1C OR323058 [0,2,0,0,0,0|2,0,0]=4 933 B10R1.8 COC1=CC(Br)=CC(Br)=C1 OR42208 [0,2,0,0,0,0|2,0,0]=4 934 B10R1.8 COC1=CC(Br)=CC(I)=C1 OR46092 [0,2,0,0,0,0|2,0,0]=4 935 B10R1.8 COC1=CC(Br)=CC(N)=C1 OR40401 [0,2,0,0,0,0|2,0,0]=4 936 B10R1.8 COC1=CC(C)=CC(C)=C1 OR9605 [0,2,0,0,0,0|2,0,0]=4 937 B10R1.8 COC1=CC(Cl)=CC(Cl)=C1 OR47824 [0,2,0,0,0,0|2,0,0]=4 938 B10R1.8 COC1=CC(Cl)=CC(I)=C1 OR46237 [0,2,0,0,0,0|2,0,0]=4 939 B10R1.8 COC1=CC(Cl)=CC(N)=C1 OR313073 [0,2,0,0,0,0|2,0,0]=4 940 B10R1.8 COC1=CC(Cl)=NC(Cl)=N1 OR301155 [0,2,0,0,0,0|2,0,0]=4 941 B10R1.8 COC1=CC(Cl)=NC(N)=N1 OR10959 [0,2,0,0,0,0|2,0,0]=4 942 B10R1.8 COC1=NC(Cl)=CC(Cl)=N1 OR18261 [0,2,0,0,0,0|2,0,0]=4 943 B10R1.8 COC1=NC(N)=NC(C)=C1 OR4277 [0,2,0,0,0,0|2,0,0]=4 944 B10R1.8 COC1=NC(N)=NC(I)=C1 OR15512 [0,2,0,0,0,0|2,0,0]=4 945 B10R1.10 CCNC1=NC(Cl)=CN=C1 OR59339 [0,2,0,0,0,0|1,0,0]=3 946 B10R1.10 CCOC1=CN=CC(N)=C1 OR13672 [0,2,0,0,0,0|1,0,0]=3 947 B10R1.10 CCOC1=NC(Br)=CC=C1 OR59382 [0,2,0,0,0,0|1,0,0]=3 948 B10R1.10 CCOC1=NC=CC(N)=C1 OR46228 [0,2,0,0,0,0|1,0,0]=3 949 B10R1.10 CNCC1=CC(Br)=CN=C1 OR12380 [0,2,0,0,0,0|2,0,0]=4 950 B10R1.30 CCC1=NC(C)=CC=C1O OR2008 [0,2,0,0,0,0|2,0,0]=4 951 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 OR13198 [0,2,0,0,0,0|2,0,0]=4 952 B10R1.30 COC1=C(Br)C=CC(I)=C1 OR9601 [0,2,0,0,0,0|2,0,0]=4 953 B10R1.30 COC1=C(Br)C=CC(N)=C1 OR15001 [0,2,0,0,0,0|2,0,0]=4 954 B10R1.30 COC1=C(Br)C=CC(O)=C1 OR30937 [0,2,0,0,0,0|2,0,0]=4 955 B10R1.30 COC1=C(C)C=CC(Cl)=C1 OR15003 [0,2,0,0,0,0|2,0,0]=4 956 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 OR0177 [0,2,0,0,0,0|2,0,0]=4 957 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 OR15004 [0,2,0,0,0,0|2,0,0]=4 958 B10R1.30 COC1=C(Cl)C=CC(O)=C1 OR400038 [0,2,0,0,0,0|2,0,0]=4 959 B10R1.30 COC1=C(I)C=CC(Br)=C1 OR46223 [0,2,0,0,0,0|2,0,0]=4 960 B10R1.30 COC1=C(I)C=CC(Cl)=C1 OR70062 [0,2,0,0,0,0|2,0,0]=4 961 B10R1.30 COC1=C(I)C=CC(O)=C1 OR18428 [0,2,0,0,0,0|2,0,0]=4 962 B10R1.30 COC1=C(N)C=CC(Br)=C1 OR30932 [0,2,0,0,0,0|2,0,0]=4 963 B10R1.30 COC1=C(N)C=CC(C)=C1 OR11969 [0,2,0,0,0,0|2,0,0]=4 964 B10R1.30 COC1=C(N)C=CC(Cl)=C1 OR11504 [0,2,0,0,0,0|2,0,0]=4 965 B10R1.30 COC1=C(N)C=CC(I)=C1 OR43624 [0,2,0,0,0,0|2,0,0]=4 966 B10R1.30 COC1=C(O)C=CC(Cl)=C1 OR4506 [0,2,0,0,0,0|2,0,0]=4 967 B10R1.30 COC1=C(O)C=CC(I)=C1 OR46089 [0,2,0,0,0,0|2,0,0]=4 968 B10R1.30 COC1=C(O)C=CC(O)=C1 OR8900 [0,2,0,0,0,0|2,0,0]=4 969 B10R1.30 COC1=CC(Br)=CC=C1O OR22659 [0,2,0,0,0,0|2,0,0]=4 970 B10R1.30 COC1=CC(Br)=CN=C1Cl OR60155 [0,2,0,0,0,0|1,0,0]=3 971 B10R1.30 COC1=CC(N)=CC=C1Cl OR11087 [0,2,0,0,0,0|2,0,0]=4 972 B10R1.30 COC1=NC(Br)=CC=C1N OR18103 [0,2,0,0,0,0|1,0,0]=3 973 B10R1.30 COC1=NC(Br)=CN=C1N OR61108 [0,2,0,0,0,0|0,0,0]=2 974 B10R1.30 COC1=NC(Cl)=CC=C1Br OR51871 [0,2,0,0,0,0|1,0,0]=3 975 B10R1.30 COC1=NC(Cl)=NC=C1Br OR3706 [0,2,0,0,0,0|2,0,0]=4 976 B10R1.30 N#CC1=NC(Br)=CN=C1Cl OR19577 [0,2,0,0,0,0|2,0,0]=4 977 B10R1.30 N#CC1=NC(Br)=CN=C1N OR19576 [0,2,0,0,0,0|2,0,0]=4 978 B10R1.30 N#CC1=NC(Cl)=CN=C1Cl OR321323 [0,2,0,0,0,0|2,0,0]=4 979 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 OR12051 [0,2,0,0,0,0|2,0,0]=4 980 B10R1.113 CC(=O)C1=CC=CC(C)=N1 OR13601 [0,2,0,0,0,0|2,0,0]=4 981 B10R1.113 CC1=CN=CC(C(=O)O)=N1 OR40068 [0,2,0,0,0,0|2,0,0]=4 982 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 OR40053 [0,2,0,0,0,0|2,0,0]=4 983 B10R1.172 C#CC1=CC(OC)=CC=C1 OR5956 [0,2,0,0,0,0|2,0,0]=4 984 B10R1.172 CCC1=NC=CC(CBr)=C1 OR40234 [0,2,0,0,0,0|2,0,0]=4 985 B10R1.172 COC1=CC(C=O)=CN=C1 OR46113 [0,2,0,0,0,0|1,0,0]=3 986 B10R1.172 COC1=CC(CS)=CC=C1 OR51960 [0,2,0,0,0,0|2,0,0]=4 987 B10R1.172 COC1=CC=CC(C#N)=C1 OR4831 [0,2,0,0,0,0|2,0,0]=4 988 B10R1.172 COC1=CC=CC(C=O)=C1 OR0816 [0,2,0,0,0,0|2,0,0]=4 989 B10R1.172 COC1=CC=CC(CBr)=C1 OR6438 [0,2,0,0,0,0|2,0,0]=4 990 B10R1.172 COC1=CC=CC(CCl)=C1 OR4813 [0,2,0,0,0,0|2,0,0]=4 991 B10R1.172 COC1=CC=CC(CN)=C1 OR8643 [0,2,0,0,0,0|2,0,0]=4 992 B10R1.172 COC1=CC=CC(CO)=C1 OR10022 [0,2,0,0,0,0|2,0,0]=4 993 B10R1.172 COC1=CC=CC(NN)=N1 OR60228 [0,2,0,0,0,0|1,0,0]=3 994 B10R1.172 COC1=CC=CC(OC)=C1 OR1557 [0,2,0,0,0,0|2,0,0]=4 995 B10R1.172 COC1=CC=CC(OC)=N1 OR0937 [0,2,0,0,0,0|1,0,0]=3 996 B10R1.172 COC1=CN=CC(OC)=N1 OR51827 [0,2,0,0,0,0|0,0,0]=2 997 B10R1.172 COC1=NC(C=O)=CC=C1 OR51762 [0,2,0,0,0,0|1,0,0]=3 998 B10R1.172 COC1=NC(NN)=CN=C1 OR60225 [0,2,0,0,0,0|0,0,0]=2 999 B10R1.172 COC1=NC=CC(C#N)=C1 OR5540 [0,2,0,0,0,0|1,0,0]=3 1000 B10R1.172 COC1=NC=CC(C=O)=C1 OR46110 [0,2,0,0,0,0|1,0,0]=3 1001 B10R1.15 COC(=O)C1=CC=CC=C1 OR60124 [0,2,0,0,0,0|2,0,0]=4 1002 B10R1.15 COC(=O)C1=NC=CC=C1 OR22699 [0,2,0,0,0,0|1,0,0]=3 1003 B10R1.15 COC(=O)C1=NC=CC=N1 OR59919 [0,2,0,0,0,0|2,0,0]=4 1004 B10R1.15 COC(=O)C1=NC=CN=C1 OR6399 [0,2,0,0,0,0|0,0,0]=2 1005 B10R1.15 COC(=O)C1=NC=NC=C1 OR200069 [0,2,0,0,0,0|2,0,0]=4 1006 B10R1.15 C\C(=N/O)C1=NC=CC=C1 OR25030 [0,2,0,0,0,0|2,0,0]=4 1007 B10R1.15 NCC(O)C1=CN=CC=C1 OR12818 [0,2,0,0,0,0|2,0,0]=4 1008 B10R1.15 NCC(O)C1=NC=CC=C1 OR12817 [0,2,0,0,0,0|2,0,0]=4 1009 B10R1.15 NCC(O)C1=NC=CC=C1 OR60079 [0,2,0,0,0,0|2,0,0]=4 1010 B10R1.15 N\C(=N/O)C1=NC=CN=C1 OR3401 [0,2,0,0,0,0|2,0,0]=4 1011 B10R1.15 O=C(CBr)C1=CC=CN=C1 OR10712 [0,2,0,0,0,0|2,0,0]=4 1012 B10R1.15 O=C(CBr)C1=NC=CC=C1 OR1299 [0,2,0,0,0,0|2,0,0]=4 1013 B10R1.28 CC(C)(N)C1=CC=CC=N1 OR470173 [0,2,0,0,0,0|2,0,0]=4 1014 B10R1.28 CC(C)(O)C1=CC=CN=C1 OR42205 [0,2,0,0,0,0|2,0,0]=4 1015 B10R1.28 CC(C)(O)C1=NC=CC=C1 OR25562 [0,2,0,0,0,0|2,0,0]=4 1016 B10R1.61 CC(=O)C1=C(O)N=CC=C1 OR345384 [0,2,0,0,0,0|2,0,0]=4 1017 B10R1.61 CC(=O)C1=CC=CN=C1Br OR18830 [0,2,0,0,0,0|2,0,0]=4 1018 B10R1.61 CC(=O)C1=CC=CN=C1Cl OR61610 [0,2,0,0,0,0|2,0,0]=4 1019 B10R1.61 CC(=O)C1=CC=CN=C1N OR15249 [0,2,0,0,0,0|2,0,0]=4 1020 B10R1.61 CC(=O)C1=CN=CC=C1N OR53152 [0,2,0,0,0,0|2,0,0]=4 1021 B10R1.61 CC(=O)C1=NC=CC=C1C OR40729 [0,2,0,0,0,0|2,0,0]=4 1022 B10R1.61 CC(=O)C1=NC=CC=C1Cl OR302156 [0,2,0,0,0,0|2,0,0]=4 1023 B10R1.61 CC1=NC=CN=C1C(=O)O OR59825 [0,2,0,0,0,0|2,0,0]=4 1024 B10R1.61 NC1=NC=CN=C1C(=O)O OR18277 [0,2,0,0,0,0|2,0,0]=4 1025 B10R1.61 O=C(O)C1=NC=CN=C1Cl OR322467 [0,2,0,0,0,0|2,0,0]=4 1026 B10R1.61 O=C(O)C1=NC=CN=C1I OR16959 [0,2,0,0,0,0|2,0,0]=4 1027 B10R1.61 O=C(O)C1=NC=CN=C1O OR40047 [0,2,0,0,0,0|2,0,0]=4 1028 B10R1.4 CCOC1=C(Br)C=CC=C1 OR9597 [0,2,0,0,0,0|2,0,0]=4 1029 B10R1.4 CCOC1=C(N)C=CC=C1 OR6652 [0,2,0,0,0,0|2,0,0]=4 1030 B10R1.4 CCOC1=C(O)C=CC=N1 OR51768 [0,2,0,0,0,0|1,0,0]=3 1031 B10R1.4 CCOC1=CC=CN=C1N OR14829 [0,2,0,0,0,0|1,0,0]=3 1032 B10R1.4 CNCC1=C(Cl)N=CC=C1 OR303625 [0,2,0,0,0,0|2,0,0]=4 1033 B10R1.4 CNCC1=C(Cl)N=CC=C1 OR45143 [0,2,0,0,0,0|2,0,0]=4 1034 B10R1.4 COCC1=C(Br)C=CC=C1 OR11434 [0,2,0,0,0,0|2,0,0]=4 1035 B10R1.17 BrCCOC1=CC=CC=C1 OR0698 [0,2,0,0,0,0|2,0,0]=4 1036 B10R1.17 C#CCOC1=CC=CC=C1 OR25609 [0,2,0,0,0,0|2,0,0]=4 1037 B10R1.17 CNCCC1=NC=CC=C1 OR22222 [0,2,0,0,0,0|2,0,0]=4 1038 B10R1.17 N#CCOC1=CC=CC=C1 OR27351 [0,2,0,0,0,0|2,0,0]=4 1039 B10R1.17 NCCOC1=CC=CC=C1 OR27353 [0,2,0,0,0,0|2,0,0]=4 1040 B10R1.17 OCCOC1=CC=CC=C1 OR4481 [0,2,0,0,0,0|2,0,0]=4 1041 B10R1.18 CC(=O)CC1=NC=CC=C1 OR302235 [0,2,0,0,0,0|2,0,0]=4 1042 B10R1.18 CC(=O)NC1=CC=CN=C1 OR21124 [0,2,0,0,0,0|2,0,0]=4 1043 B10R1.18 CC(=O)OC1=CC=CC=C1 OR5316 [0,2,0,0,0,0|2,0,0]=4 1044 B10R1.18 CC(N)CC1=NC=CC=C1 OR40277 [0,2,0,0,0,0|2,0,0]=4 1045 B10R1.18 O=C(O)CC1=NC=CN=C1 OR313069 [0,2,0,0,0,0|1,0,1]=4 1046 B10R1.20 C#CC1=CC=CN=C1OC OR52205 [0,2,0,0,0,0|1,0,0]=3 1047 B10R1.20 C#CC1=NC=CN=C1OC OR53016 [0,2,0,0,0,0|0,0,0]=2 1048 B10R1.20 C=CC1=CC=CC=C1OC OR30975 [0,2,0,0,0,0|2,0,0]=4 1049 B10R1.20 CNC1=C(C#N)C=CC=N1 OR12119 [0,2,0,0,0,0|2,0,0]=4 1050 B10R1.20 CNC1=NC=CC=C1CO OR42175 [0,2,0,0,0,0|2,0,0]=4 1051 B10R1.20 COC1=C(CBr)C=CC=C1 OR350580 [0,2,0,0,0,0|2,0,0]=4 1052 B10R1.20 COC1=C(CN)C=CC=C1 OR5027 [0,2,0,0,0,0|2,0,0]=4 1053 B10R1.20 COC1=C(CO)C=CC=C1 OR2641 [0,2,0,0,0,0|2,0,0]=4 1054 B10R1.20 COC1=C(SC)C=CC=C1 OR9712 [0,2,0,0,0,0|2,0,0]=4 1055 B10R1.20 COC1=CC=CC=C1C#N OR11202 [0,2,0,0,0,0|2,0,0]=4 1056 B10R1.20 COC1=CC=CC=C1CS OR51959 [0,2,0,0,0,0|2,0,0]=4 1057 B10R1.20 COC1=CC=CC=C1NN OR30516 [0,2,0,0,0,0|2,0,0]=4 1058 B10R1.20 COC1=CC=CN=C1CN OR306470 [0,2,0,0,0,0|1,0,0]=3 1059 B10R1.20 COC1=CC=CN=C1NN OR60217 [0,2,0,0,0,0|1,0,0]=3 1060 B10R1.20 COC1=CC=CN=C1OC OR6412 [0,2,0,0,0,0|1,0,0]=3 1061 B10R1.20 COC1=NC=CC=C1C#N OR5771 [0,2,0,0,0,0|1,0,0]=3 1062 B10R1.20 SCC1=NC=CN=C1CS OR20050 [0,2,0,0,0,0|2,0,0]=4 1063 B10R1.245 COC1=C(Br)C=CC=C1C OR40672 [0,2,0,0,0,0|2,0,0]=4 1064 B10R1.245 COC1=C(Br)C=CC=C1I OR45123 [0,2,0,0,0,0|2,0,0]=4 1065 B10R1.245 COC1=C(Cl)C=CC=C1Br OR400467 [0,2,0,0,0,0|2,0,0]=4 1066 B10R1.245 COC1=C(Cl)N=CN=C1Cl OR15925 [0,2,0,0,0,0|2,0,0]=4 1067 B10R1.245 COC1=C(N)C=CC=C1Br OR17601 [0,2,0,0,0,0|2,0,0]=4 1068 B10R1.245 COC1=C(N)C=CC=C1Cl OR9341 [0,2,0,0,0,0|2,0,0]=4 1069 B10R1.245 COC1=C(O)C=CC=C1Cl OR400489 [0,2,0,0,0,0|2,0,0]=4 1070 B10R1.245 COC1=C(O)C=CN=C1C OR2824 [0,2,0,0,0,0|1,0,0]=3 1071 B10R1.245 COC1=C(O)C=CN=C1Cl OR307236 [0,2,0,0,0,0|1,0,0]=3 1072 B10R1.245 COC1=C(O)N=CN=C1O OR3100 [0,2,0,0,0,0|2,0,0]=4 1073 B10R2.7 C1=CC2=C(C=C1)OCO2 OR4960 [0,1,0,1,0,0|2,0,0]=4 1074 B10R2.7 C1=CC2=C(C=CO2)N=C1 OR17929 [0,1,0,1,0,0|1,0,1]=4 1075 B10R2.7 C1=CC2=C(C=N1)CCN2 OR305601 [0,1,0,1,0,0|2,0,0]=4 1076 B10R2.7 C1=CC2=C(C=N1)CNC2 OR302510 [0,1,0,1,0,0|2,0,0]=4 1077 B10R2.7 C1=CC=C2COCC2=C1 OR24902 [0,1,0,1,0,0|2,0,0]=4 1078 B10R2.7 C1=CC=C2OCCC2=C1 OR28826 [0,1,0,1,0,0|2,0,0]=4 1079 B10R2.7 C1=CN=C2CCCC2=C1 OR5187 [0,1,0,1,0,0|2,0,0]=4 1080 B10R2.7 C1=CN=C2CNCC2=C1 OR30672 [0,1,0,1,0,0|2,0,0]=4 1081 B6R1.2 BrC1=CC=CO1 OR23025 [1,0,0,0,1,0|2,0,0]=4 1082 B6R1.2 BrC1=CC=CS1 OR6569 [1,0,0,0,1,0|2,0,0]=4 1083 B6R1.2 BrC1=CN=CO1 OR311178 [1,0,0,0,1,0|2,0,0]=4 1084 B6R1.2 BrC1=CN=CO1 OR53068 [1,0,0,0,1,0|2,0,0]=4 1085 B6R1.2 BrC1=CN=CS1 OR46041 [1,0,0,0,1,0|2,0,0]=4 1086 B6R1.2 BrC1=CNC=N1 OR10376 [1,0,0,0,1,0|1,0,1]=4 1087 B6R1.2 BrC1=CNN=C1 OR8592 [1,0,0,0,1,0|2,0,0]=4 1088 B6R1.2 BrC1=COC=C1 OR23030 [1,0,0,0,1,0|2,0,0]=4 1089 B6R1.2 BrC1=CON=C1 OR7800 [1,0,0,0,1,0|2,0,0]=4 1090 B6R1.2 BrC1=CSC=C1 OR6570 [1,0,0,0,1,0|2,0,0]=4 1091 B6R1.2 BrC1=CSC=N1 OR8552 [1,0,0,0,1,0|2,0,0]=4 1092 B6R1.2 BrC1=CSN=C1 OR301093 [1,0,0,0,1,0|2,0,0]=4 1093 B6R1.2 BrC1=NC=CN1 OR10366 [1,0,0,0,1,0|1,0,1]=4 1094 B6R1.2 BrC1=NC=CS1 OR23133 [1,0,0,0,1,0|2,0,0]=4 1095 B6R1.2 BrC1=NNC=C1 OR301082 [1,0,0,0,1,0|2,0,0]=4 1096 B6R1.2 BrC1=NNC=N1 OR13675 [1,0,0,0,1,0|2,0,0]=4 1097 B6R1.2 BrC1=NOC=C1 OR46500 [1,0,0,0,1,0|2,0,0]=4 1098 B6R1.2 BrC1=NSC=C1 OR40801 [1,0,0,0,1,0|2,0,0]=4 1099 B6R1.2 CC1=CC=CN1 OR46081 [1,0,0,0,1,0|0,0,1]=3 1100 B6R1.2 CC1=CC=CS1 OR28832 [1,0,0,0,1,0|1,0,0]=3 1101 B6R1.2 CC1=CC=NO1 OR15750 [1,0,0,0,1,0|1,0,0]=3 1102 B6R1.2 CC1=CN=CS1 OR322292 [1,0,0,0,1,0|1,0,0]=3 1103 B6R1.2 CC1=CNC=C1 OR313041 [1,0,0,0,1,0|0,0,1]=3 1104 B6R1.2 CC1=CNC=N1 OR8780 [1,0,0,0,1,0|0,0,1]=3 1105 B6R1.2 CC1=CNN=N1 OR46054 [1,0,0,0,1,0|1,0,1]=4 1106 B6R1.2 CC1=CSC=C1 OR10137 [1,0,0,0,1,0|1,0,0]=3 1107 B6R1.2 CC1=CSN=N1 OR300907 [1,0,0,0,1,0|2,0,0]=4 1108 B6R1.2 CC1=NC=CN1 OR2900 [1,0,0,0,1,0|0,0,1]=3 1109 B6R1.2 CC1=NNC=C1 OR301129 [1,0,0,0,1,0|1,0,0]=3 1110 B6R1.2 CC1=NNC=N1 OR322862 [1,0,0,0,1,0|1,0,0]=3 1111 B6R1.2 CC1=NSC=C1 OR346143 [1,0,0,0,1,0|1,0,0]=3 1112 B6R1.2 CN1C=CC=C1 OR5110 [1,0,0,0,1,0|2,0,0]=4 1113 B6R1.2 CN1C=CN=C1 OR10004 [1,0,0,0,1,0|1,0,0]=3 1114 B6R1.2 ClC1=CC=CS1 OR10138 [1,0,0,0,1,0|2,0,0]=4 1115 B6R1.2 ClC1=CNC=N1 OR46577 [1,0,0,0,1,0|1,0,1]=4 1116 B6R1.2 ClC1=CNN=C1 OR61421 [1,0,0,0,1,0|2,0,0]=4 1117 B6R1.2 ClC1=CSC=C1 OR0302 [1,0,0,0,1,0|2,0,0]=4 1118 B6R1.2 ClC1=NC=CN1 OR10411 [1,0,0,0,1,0|1,0,1]=4 1119 B6R1.2 ClC1=NC=CS1 OR9303 [1,0,0,0,1,0|2,0,0]=4 1120 B6R1.2 ClC1=NNC=C1 OR183405 [1,0,0,0,1,0|2,0,0]=4 1121 B6R1.2 IC1=CC=CS1 OR15030 [1,0,0,0,1,0|2,0,0]=4 1122 B6R1.2 IC1=CNC=N1 OR10517 [1,0,0,0,1,0|1,0,1]=4 1123 B6R1.2 IC1=CNN=C1 OR10990 [1,0,0,0,1,0|2,0,0]=4 1124 B6R1.2 IC1=CSC=C1 OR2623 [1,0,0,0,1,0|2,0,0]=4 1125 B6R1.2 IC1=NC=CN1 OR10516 [1,0,0,0,1,0|1,0,1]=4 1126 B6R1.2 NC1=CC=CS1 OR51953 [1,0,0,0,1,0|2,0,0]=4 1127 B6R1.2 NC1=CC=CS1 OR51954 [1,0,0,0,1,0|2,0,0]=4 1128 B6R1.2 NC1=CC=NN1 OR30957 [1,0,0,0,1,0|2,0,0]=4 1129 B6R1.2 NC1=CC=NO1 OR300646 [1,0,0,0,1,0|2,0,0]=4 1130 B6R1.2 NC1=CN=CS1 OR16619 [1,0,0,0,1,0|2,0,0]=4 1131 B6R1.2 NC1=CN=CS1 OR51952 [1,0,0,0,1,0|2,0,0]=4 1132 B6R1.2 NC1=CNN=C1 OR16453 [1,0,0,0,1,0|2,0,0]=4 1133 B6R1.2 NC1=NC=CN1 OR11741 [1,0,0,0,1,0|1,0,1]=4 1134 B6R1.2 NC1=NC=CO1 OR3721 [1,0,0,0,1,0|2,0,0]=4 1135 B6R1.2 NC1=NC=CS1 OR1880 [1,0,0,0,1,0|2,0,0]=4 1136 B6R1.2 NC1=NC=NS1 OR19519 [1,0,0,0,1,0|2,0,0]=4 1137 B6R1.2 NC1=NNC=C1 OR61130 [1,0,0,0,1,0|2,0,0]=4 1138 B6R1.2 NC1=NNC=C1 OR6125 [1,0,0,0,1,0|2,0,0]=4 1139 B6R1.2 NC1=NNC=N1 OR13640 [1,0,0,0,1,0|2,0,0]=4 1140 B6R1.2 NC1=NOC=C1 OR5608 [1,0,0,0,1,0|2,0,0]=4 1141 B6R1.2 OC1=CC=NN1 OR300636 [1,0,0,0,1,0|1,0,0]=3 1142 B6R1.2 OC1=NC=CS1 OR322501 [1,0,0,0,1,0|1,0,0]=3 1143 B6R1.2 OC1=NOC=C1 OR315208 [1,0,0,0,1,0|1,0,0]=3 1144 B6R1.2 SC1=CC=CS1 OR3041 [1,0,0,0,1,0|1,1,0]=4 1145 B6R1.2 SC1=NC=CN1 OR8823 [1,0,0,0,1,0|0,1,1]=4 1146 B6R1.2 SC1=NC=CS1 OR5341 [1,0,0,0,1,0|1,1,0]=4 1147 B6R1.2 SC1=NNC=N1 OR28670 [1,0,0,0,1,0|1,1,0]=4