0 B10R1.10 CC1=CC(CCBr)=CC=C1 P40673 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.10 CC1=CC(CCCl)=CC=C1 P38353 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.10 CC1=CC(CCI)=CC=C1 M23009 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.10 CC1=CC(CCN)=CC=C1 P37429 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.10 CC1=CC(CCN)=NC=C1 Q53269 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.10 CC1=CC=CC(CCO)=N1 Q52530 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.10 CC1=CN=CC(CCN)=C1 Q64732 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.10 CC1=CN=CC(CCO)=C1 Q64733 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.10 CC1=NC=CC(CC#N)=C1 L14363 [0,0,0,0,0,0|2,0,2]=4 9 B10R1.10 CC1=NC=CC(CCN)=C1 O31989 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.10 CCCC1=CC=CC(N)=C1 M23710 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.10 CCCC1=CC=CC(N)=N1 O31120 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.10 CCNC1=CC=CC(Br)=C1 P38317 [0,0,0,0,0,0|2,1,0]=3 13 B10R1.10 CCNC1=CC=CC(Cl)=C1 P41014 [0,0,0,0,0,0|2,1,0]=3 14 B10R1.10 CCNC1=CC=CC(F)=C1 P39149 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.10 CCOC1=CC(Br)=NC=C1 Q52481 [0,0,0,0,0,0|3,1,0]=4 16 B10R1.10 CCOC1=CC(C)=CN=C1 N27267 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.10 CCOC1=CC(Cl)=NC=C1 N24567 [0,0,0,0,0,0|3,1,0]=4 18 B10R1.10 CCOC1=CC=CC(F)=C1 Q66827 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.10 CCOC1=CC=CC(N)=N1 O30214 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.10 CCOC1=NC=CC(Br)=C1 N24697 [0,0,0,0,0,0|3,1,0]=4 21 B10R1.10 CCOC1=NC=CC(I)=C1 N26426 [0,0,0,0,0,0|3,1,0]=4 22 B10R1.10 CCOC1=NC=CC(N)=C1 P51356 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.10 CNCC1=CC(Cl)=NC=C1 P36290 [0,0,0,0,0,0|3,1,0]=4 24 B10R1.10 CNCC1=CC(F)=CN=C1 P42788 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.10 CNCC1=CC(O)=CC=C1 P42117 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.10 CNCC1=CC=CC(=O)N1 L20412 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.10 CNCC1=CC=CC(C)=C1 P38357 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.10 COCC1=CC(Br)=CC=C1 Q67458 [0,0,0,0,0,0|2,1,0]=3 29 B10R1.10 COCC1=CN=CC(Br)=C1 Q67548 [0,0,0,0,0,0|3,1,0]=4 30 B10R1.10 COCC1=NC=CC(N)=C1 Q56240 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.10 CSCC1=CC(N)=NC=C1 F-4303 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.10 FC1=CC(CCBr)=CC=C1 P39371 [0,0,0,0,0,0|1,0,0]=1 33 B10R1.10 FC1=CN=CC(CCBr)=C1 Q64580 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.10 N#CCC1=CC(Br)=CN=C1 G-7576 [0,0,0,0,0,0|1,1,2]=4 35 B10R1.10 N#CCC1=CC(F)=CN=C1 C-3499 [0,0,0,0,0,0|1,0,2]=3 36 B10R1.10 N#CCC1=CC=CC(N)=C1 P37983 [0,0,0,0,0,0|1,0,2]=3 37 B10R1.10 N#CCC1=CC=NC(Cl)=C1 Q55028 [0,0,0,0,0,0|1,1,2]=4 38 B10R1.10 NC1=CC(CCO)=CC=C1 O31199 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.10 NC1=CC(CCO)=NC=C1 Q53462 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.10 NCCC1=CC(Br)=NC=C1 H-8231 [0,0,0,0,0,0|1,1,0]=2 41 B10R1.10 NCCC1=CC(F)=CN=C1 Q64579 [0,0,0,0,0,0|1,0,0]=1 42 B10R1.10 NCCC1=CC(O)=CC=C1 M23068 [0,0,0,0,0,0|1,0,0]=1 43 B10R1.10 NCCC1=CC=CC(Cl)=C1 G-6963 [0,0,0,0,0,0|0,1,0]=1 44 B10R1.10 NCCC1=CC=CC(I)=C1 P34955 [0,0,0,0,0,0|0,1,0]=1 45 B10R1.10 NCCC1=CC=CC(N)=C1 P36157 [0,0,0,0,0,0|1,0,0]=1 46 B10R1.10 NCCC1=NC=CC(F)=C1 Q53270 [0,0,0,0,0,0|1,0,0]=1 47 B10R1.10 NNCC1=CC(Br)=CN=C1 Q51914 [0,0,0,0,0,0|2,1,0]=3 48 B10R1.10 NNCC1=CC(Cl)=CC=C1 Q51809 [0,0,0,0,0,0|1,1,0]=2 49 B10R1.10 NNCC1=CC(F)=CC=C1 C-3248 [0,0,0,0,0,0|1,0,0]=1 50 B10R1.10 NNCC1=CC(F)=CC=C1 Q51806 [0,0,0,0,0,0|1,0,0]=1 51 B10R1.10 NNCC1=CC=CC(Br)=C1 L20978 [0,0,0,0,0,0|1,1,0]=2 52 B10R1.10 OCCC1=CC(F)=CN=C1 Q64578 [0,0,0,0,0,0|2,0,0]=2 53 B10R1.10 OCCC1=CC=CC(O)=C1 P41607 [0,0,0,0,0,0|2,0,0]=2 54 B10R1.10 OCCC1=NC(Cl)=CC=C1 Q69232 [0,0,0,0,0,0|2,1,0]=3 55 B10R1.10 OCCC1=NC=CC(Br)=C1 S72505 [0,0,0,0,0,0|2,1,0]=3 56 B9R1.2 BrCC1=CC=CC(Br)=N1 P35902 [1,0,0,0,0,0|2,1,0]=4 57 B9R1.2 C#CC1=CC(F)=NC=C1 Q54978 [1,0,0,0,0,0|1,0,2]=4 58 B9R1.2 C#CC1=CC(O)=CC=C1 P42883 [1,0,0,0,0,0|1,0,2]=4 59 B9R1.2 C#CC1=CC=CC(Br)=C1 O27910 [1,0,0,0,0,0|0,1,2]=4 60 B9R1.2 C#CC1=CC=CC(C)=C1 P36176 [1,0,0,0,0,0|1,0,2]=4 61 B9R1.2 C=CC1=CN=CC(F)=C1 L21838 [1,0,0,0,0,0|1,0,2]=4 62 B9R1.2 CC1=CC(CN)=CC=N1 Q62498 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.2 CC1=CC(CN)=NC=C1 O29857 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.2 CC1=CC(CN)=NC=C1 O31684 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.2 CC1=CC(CN)=NN=C1 L22164 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.2 CC1=CC(NN)=NC=C1 O31163 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.2 CC1=CC=CC(CN)=N1 P35737 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.2 CC1=CC=CC(CN)=N1 P36768 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.2 CC1=CC=NC(CN)=N1 Q56400 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.2 CC1=CN=CC(CCl)=C1 O33584 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.2 CC1=CN=CC(CO)=C1 I-9425 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.2 CC1=NC(CN)=NC=C1 L14171 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.2 CC1=NC=CC(CN)=C1 O31522 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.2 CC1=NC=CC(CO)=C1 O30864 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.2 CCC1=CC(Br)=NC=C1 P45487 [1,0,0,0,0,0|1,1,0]=3 76 B9R1.2 CCC1=CC(Cl)=NC=N1 P51150 [1,0,0,0,0,0|2,1,0]=4 77 B9R1.2 CCC1=CC=CC(Br)=N1 Q52717 [1,0,0,0,0,0|1,1,0]=3 78 B9R1.2 CCC1=CC=CC(Cl)=N1 Q62319 [1,0,0,0,0,0|1,1,0]=3 79 B9R1.2 CCC1=CC=CC(F)=N1 Q62318 [1,0,0,0,0,0|1,0,0]=2 80 B9R1.2 CCC1=NC=CC(Cl)=N1 L18383 [1,0,0,0,0,0|2,1,0]=4 81 B9R1.2 CCC1=NC=CC(N)=C1 L18226 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.2 CNC1=CC(Br)=CN=C1 P51196 [1,0,0,0,0,0|2,1,0]=4 83 B9R1.2 CNC1=CC(C)=CC=N1 Q58361 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.2 CNC1=CC(C)=CC=N1 Q58362 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.2 CNC1=CC(O)=CC=C1 P41161 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.2 CNC1=CC=CC(F)=N1 Q58333 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.2 CNC1=CC=CC(I)=C1 P37043 [1,0,0,0,0,0|1,1,0]=3 88 B9R1.2 CNC1=NC=CC(I)=C1 N26836 [1,0,0,0,0,0|2,1,0]=4 89 B9R1.2 COC1=CC(C)=CN=C1 N25271 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.2 COC1=CC(F)=NC=C1 Q67856 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.2 COC1=CC(N)=CN=C1 Q56314 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.2 COC1=CC=CC(I)=N1 O32550 [1,0,0,0,0,0|2,1,0]=4 93 B9R1.2 COC1=CN=CC(Cl)=C1 S70722 [1,0,0,0,0,0|2,1,0]=4 94 B9R1.2 COC1=CN=CC(N)=C1 G-6107 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.2 COC1=CN=CC(O)=C1 O31805 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.2 COC1=NC=CC(Br)=C1 Q67517 [1,0,0,0,0,0|2,1,0]=4 97 B9R1.2 COC1=NC=CC(Cl)=C1 Q68014 [1,0,0,0,0,0|2,1,0]=4 98 B9R1.2 COC1=NC=CC(I)=C1 Q67717 [1,0,0,0,0,0|2,1,0]=4 99 B9R1.2 COC1=NC=CC(N)=C1 G-5580 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.2 COC1=NC=CC(O)=C1 N25339 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.2 CSC1=CC(F)=NC=C1 N26858 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.2 CSC1=CC=CC(Br)=N1 P51643 [1,0,0,0,0,0|2,1,0]=4 103 B9R1.2 CSC1=CN=CC(Br)=C1 Q67547 [1,0,0,0,0,0|2,1,0]=4 104 B9R1.2 CSC1=CN=CC(Cl)=C1 N26275 [1,0,0,0,0,0|2,1,0]=4 105 B9R1.2 CSC1=CN=CC(O)=C1 N26050 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.2 ClC1=CN=CC(CBr)=C1 Q53180 [1,0,0,0,0,0|2,1,0]=4 107 B9R1.2 ClC1=NC(CBr)=CC=C1 N26153 [1,0,0,0,0,0|2,1,0]=4 108 B9R1.2 ClCC1=CC(Cl)=CN=C1 F-4077 [1,0,0,0,0,0|2,1,0]=4 109 B9R1.2 ClCC1=CC(Cl)=NC=C1 I-9215 [1,0,0,0,0,0|2,1,0]=4 110 B9R1.2 ClCC1=CN=CC(Cl)=C1 Q53715 [1,0,0,0,0,0|2,1,0]=4 111 B9R1.2 FC1=CN=CC(CCl)=C1 C-3497 [1,0,0,0,0,0|2,0,0]=3 112 B9R1.2 N#CC1=CC(F)=CN=C1 O31819 [1,0,0,0,0,0|1,0,2]=4 113 B9R1.2 NC1=CC(C=O)=CC=C1 O30581 [1,0,0,0,0,0|2,0,1]=4 114 B9R1.2 NC1=CC(CO)=NC=C1 P43136 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.2 NC1=NC=CC(CO)=C1 G-7574 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.2 NCC1=CC(=O)NC=C1 C-3609 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.2 NCC1=CC(=O)NC=C1 P44155 [1,0,0,0,0,0|2,0,0]=3 118 B9R1.2 NCC1=CC(Br)=CN=C1 O31870 [1,0,0,0,0,0|1,1,0]=3 119 B9R1.2 NCC1=CC(Cl)=NC=C1 I-9257 [1,0,0,0,0,0|1,1,0]=3 120 B9R1.2 NCC1=CC(Cl)=NC=C1 L22480 [1,0,0,0,0,0|1,1,0]=3 121 B9R1.2 NCC1=CC(F)=CC=N1 Q52932 [1,0,0,0,0,0|1,0,0]=2 122 B9R1.2 NCC1=CC(F)=NC=C1 O29911 [1,0,0,0,0,0|1,0,0]=2 123 B9R1.2 NCC1=CC(F)=NC=C1 O31041 [1,0,0,0,0,0|1,0,0]=2 124 B9R1.2 NCC1=CC(N)=NC=N1 G-6200 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.2 NCC1=CC(O)=CC=C1 P36367 [1,0,0,0,0,0|1,0,0]=2 126 B9R1.2 NCC1=CC=CC(=O)N1 O30155 [1,0,0,0,0,0|2,0,0]=3 127 B9R1.2 NCC1=CC=CC(F)=C1 N26365 [1,0,0,0,0,0|0,0,0]=1 128 B9R1.2 NCC1=CC=NC(Cl)=N1 P48695 [1,0,0,0,0,0|2,1,0]=4 129 B9R1.2 NCC1=CC=NC(Cl)=N1 Q56710 [1,0,0,0,0,0|2,1,0]=4 130 B9R1.2 NCC1=CN=CC(F)=C1 C-3498 [1,0,0,0,0,0|1,0,0]=2 131 B9R1.2 NCC1=CN=CC(N)=C1 O29974 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.2 NCC1=CN=CC(N)=C1 O31108 [1,0,0,0,0,0|2,0,0]=3 133 B9R1.2 NCC1=C[N+]([O-])=CC=C1 Q55759 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.2 NCC1=NC(=O)NC=C1 Q51935 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.2 NCC1=NC(Br)=CC=C1 O34414 [1,0,0,0,0,0|1,1,0]=3 136 B9R1.2 NCC1=NC(F)=CC=C1 O30290 [1,0,0,0,0,0|1,0,0]=2 137 B9R1.2 NCC1=NC(F)=CC=C1 O31621 [1,0,0,0,0,0|1,0,0]=2 138 B9R1.2 NCC1=NC(N)=CC=C1 L20065 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.2 NCC1=NC(N)=CC=C1 Q62425 [1,0,0,0,0,0|2,0,0]=3 140 B9R1.2 NCC1=NC(N)=CC=C1 Q62426 [1,0,0,0,0,0|2,0,0]=3 141 B9R1.2 NCC1=NC=CC(Br)=C1 G-5659 [1,0,0,0,0,0|1,1,0]=3 142 B9R1.2 NCC1=NC=CC(Br)=C1 O33288 [1,0,0,0,0,0|1,1,0]=3 143 B9R1.2 NCC1=NC=CC(Br)=C1 Q51926 [1,0,0,0,0,0|1,1,0]=3 144 B9R1.2 NCC1=NC=CC(Cl)=C1 I-9896 [1,0,0,0,0,0|1,1,0]=3 145 B9R1.2 NCC1=NC=CC(Cl)=C1 Q56342 [1,0,0,0,0,0|1,1,0]=3 146 B9R1.2 NCC1=NC=CC(Cl)=N1 H-8844 [1,0,0,0,0,0|2,1,0]=4 147 B9R1.2 NCC1=NC=CC(Cl)=N1 Q52695 [1,0,0,0,0,0|2,1,0]=4 148 B9R1.2 NCC1=NC=CC(F)=C1 O29654 [1,0,0,0,0,0|1,0,0]=2 149 B9R1.2 NCC1=NC=CC(N)=N1 Q58583 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.2 NCC1=NC=CC(O)=C1 O29566 [1,0,0,0,0,0|2,0,0]=3 151 B9R1.2 NCC1=NC=NC(N)=C1 L13264 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.2 NCC1=NC=NC(O)=C1 G-6198 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.2 NNC1=CC(Cl)=NC=C1 O30804 [1,0,0,0,0,0|2,1,0]=4 154 B9R1.2 NNC1=CN=CC(Br)=C1 Q57187 [1,0,0,0,0,0|2,1,0]=4 155 B9R1.2 NNC1=CN=CC(Br)=C1 Q57188 [1,0,0,0,0,0|2,1,0]=4 156 B9R1.2 NNC1=NC=CC(Cl)=C1 P43285 [1,0,0,0,0,0|2,1,0]=4 157 B9R1.2 N\N=C1/C=C(I)C=CN1 N25209 [1,0,0,0,0,0|2,1,0]=4 158 B9R1.2 O=C1C=C(CO)C=CN1 C-2797 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.2 O=C1C=CC=C(CO)N1 Q52489 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.2 O=CC1=CC(F)=CN=C1 C-3502 [1,0,0,0,0,0|2,0,1]=4 161 B9R1.2 O=CC1=CC(F)=NC=C1 Q66309 [1,0,0,0,0,0|2,0,1]=4 162 B9R1.2 O=CC1=NC=CC(F)=C1 Q56665 [1,0,0,0,0,0|2,0,1]=4 163 B9R1.2 OC1=CC=CC(CBr)=C1 O29845 [1,0,0,0,0,0|2,0,0]=3 164 B9R1.2 OCC1=CC(Cl)=CN=C1 P39543 [1,0,0,0,0,0|2,1,0]=4 165 B9R1.2 OCC1=CC(Cl)=NC=C1 Q67739 [1,0,0,0,0,0|2,1,0]=4 166 B9R1.2 OCC1=CC(F)=CN=C1 C-3496 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.2 OCC1=CC(F)=NC=C1 P41706 [1,0,0,0,0,0|2,0,0]=3 168 B9R1.2 OCC1=CN=CC(Br)=C1 P38449 [1,0,0,0,0,0|2,1,0]=4 169 B9R1.2 OCC1=NC(Br)=CC=C1 P38733 [1,0,0,0,0,0|2,1,0]=4 170 B9R1.2 OCC1=NC(F)=CC=C1 P38880 [1,0,0,0,0,0|2,0,0]=3 171 B9R1.2 OCC1=NC=CC(Br)=C1 B-1208 [1,0,0,0,0,0|2,1,0]=4 172 B9R1.2 OCC1=NC=CC(F)=C1 O29281 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.2 [O-][N+]1=CC=CC(CCl)=C1 O29734 [1,0,0,0,0,0|3,0,0]=4 174 B9R1.8 BrCCC1=CC=NC=C1 Q62364 [1,0,0,0,0,0|2,0,0]=3 175 B9R1.8 BrCCC1=CN=CC=C1 Q62363 [1,0,0,0,0,0|2,0,0]=3 176 B9R1.8 C=CCC1=CC=CC=N1 Q62450 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.8 CNCC1=CC=CN=C1 P35002 [1,0,0,0,0,0|3,0,0]=4 178 B9R1.8 CNCC1=CC=NC=C1 P36555 [1,0,0,0,0,0|3,0,0]=4 179 B9R1.8 CNCC1=NC=CC=C1 P39822 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.8 N#CCC1=CC=NC=C1 P41732 [1,0,0,0,0,0|1,0,2]=4 181 B9R1.8 NCCC1=CC=NC=N1 L14509 [1,0,0,0,0,0|2,0,0]=3 182 B9R1.8 NCCC1=NC=CC=N1 L14904 [1,0,0,0,0,0|2,0,0]=3 183 B9R1.8 NCCC1=NC=CC=N1 Q55474 [1,0,0,0,0,0|2,0,0]=3 184 B9R1.8 NCCC1=NC=NC=C1 Q56454 [1,0,0,0,0,0|2,0,0]=3 185 B9R1.8 NNCC1=CC=CC=C1 P43525 [1,0,0,0,0,0|1,0,0]=2 186 B9R1.8 NNCC1=CC=CN=C1 O31533 [1,0,0,0,0,0|2,0,0]=3 187 B9R1.8 NNCC1=CC=NC=C1 C-3253 [1,0,0,0,0,0|2,0,0]=3 188 B9R1.8 NNCC1=CC=NC=C1 L13556 [1,0,0,0,0,0|2,0,0]=3 189 B9R1.8 NNCC1=CC=NC=C1 O32212 [1,0,0,0,0,0|2,0,0]=3 190 B9R1.8 NNCC1=CN=CC=C1 C-3254 [1,0,0,0,0,0|2,0,0]=3 191 B9R1.8 NNCC1=CN=CN=C1 C-3759 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.8 NNCC1=NC=CC=C1 C-3255 [1,0,0,0,0,0|2,0,0]=3 193 B9R1.8 NNCC1=NC=CC=C1 O31423 [1,0,0,0,0,0|2,0,0]=3 194 B9R1.8 NNCC1=NC=CC=N1 C-2760 [1,0,0,0,0,0|3,0,0]=4 195 B9R1.8 NNCC1=NC=CN=C1 G-5311 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.8 O=CCC1=CN=CC=C1 Q60356 [1,0,0,0,0,0|2,0,1]=4 197 B9R1.8 OCCC1=CC=CN=C1 O28068 [1,0,0,0,0,0|2,0,0]=3 198 B9R1.8 OCCC1=CC=NC=C1 P37585 [1,0,0,0,0,0|2,0,0]=3 199 B9R1.8 OCCC1=CC=NC=N1 Q56821 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.8 OCCC1=NC=CC=N1 Q56820 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.8 [C-]#[N+]CC1=NC=CC=C1 O32008 [1,0,0,0,0,0|3,0,0]=4 202 B11R1.13 CCOC1=C(N)C(N)=CC=C1 O29910 [0,1,0,0,0,0|3,0,0]=4 203 B11R1.13 CNCC1=CC=CC(Br)=C1F N24854 [0,1,0,0,0,0|2,1,0]=4 204 B11R1.13 COCC1=C(F)C(Br)=CC=C1 O32038 [0,1,0,0,0,0|2,1,0]=4 205 B11R1.13 ClC1=C(Cl)C(CCBr)=CC=C1 P34812 [0,1,0,0,0,0|1,1,0]=3 206 B11R1.13 FC1=C(F)C(CCBr)=CC=C1 P41924 [0,1,0,0,0,0|1,0,0]=2 207 B11R1.13 N#CCC1=CC=CC(F)=C1I O29631 [0,1,0,0,0,0|0,0,2]=3 208 B11R1.13 OCCC1=CC=CC(F)=C1F O27892 [0,1,0,0,0,0|1,0,0]=2 209 B11R1.23 C#CC(O)C1=CC=CC(Cl)=C1 P38984 [0,1,0,0,0,0|1,1,1]=4 210 B11R1.23 C#CC(O)C1=CC=CC(F)=C1 O31432 [0,1,0,0,0,0|1,0,1]=3 211 B11R1.23 CC1=CC(C(=O)CBr)=CC=C1 O28559 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.23 CC1=CC(C(N)CO)=CC=C1 P42443 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.23 CC1=CC(C(O)CN)=CC=C1 P37590 [0,1,0,0,0,0|1,0,0]=2 214 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 P42962 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.23 CCC(N)C1=CC=CC(Cl)=C1 P38298 [0,1,0,0,0,0|1,1,0]=3 216 B11R1.23 CCC(O)C1=CC=CC(Cl)=C1 P38851 [0,1,0,0,0,0|1,1,0]=3 217 B11R1.23 NC(CO)C1=CC=CC(Br)=C1 P40234 [0,1,0,0,0,0|1,1,0]=3 218 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 P40407 [0,1,0,0,0,0|1,1,0]=3 219 B11R1.23 NC(CO)C1=CC=CC(F)=C1 P40409 [0,1,0,0,0,0|1,0,0]=2 220 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 P37041 [0,1,0,0,0,0|0,1,1]=3 221 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 P37749 [0,1,0,0,0,0|0,1,1]=3 222 B11R1.23 NCC(=O)C1=CC=CC(F)=C1 P35035 [0,1,0,0,0,0|0,0,1]=2 223 B11R1.23 NCC(=O)C1=CC=CC(O)=C1 P41173 [0,1,0,0,0,0|1,0,1]=3 224 B11R1.23 NCC(O)C1=CC=CC(Br)=C1 P38183 [0,1,0,0,0,0|0,1,0]=2 225 B11R1.23 NCC(O)C1=CC=CC(Cl)=C1 P37589 [0,1,0,0,0,0|0,1,0]=2 226 B11R1.23 NCC(O)C1=CC=CC(F)=C1 P38243 [0,1,0,0,0,0|0,0,0]=1 227 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 P51568 [0,1,0,0,0,0|0,1,0]=2 228 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 P39827 [0,1,0,0,0,0|1,1,0]=3 229 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 P35059 [0,1,0,0,0,0|1,1,0]=3 230 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 P42255 [0,1,0,0,0,0|1,0,0]=2 231 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 P39826 [0,1,0,0,0,0|1,1,0]=3 232 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=N1 Q53157 [0,1,0,0,0,0|2,1,0]=4 233 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 P36766 [0,1,0,0,0,0|1,1,0]=3 234 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 P38815 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.24 BrCCCC1=CC(Br)=CC=C1 O28830 [0,1,0,0,0,0|1,1,0]=3 236 B11R1.24 C#CCOC1=CC=CC(C)=C1 P37380 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.24 CC1=CC(CCCN)=CC=C1 P42846 [0,1,0,0,0,0|1,0,0]=2 238 B11R1.24 CC1=CC(CCCO)=CC=C1 P42630 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.24 CC1=CC(OCCN)=CC=C1 P36838 [0,1,0,0,0,0|1,0,0]=2 240 B11R1.24 CC1=CC(OCCO)=CC=C1 P41522 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.24 CC1=NC(NCCN)=CC=C1 Q62433 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.24 CCCCC1=CC=CC(N)=N1 O30054 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.24 CCCC[N+]1=CC=CC(C)=C1 O34174 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.24 CCCOC1=CC(Br)=CC=C1 Q66928 [0,1,0,0,0,0|1,1,0]=3 245 B11R1.24 CCNCC1=CC(Br)=CN=C1 O32185 [0,1,0,0,0,0|2,1,0]=4 246 B11R1.24 CCOCC1=CC(Br)=CN=C1 N26827 [0,1,0,0,0,0|2,1,0]=4 247 B11R1.24 CNCCC1=CC=CC(Br)=C1 P36066 [0,1,0,0,0,0|0,1,0]=2 248 B11R1.24 CNCCC1=CC=CC(C)=C1 P41493 [0,1,0,0,0,0|1,0,0]=2 249 B11R1.24 CNCCC1=CC=CC(Cl)=C1 P37634 [0,1,0,0,0,0|0,1,0]=2 250 B11R1.24 CNCCC1=CC=CC(F)=C1 P37712 [0,1,0,0,0,0|0,0,0]=1 251 B11R1.24 COCOC1=CC(Br)=CC=C1 Q66574 [0,1,0,0,0,0|2,1,0]=4 252 B11R1.24 COCOC1=CC(Cl)=CC=C1 Q66406 [0,1,0,0,0,0|2,1,0]=4 253 B11R1.24 COCOC1=CC(F)=CC=C1 Q66728 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.24 ClC1=CC(CCCBr)=CC=C1 P35187 [0,1,0,0,0,0|1,1,0]=3 255 B11R1.24 FC1=CC(CCCBr)=CC=C1 P40928 [0,1,0,0,0,0|1,0,0]=2 256 B11R1.24 N#CCOC1=CC=CC(Br)=C1 P34857 [0,1,0,0,0,0|0,1,2]=4 257 B11R1.24 N#CCOC1=CC=CC(F)=C1 P41549 [0,1,0,0,0,0|0,0,2]=3 258 B11R1.24 N#CCOC1=CC=CC(O)=C1 P42751 [0,1,0,0,0,0|1,0,2]=4 259 B11R1.24 NC1=CC(CCCO)=NC=C1 Q53463 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.24 NC1=CC=CC(OCCO)=C1 P37761 [0,1,0,0,0,0|2,0,0]=3 261 B11R1.24 NCCCC1=CC(O)=CC=C1 P37377 [0,1,0,0,0,0|1,0,0]=2 262 B11R1.24 NCCCC1=CC=CC(Br)=C1 P40513 [0,1,0,0,0,0|0,1,0]=2 263 B11R1.24 NCCCC1=CC=CC(Cl)=C1 P40264 [0,1,0,0,0,0|0,1,0]=2 264 B11R1.24 NCCCC1=CC=CC(F)=C1 P42845 [0,1,0,0,0,0|0,0,0]=1 265 B11R1.24 NCCCC1=CC=CC(N)=C1 P38762 [0,1,0,0,0,0|1,0,0]=2 266 B11R1.24 NCCOC1=CC(O)=CC=C1 Q66030 [0,1,0,0,0,0|1,0,0]=2 267 B11R1.24 NCCOC1=CC=CC(Br)=C1 P35063 [0,1,0,0,0,0|0,1,0]=2 268 B11R1.24 NCCOC1=CC=CC(Cl)=C1 P36837 [0,1,0,0,0,0|0,1,0]=2 269 B11R1.24 NCCOC1=CC=CC(F)=C1 P42322 [0,1,0,0,0,0|0,0,0]=1 270 B11R1.24 OCC#CC1=CC=CC(Cl)=C1 O30477 [0,1,0,0,0,0|1,1,1]=4 271 B11R1.24 OCC#CC1=CC=CC(F)=C1 O27862 [0,1,0,0,0,0|1,0,1]=3 272 B11R1.24 OCCCC1=CC=CC(Br)=C1 P36802 [0,1,0,0,0,0|1,1,0]=3 273 B11R1.24 OCCCC1=CC=CC(Cl)=C1 P39520 [0,1,0,0,0,0|1,1,0]=3 274 B11R1.24 OCCCC1=CC=CC(F)=C1 P40929 [0,1,0,0,0,0|1,0,0]=2 275 B11R1.24 OCCCC1=CC=CC(O)=C1 P41291 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.24 OCCOC1=CC=CC(Br)=C1 P36001 [0,1,0,0,0,0|1,1,0]=3 277 B11R1.24 OCCOC1=CC=CC(Cl)=C1 P37049 [0,1,0,0,0,0|1,1,0]=3 278 B11R1.24 OCCOC1=CC=CC(Cl)=N1 Q58465 [0,1,0,0,0,0|2,1,0]=4 279 B11R1.24 OCCOC1=CC=CC(F)=C1 P41246 [0,1,0,0,0,0|1,0,0]=2 280 B11R1.24 OCCOC1=CC=CC(I)=C1 P36653 [0,1,0,0,0,0|1,1,0]=3 281 B11R1.34 CC1=CC(N=C=S)=CC(F)=C1 O31566 [0,1,0,0,0,0|2,0,1]=4 282 B11R1.34 CCNC1=CC(Cl)=CC(Cl)=C1 P38143 [0,1,0,0,0,0|2,1,0]=4 283 B11R1.34 CCOC1=CC(Br)=CC(Br)=C1 Q67194 [0,1,0,0,0,0|2,1,0]=4 284 B11R1.34 CCOC1=CC(Br)=CC(F)=C1 Q68063 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.34 CCOC1=CC(C)=CC(F)=C1 N27355 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.34 CCOC1=CC(F)=CC(F)=C1 Q67542 [0,1,0,0,0,0|2,0,0]=3 287 B11R1.34 CCOC1=CC(O)=CC(Br)=C1 N26906 [0,1,0,0,0,0|2,1,0]=4 288 B11R1.34 ClC1=CC(Cl)=CC(CCBr)=C1 P35013 [0,1,0,0,0,0|1,1,0]=3 289 B11R1.34 FC1=CC(F)=CC(CCBr)=C1 P34811 [0,1,0,0,0,0|1,0,0]=2 290 B11R1.34 NCCC1=CC(Cl)=CC(Cl)=C1 P36655 [0,1,0,0,0,0|0,1,0]=2 291 B11R1.34 OCCC1=CC(Cl)=CC(Cl)=C1 O28071 [0,1,0,0,0,0|1,1,0]=3 292 B11R1.34 OCCC1=CC(F)=CC(F)=C1 P37971 [0,1,0,0,0,0|1,0,0]=2 293 B11R1.157 CC(C)NC1=CC=CC(Br)=C1 P41926 [0,1,0,0,0,0|2,1,0]=4 294 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 P38903 [0,1,0,0,0,0|2,1,0]=4 295 B11R1.157 CC(C)NC1=CC=CC(F)=C1 P42251 [0,1,0,0,0,0|2,0,0]=3 296 B11R1.157 CC(C)OC1=CC(F)=CC=C1 Q66828 [0,1,0,0,0,0|2,0,0]=3 297 B11R1.157 CC(C)OC1=CC=CC(O)=C1 N24861 [0,1,0,0,0,0|3,0,0]=4 298 B11R1.157 CC1=CC(CB(O)O)=CC=C1 L20484 [0,1,0,0,0,0|3,0,0]=4 299 B11R1.157 CC1=CC(NC(C)C)=CC=C1 P42983 [0,1,0,0,0,0|3,0,0]=4 300 B11R1.157 CN(C)CC1=CC(N)=CC=C1 P39096 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.157 CN(C)CC1=CC=CC(Br)=C1 Q67698 [0,1,0,0,0,0|2,1,0]=4 302 B11R1.157 FC1=CC(OC(F)F)=CC=C1 O31131 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 C-3500 [0,1,0,0,0,0|2,0,1]=4 304 B11R1.157 O=C(O)CC1=NC(F)=CC=C1 L21789 [0,1,0,0,0,0|2,0,1]=4 305 B11R1.157 O=C(O)CC1=NC=CC(F)=C1 Q60777 [0,1,0,0,0,0|2,0,1]=4 306 B11R1.182 C=CCC1=C(O)C=CC(Cl)=C1 L19203 [0,1,0,0,0,0|1,1,1]=4 307 B11R1.182 CC1=CC=C(C)C(CNN)=C1 L21088 [0,1,0,0,0,0|2,0,0]=3 308 B11R1.182 CCCC1=CC(O)=CC=C1Cl O29485 [0,1,0,0,0,0|2,0,0]=3 309 B11R1.182 CCOC1=C(Br)C=CC(Br)=C1 N25686 [0,1,0,0,0,0|2,1,0]=4 310 B11R1.182 CCOC1=C(Br)C=CC(O)=C1 H-8355 [0,1,0,0,0,0|3,0,0]=4 311 B11R1.182 CCOC1=C(Cl)C=CC(Br)=C1 N24921 [0,1,0,0,0,0|2,1,0]=4 312 B11R1.182 CCOC1=CC(Br)=CC=C1C Q66415 [0,1,0,0,0,0|2,1,0]=4 313 B11R1.182 CCOC1=CC(Br)=CC=C1F Q67057 [0,1,0,0,0,0|2,1,0]=4 314 B11R1.182 CCOC1=CC(C)=CC=C1Br N27758 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.182 CCOC1=CC(F)=CC=C1Br Q67521 [0,1,0,0,0,0|2,0,0]=3 316 B11R1.182 CNCC1=CC(Cl)=CC=C1Cl M23031 [0,1,0,0,0,0|2,1,0]=4 317 B11R1.182 CNCC1=CC(F)=CC=C1F Q66047 [0,1,0,0,0,0|2,0,0]=3 318 B11R1.182 ClC1=CC=C(Cl)C(CCBr)=C1 P38258 [0,1,0,0,0,0|1,1,0]=3 319 B11R1.182 FC1=CC=C(F)C(CCBr)=C1 P41606 [0,1,0,0,0,0|1,0,0]=2 320 B11R1.182 NCCN1C=C(Br)C=CC1=O Q58261 [0,1,0,0,0,0|1,1,0]=3 321 B11R1.182 OCCC1=CC(Cl)=CC=C1Cl P40249 [0,1,0,0,0,0|1,1,0]=3 322 B11R1.182 OCCC1=CC(F)=CC=C1F O27997 [0,1,0,0,0,0|1,0,0]=2 323 B11R1.189 CCCC1=NC=CC(C#N)=C1 Q62488 [0,1,0,0,0,0|3,0,0]=4 324 B11R1.189 CCNC1=CC=CC(OC)=C1 P38184 [0,1,0,0,0,0|3,0,0]=4 325 B11R1.189 CNCC1=CC=CC(C#N)=C1 P35253 [0,1,0,0,0,0|3,0,0]=4 326 B11R1.189 COC1=CC(CCBr)=CC=C1 P39742 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.189 COC1=CC(CON)=CC=C1 O31688 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.189 COC1=CC=CC(CCN)=N1 Q62431 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.189 COC1=CC=CC(CNN)=C1 C-3257 [0,1,0,0,0,0|2,0,0]=3 330 B11R1.189 N#CC1=CC(CCO)=NC=C1 I-9684 [0,1,0,0,0,0|3,0,0]=4 331 B11R1.189 N#CCC1=CC=CC(C#N)=C1 P40744 [0,1,0,0,0,0|1,0,2]=4 332 B11R1.192 CC1=C(F)C=CC(CCO)=N1 Q53007 [0,1,0,0,0,0|3,0,0]=4 333 B11R1.192 CC1=CC=C(CC#N)C=C1C P38953 [0,1,0,0,0,0|1,0,2]=4 334 B11R1.192 CCOC1=CC(F)=C(C)C=C1 N24366 [0,1,0,0,0,0|2,0,0]=3 335 B11R1.192 CCOC1=CC=C(Br)C(C)=C1 Q66720 [0,1,0,0,0,0|3,0,0]=4 336 B11R1.192 CCOC1=CC=C(Br)C(Cl)=C1 Q66397 [0,1,0,0,0,0|2,1,0]=4 337 B11R1.192 CCOC1=CC=C(Br)C(F)=C1 Q67492 [0,1,0,0,0,0|2,0,0]=3 338 B11R1.192 CCOC1=CC=C(C)C(Br)=C1 N26273 [0,1,0,0,0,0|2,1,0]=4 339 B11R1.192 CCOC1=CC=C(C)C(O)=C1 N25713 [0,1,0,0,0,0|3,0,0]=4 340 B11R1.192 CCOC1=CC=C(F)C(O)=C1 N25197 [0,1,0,0,0,0|3,0,0]=4 341 B11R1.192 CCOC1=CC=C(O)C(Cl)=C1 N25132 [0,1,0,0,0,0|2,1,0]=4 342 B11R1.192 CNCC1=CC=C(C)C(C)=C1 P40736 [0,1,0,0,0,0|3,0,0]=4 343 B11R1.192 CNCC1=CC=C(F)C(Br)=C1 Q66119 [0,1,0,0,0,0|2,1,0]=4 344 B11R1.192 CNCC1=CC=C(F)C(Cl)=C1 Q66040 [0,1,0,0,0,0|2,1,0]=4 345 B11R1.192 CNCC1=CC=C(F)C(F)=C1 P36292 [0,1,0,0,0,0|2,0,0]=3 346 B11R1.192 COCC1=CC=C(Br)C(C)=C1 N26886 [0,1,0,0,0,0|3,0,0]=4 347 B11R1.192 COCC1=CC=C(Cl)C(Br)=C1 N26925 [0,1,0,0,0,0|2,1,0]=4 348 B11R1.192 ClC1=CC=C(CCBr)C=C1Cl P38351 [0,1,0,0,0,0|1,1,0]=3 349 B11R1.192 FC1=CC=C(CCBr)C=C1F P40504 [0,1,0,0,0,0|1,0,0]=2 350 B11R1.192 N#CCC1=CC=C(Br)C(F)=C1 H-8275 [0,1,0,0,0,0|0,0,2]=3 351 B11R1.192 NCCC1=CC=C(Cl)C(F)=C1 O32009 [0,1,0,0,0,0|0,0,0]=1 352 B11R1.192 NCCC1=CC=C(F)C(F)=C1 P39635 [0,1,0,0,0,0|0,0,0]=1 353 B11R1.192 OCCC1=CC(Br)=C(Cl)N=C1 L18305 [0,1,0,0,0,0|2,1,0]=4 354 B11R1.192 OCCC1=CC=C(F)C(F)=C1 P39050 [0,1,0,0,0,0|1,0,0]=2 355 B11R1.192 OCCC1=CC=C(O)C(O)=C1 M15188 [0,1,0,0,0,0|2,0,0]=3 356 B11R2.35 BrC1=CC(C2CO2)=CC=C1 P39092 [0,0,0,1,0,0|1,1,0]=3 357 B11R2.35 BrC1=CC=CC(C2CC2)=C1 O31879 [0,0,0,1,0,0|1,1,0]=3 358 B11R2.35 BrC1=CN=CC(C2CC2)=C1 N25476 [0,0,0,1,0,0|2,1,0]=4 359 B11R2.35 ClC1=CC(C2CC2)=CC=N1 I-9975 [0,0,0,1,0,0|2,1,0]=4 360 B11R2.35 ClC1=CC(C2CO2)=CC=C1 P39883 [0,0,0,1,0,0|1,1,0]=3 361 B11R2.35 FC1=CC(C2CO2)=CC=C1 P40300 [0,0,0,1,0,0|1,0,0]=2 362 B11R2.35 FC1=CN=CC(C2CC2)=C1 N27151 [0,0,0,1,0,0|2,0,0]=3 363 B11R2.35 NC1=CC(C2CC2)=NC=C1 M23384 [0,0,0,1,0,0|3,0,0]=4 364 B11R2.35 OC1=CC=CC(C2CC2)=C1 O30101 [0,0,0,1,0,0|2,0,0]=3 365 B11R2.36 BrC1=CC2=C(C=C1)CCN2 M15579 [0,0,0,1,0,0|2,1,0]=4 366 B11R2.36 BrC1=CC2=C(C=C1)CNC2 O32275 [0,0,0,1,0,0|2,1,0]=4 367 B11R2.36 BrC1=CC2=C(N=C1)NCC2 10616 [0,0,0,1,0,0|1,1,0]=3 368 B11R2.36 BrC1=CC2=C(N=C1)NCC2 Q51813 [0,0,0,1,0,0|1,1,0]=3 369 B11R2.36 BrC1=CC=C2C=CCC2=C1 10753 [0,0,0,1,0,0|1,1,1]=4 370 B11R2.36 BrC1=CC=C2CNCC2=C1 C-3625 [0,0,0,1,0,0|2,1,0]=4 371 B11R2.36 BrC1=CC=C2NC=NC2=C1 A-847 [0,0,0,1,0,0|1,1,1]=4 372 B11R2.36 BrC1=CC=C2NN=CC2=C1 C-2005 [0,0,0,1,0,0|1,1,1]=4 373 B11R2.36 CC1=CC2=C(C=C1)NCC2 O32270 [0,0,0,1,0,0|1,0,0]=2 374 B11R2.36 CC1=CC2=C(C=C1)NN=C2 O34411 [0,0,0,1,0,0|2,0,1]=4 375 B11R2.36 ClC1=CC2=C(C=C1)CCN2 M15570 [0,0,0,1,0,0|2,1,0]=4 376 B11R2.36 ClC1=CC=C2NN=CC2=C1 C-2056 [0,0,0,1,0,0|1,1,1]=4 377 B11R2.36 ClC1=CC=C2OCCC2=C1 M15833 [0,0,0,1,0,0|1,1,0]=3 378 B11R2.36 FC1=CC2=C(C=C1)CCN2 D-2527 [0,0,0,1,0,0|2,0,0]=3 379 B11R2.36 FC1=CC2=C(C=C1)CNC2 L13810 [0,0,0,1,0,0|2,0,0]=3 380 B11R2.36 FC1=CC2=C(C=CN2)C=C1 C-3360 [0,0,0,1,0,0|2,0,1]=4 381 B11R2.36 FC1=CC2=C(C=N1)NC=C2 O32349 [0,0,0,1,0,0|1,0,2]=4 382 B11R2.36 FC1=CC2=C(N=C1)NC=C2 G-5294 [0,0,0,1,0,0|1,0,2]=4 383 B11R2.36 FC1=CC=C2C=NNC2=C1 C-2106 [0,0,0,1,0,0|3,0,0]=4 384 B11R2.36 FC1=CC=C2N=CSC2=C1 Q65372 [0,0,0,1,0,0|1,0,2]=4 385 B11R2.36 FC1=CC=C2NC=CC2=N1 P44953 [0,0,0,1,0,0|1,0,2]=4 386 B11R2.36 FC1=CC=C2NN=CC2=C1 C-2101 [0,0,0,1,0,0|1,0,1]=3 387 B11R2.36 FC1=CC=C2OC=CC2=C1 P39420 [0,0,0,1,0,0|1,0,2]=4 388 B11R2.36 FC1=CC=C2OCCC2=C1 Q65592 [0,0,0,1,0,0|1,0,0]=2 389 B11R2.36 FC1=CC=C2SC=CC2=C1 P51244 [0,0,0,1,0,0|1,0,2]=4 390 B11R2.36 FC1=CN=C2NN=CC2=C1 C-3700 [0,0,0,1,0,0|2,0,1]=4 391 B11R2.36 FC1=NC2=C(C=C1)NN=C2 P49012 [0,0,0,1,0,0|2,0,1]=4 392 B11R2.36 IC1=CC2=C(C=C1)CCN2 O31769 [0,0,0,1,0,0|2,1,0]=4 393 B11R2.36 IC1=CC2=C(C=C1)CNC2 H-8930 [0,0,0,1,0,0|2,1,0]=4 394 B11R2.36 IC1=CC2=C(C=C1)CNC2 M15878 [0,0,0,1,0,0|2,1,0]=4 395 B11R2.36 IC1=CC2=C(C=C1)NC=C2 Q55309 [0,0,0,1,0,0|0,1,2]=4 396 B11R2.36 IC1=CC=C2NN=CC2=C1 C-2103 [0,0,0,1,0,0|1,1,1]=4 397 B11R2.36 NC1=CC2=C(C=C1)CCN2 P40883 [0,0,0,1,0,0|3,0,0]=4 398 B11R2.36 NC1=CC2=C(C=C1)NN=C2 C-2139 [0,0,0,1,0,0|2,0,1]=4 399 B11R2.36 NC1=CC=C2OCCC2=C1 M15806 [0,0,0,1,0,0|2,0,0]=3 400 B11R2.36 OC1=CC2=C(C=C1)CNC2 Q57110 [0,0,0,1,0,0|3,0,0]=4 401 B11R2.36 OC1=CC2=C(C=C1)NC=C2 P46527 [0,0,0,1,0,0|1,0,2]=4 402 B11R2.36 OC1=CC2=C(C=C1)NCC2 O32235 [0,0,0,1,0,0|1,0,0]=2 403 B11R2.36 OC1=CC2=C(C=C1)OCC2 N25202 [0,0,0,1,0,0|2,0,0]=3 404 B11R2.106 BrC1=C2CNCC2=CC=C1 L18234 [0,0,0,1,0,0|2,1,0]=4 405 B11R2.106 BrC1=C2NN=CC2=CC=C1 C-2070 [0,0,0,1,0,0|1,1,1]=4 406 B11R2.106 BrC1=C2OCCC2=CC=C1 M15789 [0,0,0,1,0,0|1,1,0]=3 407 B11R2.106 BrC1=C2OCOC2=CC=C1 O31623 [0,0,0,1,0,0|2,1,0]=4 408 B11R2.106 BrC1=CC=CC2=C1CCC2 G-5799 [0,0,0,1,0,0|1,1,0]=3 409 B11R2.106 BrC1=CC=CC2=C1CCN2 O30708 [0,0,0,1,0,0|2,1,0]=4 410 B11R2.106 BrC1=CC=CC2=C1CCN2 O34479 [0,0,0,1,0,0|2,1,0]=4 411 B11R2.106 BrC1=CC=CC2=C1CNC2 P51178 [0,0,0,1,0,0|2,1,0]=4 412 B11R2.106 BrC1=CC=CC2=C1NCC2 O30394 [0,0,0,1,0,0|0,1,0]=2 413 B11R2.106 BrC1=CN=CC2=C1NCC2 F-4133 [0,0,0,1,0,0|1,1,0]=3 414 B11R2.106 CC1=CC=CC2=C1CNC2 O31189 [0,0,0,1,0,0|3,0,0]=4 415 B11R2.106 CC1=CC=CC2=C1NC=C2 I-9272 [0,0,0,1,0,0|1,0,2]=4 416 B11R2.106 CC1=CC=CC2=C1NN=C2 O34439 [0,0,0,1,0,0|2,0,1]=4 417 B11R2.106 ClC1=C2CCNC2=CC=C1 H-8553 [0,0,0,1,0,0|2,1,0]=4 418 B11R2.106 ClC1=C2NN=CC2=CC=C1 C-2058 [0,0,0,1,0,0|1,1,1]=4 419 B11R2.106 ClC1=CC=CC2=C1CNC2 O32221 [0,0,0,1,0,0|2,1,0]=4 420 B11R2.106 ClC1=CC=CC2=C1NC=C2 Q55310 [0,0,0,1,0,0|0,1,2]=4 421 B11R2.106 ClC1=NC=CC2=C1NCC2 O33103 [0,0,0,1,0,0|1,1,0]=3 422 B11R2.106 FC1=C2NC=CC2=CC=C1 C-3602 [0,0,0,1,0,0|0,0,2]=3 423 B11R2.106 FC1=C2NC=CC2=CC=N1 P49490 [0,0,0,1,0,0|1,0,2]=4 424 B11R2.106 FC1=C2NC=CC2=CN=C1 10566 [0,0,0,1,0,0|1,0,2]=4 425 B11R2.106 FC1=C2NC=CC2=NC=C1 P48991 [0,0,0,1,0,0|1,0,2]=4 426 B11R2.106 FC1=C2NN=CC2=NC=C1 P48500 [0,0,0,1,0,0|2,0,1]=4 427 B11R2.106 FC1=C2OC=CC2=CC=C1 P39419 [0,0,0,1,0,0|1,0,2]=4 428 B11R2.106 FC1=C2SC=CC2=CC=C1 P38656 [0,0,0,1,0,0|1,0,2]=4 429 B11R2.106 FC1=CC=CC2=C1C=CN2 C-3359 [0,0,0,1,0,0|2,0,1]=4 430 B11R2.106 FC1=CC=CC2=C1C=CO2 N26468 [0,0,0,1,0,0|2,0,1]=4 431 B11R2.106 FC1=CC=CC2=C1C=NN2 G-6585 [0,0,0,1,0,0|3,0,0]=4 432 B11R2.106 FC1=CC=CC2=C1CCN2 O30386 [0,0,0,1,0,0|2,0,0]=3 433 B11R2.106 FC1=CC=CC2=C1CCN2 P43501 [0,0,0,1,0,0|2,0,0]=3 434 B11R2.106 FC1=CC=CC2=C1NN=C2 Q55643 [0,0,0,1,0,0|1,0,1]=3 435 B11R2.106 FC1=CC=NC2=C1CCO2 L22189 [0,0,0,1,0,0|3,0,0]=4 436 B11R2.106 IC1=C2NN=CC2=CC=C1 10155 [0,0,0,1,0,0|1,1,1]=4 437 B11R2.106 IC1=CC=CC2=C1CCN2 O30821 [0,0,0,1,0,0|2,1,0]=4 438 B11R2.106 NC1=C2CCOC2=CC=C1 M15821 [0,0,0,1,0,0|3,0,0]=4 439 B11R2.106 NC1=C2COCC2=CC=C1 S72502 [0,0,0,1,0,0|3,0,0]=4 440 B11R2.106 NC1=C2OCCC2=CC=C1 M15777 [0,0,0,1,0,0|2,0,0]=3 441 B11R2.106 NC1=CC=CC2=C1NC=C2 O31787 [0,0,0,1,0,0|1,0,2]=4 442 B11R2.106 NC1=CC=CC2=C1NN=C2 C-2137 [0,0,0,1,0,0|2,0,1]=4 443 B11R2.106 OC1=C2CCOC2=CC=C1 M15862 [0,0,0,1,0,0|3,0,0]=4 444 B11R2.106 OC1=CC=CC2=C1NC=C2 O30805 [0,0,0,1,0,0|1,0,2]=4 445 B11R2.106 OC1=CC=CC2=C1NN=C2 O30543 [0,0,0,1,0,0|2,0,1]=4 446 B9R1.7 CC1=CC=C(CCO)O1 P51657 [0,0,0,0,1,0|3,0,0]=4 447 B9R1.7 CC1=CSC(CCN)=N1 L20707 [0,0,0,0,1,0|3,0,0]=4 448 B9R1.7 CC1=NC(CCN)=CN1 O32293 [0,0,0,0,1,0|3,0,0]=4 449 B9R1.7 CC1=NOC(CCN)=C1 L19848 [0,0,0,0,1,0|3,0,0]=4 450 B9R1.7 CN1C=C(CCN)C=N1 O29786 [0,0,0,0,1,0|3,0,0]=4 451 B9R1.33 CC1=C(CCN)SC=N1 P37210 [0,0,0,0,1,0|3,0,0]=4 452 B8R1.2 BrCC1=CC=CN=C1 P36550 [2,0,0,0,0,0|2,0,0]=4 453 B8R1.2 ICC1=CC=CC=C1 P37031 [2,0,0,0,0,0|1,0,0]=3 454 B8R1.2 NCC1=CC=CN=N1 L21914 [2,0,0,0,0,0|2,0,0]=4 455 B8R1.2 NCC1=CC=NC=C1 O30621 [2,0,0,0,0,0|1,0,0]=3 456 B8R1.2 NCC1=CC=NC=N1 C-2474 [2,0,0,0,0,0|2,0,0]=4 457 B8R1.2 NCC1=CC=NC=N1 L13752 [2,0,0,0,0,0|2,0,0]=4 458 B8R1.2 NCC1=CC=NN=C1 C-3221 [2,0,0,0,0,0|2,0,0]=4 459 B8R1.2 NCC1=CC=NN=C1 C-3221-01 [2,0,0,0,0,0|2,0,0]=4 460 B8R1.2 NCC1=CN=CN=C1 C-3222 [2,0,0,0,0,0|2,0,0]=4 461 B8R1.2 NCC1=CN=CN=C1 L14043 [2,0,0,0,0,0|2,0,0]=4 462 B8R1.2 NCC1=NC=CC=N1 C-3224 [2,0,0,0,0,0|2,0,0]=4 463 B8R1.2 NCC1=NC=CC=N1 C-3224-1 [2,0,0,0,0,0|2,0,0]=4 464 B8R1.2 NCC1=NC=CN=C1 C-3223 [2,0,0,0,0,0|2,0,0]=4 465 B8R1.2 NCC1=NN=CC=C1 C-2473 [2,0,0,0,0,0|2,0,0]=4 466 B8R1.2 NNC1=CC=CN=C1 C-3227 [2,0,0,0,0,0|2,0,0]=4 467 B8R1.2 NNC1=CC=NC=C1 C-3226 [2,0,0,0,0,0|2,0,0]=4 468 B8R1.2 NNC1=CC=NC=C1 L19135 [2,0,0,0,0,0|2,0,0]=4 469 B8R1.2 NNC1=CC=NC=C1 O31964 [2,0,0,0,0,0|2,0,0]=4 470 B8R1.4 CC1=CN=CC(Br)=C1 G-7029 [2,0,0,0,0,0|1,1,0]=4 471 B8R1.4 CC1=CN=CC(F)=C1 P38200 [2,0,0,0,0,0|1,0,0]=3 472 B8R1.4 CC1=CN=CC(N)=C1 S70885 [2,0,0,0,0,0|2,0,0]=4 473 B8R1.4 CC1=CN=CC(O)=C1 O30725 [2,0,0,0,0,0|2,0,0]=4 474 B8R1.4 CC1=NC=CC(Cl)=C1 E-3106 [2,0,0,0,0,0|1,1,0]=4 475 B8R1.4 FC1=CC(I)=CN=C1 O30723 [2,0,0,0,0,0|2,0,0]=4 476 B8R1.4 FC1=NC=CC(I)=C1 E-3003 [2,0,0,0,0,0|2,0,0]=4 477 B8R1.4 NC1=CC(=O)NC=C1 C-3231 [2,0,0,0,0,0|2,0,0]=4 478 B8R1.4 NC1=CC(Br)=CC=N1 B-1202 [2,0,0,0,0,0|1,1,0]=4 479 B8R1.4 NC1=CC(Cl)=NC=C1 G-5361 [2,0,0,0,0,0|1,1,0]=4 480 B8R1.4 NC1=CC(F)=NC=C1 G-7585 [2,0,0,0,0,0|1,0,0]=3 481 B8R1.4 NC1=CC(F)=NC=N1 Q58616 [2,0,0,0,0,0|2,0,0]=4 482 B8R1.4 NC1=NC(Cl)=CC=C1 G-5936 [2,0,0,0,0,0|1,1,0]=4 483 B8R1.4 NC1=NC(F)=NC=C1 L18384 [2,0,0,0,0,0|2,0,0]=4 484 B8R1.4 NC1=NC(O)=CC=C1 Q68106 [2,0,0,0,0,0|2,0,0]=4 485 B8R1.4 NC1=NC=CC(F)=C1 A-621 [2,0,0,0,0,0|1,0,0]=3 486 B8R1.4 NC1=NC=CC(F)=N1 L14581 [2,0,0,0,0,0|2,0,0]=4 487 B8R1.4 NC1=NC=CC(I)=C1 G-6400 [2,0,0,0,0,0|1,1,0]=4 488 B8R1.4 NC1=NC=CC(O)=C1 E-3010 [2,0,0,0,0,0|2,0,0]=4 489 B8R1.4 O=C1C=CC=C(F)N1 F-4400 [2,0,0,0,0,0|2,0,0]=4 490 B8R1.4 OC1=CC(F)=NC=C1 E-3009 [2,0,0,0,0,0|2,0,0]=4 491 B8R1.4 OC1=CN=CC(F)=C1 E-3008 [2,0,0,0,0,0|2,0,0]=4 492 B8R1.4 OC1=NC=CC(F)=C1 S72531 [2,0,0,0,0,0|2,0,0]=4 493 B10R1.2 CC1=C(Br)C(CN)=CC=C1 P41922 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.2 CC1=C(Br)C=CC=C1CN P34928 [1,1,0,0,0,0|0,1,0]=3 495 B10R1.2 CC1=C(Br)C=CC=C1CO P35887 [1,1,0,0,0,0|1,1,0]=4 496 B10R1.2 CC1=C(CO)C=CC=C1Cl N24882 [1,1,0,0,0,0|1,1,0]=4 497 B10R1.2 CC1=C(CO)C=CN=C1F N27820 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.2 CC1=C(F)C(CO)=CC=C1 Q67892 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.2 CC1=C(O)C(CO)=CC=C1 P39563 [1,1,0,0,0,0|2,0,0]=4 500 B10R1.2 CCC1=CC=CC(C)=C1C O30455 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.2 CN1C=CC=C(CN)C1=O I-9789 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.2 CNC1=CC=CC(Br)=C1N O31477 [1,1,0,0,0,0|1,1,0]=4 503 B10R1.2 COC1=C(Br)C(O)=CC=C1 O31968 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.2 COC1=C(Cl)C(Br)=CC=C1 Q67395 [1,1,0,0,0,0|1,1,0]=4 505 B10R1.2 COC1=C(Cl)C(N)=CC=C1 L18399 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.2 COC1=C(Cl)C(N)=CC=C1 M24076 [1,1,0,0,0,0|2,0,0]=4 507 B10R1.2 COC1=C(F)C(C)=CC=C1 N25450 [1,1,0,0,0,0|2,0,0]=4 508 B10R1.2 COC1=C(N)C(N)=CC=C1 O34317 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.2 COC1=C(O)C(Br)=CC=C1 G-5963 [1,1,0,0,0,0|1,1,0]=4 510 B10R1.2 COC1=C(O)C(F)=CC=C1 Q66672 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.2 COC1=C(O)C(F)=CC=C1 Q67743 [1,1,0,0,0,0|1,0,0]=3 512 B10R1.2 COC1=CC=CC(Br)=C1Br Q67513 [1,1,0,0,0,0|1,1,0]=4 513 B10R1.2 COC1=CC=CC(Br)=C1C D-2572 [1,1,0,0,0,0|1,1,0]=4 514 B10R1.2 COC1=CC=CC(Br)=C1F Q67527 [1,1,0,0,0,0|1,1,0]=4 515 B10R1.2 COC1=CC=CC(Br)=C1I N24961 [1,1,0,0,0,0|1,1,0]=4 516 B10R1.2 COC1=CC=CC(F)=C1Cl N25141 [1,1,0,0,0,0|1,0,0]=3 517 B10R1.2 COC1=CC=CC(F)=C1I Q68123 [1,1,0,0,0,0|1,0,0]=3 518 B10R1.2 COC1=NC=CC(F)=C1Br Q62296 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.2 CSC1=C(Cl)C(Cl)=CC=C1 Q68599 [1,1,0,0,0,0|1,1,0]=4 520 B10R1.2 CSC1=C(Cl)C(F)=CC=C1 Q68532 [1,1,0,0,0,0|1,0,0]=3 521 B10R1.2 CSC1=C(F)C(F)=CC=C1 N25629 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.2 CSC1=CC=CC(Br)=C1F N25973 [1,1,0,0,0,0|1,1,0]=4 523 B10R1.2 CSC1=CC=CC(F)=C1O N27023 [1,1,0,0,0,0|1,0,0]=3 524 B10R1.2 CSC1=CC=CC(O)=C1F N25513 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.2 NC1=C(Br)C=CC=C1CO O32343 [1,1,0,0,0,0|1,1,0]=4 526 B10R1.2 NCC1=C(F)C(Br)=CC=N1 Q53096 [1,1,0,0,0,0|1,1,0]=4 527 B10R1.2 NCC1=C(F)C(Br)=CC=N1 Q53097 [1,1,0,0,0,0|1,1,0]=4 528 B10R1.2 NCC1=C(F)C(Cl)=CC=N1 Q53094 [1,1,0,0,0,0|1,1,0]=4 529 B10R1.2 NCC1=C(F)C(Cl)=CC=N1 Q53095 [1,1,0,0,0,0|1,1,0]=4 530 B10R1.2 NCC1=C(F)C(I)=CC=N1 Q53098 [1,1,0,0,0,0|1,1,0]=4 531 B10R1.2 NCC1=C(O)C(O)=CC=C1 P36464 [1,1,0,0,0,0|1,0,0]=3 532 B10R1.2 NCC1=CC=CC(Br)=C1Cl P42860 [1,1,0,0,0,0|0,1,0]=3 533 B10R1.2 OCC1=C(Br)C(F)=CC=C1 N25113 [1,1,0,0,0,0|1,0,0]=3 534 B10R1.2 OCC1=C(Cl)C(F)=CN=C1 N27780 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.2 OCC1=C(Cl)C(F)=NC=C1 Q67583 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.2 OCC1=CC=CC(Cl)=C1Br P42134 [1,1,0,0,0,0|1,1,0]=4 537 B10R1.2 OCC1=CC=CC(Cl)=C1Cl Q68410 [1,1,0,0,0,0|1,1,0]=4 538 B10R1.2 OCC1=CC=CC(Cl)=C1F Q68242 [1,1,0,0,0,0|1,1,0]=4 539 B10R1.2 OCC1=CC=CC(Cl)=C1O N27736 [1,1,0,0,0,0|1,1,0]=4 540 B10R1.2 OCC1=CC=CC(F)=C1I O31062 [1,1,0,0,0,0|1,0,0]=3 541 B10R1.2 OCC1=CC=CC(I)=C1F N26895 [1,1,0,0,0,0|1,1,0]=4 542 B10R1.8 C#CC1=CC(F)=CC(F)=C1 P41035 [1,1,0,0,0,0|0,0,2]=4 543 B10R1.8 CC1=CC(Br)=CC(CN)=C1 P43405 [1,1,0,0,0,0|0,1,0]=3 544 B10R1.8 CC1=CC(Br)=CC(CO)=C1 N24555 [1,1,0,0,0,0|1,1,0]=4 545 B10R1.8 CC1=CC(C)=CC(CO)=C1 Q67964 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.8 CC1=CC(CN)=CC(C)=N1 Q64114 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.8 CC1=CC(CN)=NC(C)=C1 O29514 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.8 CC1=CC(CN)=NC(C)=C1 O31552 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.8 CC1=CC(Cl)=CC(CO)=C1 N26490 [1,1,0,0,0,0|1,1,0]=4 550 B10R1.8 CC1=CC(F)=CC(CCl)=N1 Q56662 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.8 CC1=CC(I)=CC(CO)=C1 O29298 [1,1,0,0,0,0|1,1,0]=4 552 B10R1.8 CCC1=CC(Br)=CC(Br)=C1 Q67820 [1,1,0,0,0,0|0,1,0]=3 553 B10R1.8 CNC1=CC(Cl)=CC(Cl)=C1 P38142 [1,1,0,0,0,0|1,1,0]=4 554 B10R1.8 CNC1=CC(F)=CC(Br)=C1 N25920 [1,1,0,0,0,0|1,0,0]=3 555 B10R1.8 COC1=CC(Br)=CC(Br)=C1 F-4625 [1,1,0,0,0,0|1,1,0]=4 556 B10R1.8 COC1=CC(Br)=CC(N)=C1 O31171 [1,1,0,0,0,0|1,1,0]=4 557 B10R1.8 COC1=CC(Br)=CC(O)=C1 N25535 [1,1,0,0,0,0|1,1,0]=4 558 B10R1.8 COC1=CC(Br)=NC(F)=C1 Q62369 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.8 COC1=CC(C)=CC(F)=C1 Q67673 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.8 COC1=CC(F)=CC(O)=C1 Q67667 [1,1,0,0,0,0|1,0,0]=3 561 B10R1.8 COC1=CC(F)=NC(F)=C1 Q56250 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.8 COC1=CC(O)=CC(Cl)=C1 N24186 [1,1,0,0,0,0|1,1,0]=4 563 B10R1.8 CSC1=CC(Br)=CC(Br)=C1 Q67818 [1,1,0,0,0,0|1,1,0]=4 564 B10R1.8 CSC1=CC(C)=CC(C)=C1 Q67824 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.8 CSC1=CC(Cl)=CC(Br)=C1 N26848 [1,1,0,0,0,0|1,1,0]=4 566 B10R1.8 CSC1=CC(F)=CC(Br)=C1 Q67817 [1,1,0,0,0,0|1,0,0]=3 567 B10R1.8 CSC1=CC(F)=CC(Cl)=C1 N25740 [1,1,0,0,0,0|1,0,0]=3 568 B10R1.8 CSC1=CC(F)=CC(F)=C1 N24619 [1,1,0,0,0,0|1,0,0]=3 569 B10R1.8 CSC1=CC(F)=CC(O)=C1 N27715 [1,1,0,0,0,0|1,0,0]=3 570 B10R1.8 ClC1=CC(Cl)=CC(CBr)=C1 O32631 [1,1,0,0,0,0|1,1,0]=4 571 B10R1.8 NCC1=CC(Cl)=NC(Cl)=C1 O30535 [1,1,0,0,0,0|1,1,0]=4 572 B10R1.8 NCC1=CC(Cl)=NC(Cl)=C1 P51195 [1,1,0,0,0,0|1,1,0]=4 573 B10R1.8 NCC1=NC(Cl)=CC(Br)=C1 Q52675 [1,1,0,0,0,0|1,1,0]=4 574 B10R1.8 NCC1=NC(Cl)=CC(Cl)=C1 Q52648 [1,1,0,0,0,0|1,1,0]=4 575 B10R1.8 NNC1=CC(Br)=CC(Br)=C1 Q69185 [1,1,0,0,0,0|1,1,0]=4 576 B10R1.8 OC1=CC(O)=CC(CBr)=C1 P38735 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.8 OCC1=CC(Br)=CC(Br)=C1 Q67938 [1,1,0,0,0,0|1,1,0]=4 578 B10R1.8 OCC1=CC(Cl)=CC(Br)=C1 Q67835 [1,1,0,0,0,0|1,1,0]=4 579 B10R1.8 OCC1=CC(F)=CC(Br)=C1 P39698 [1,1,0,0,0,0|1,0,0]=3 580 B10R1.8 OCC1=CC(F)=CC(Cl)=C1 Q68066 [1,1,0,0,0,0|1,0,0]=3 581 B10R1.30 CC1=CC=C(Br)C(CO)=C1 N24927 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.30 CC1=CC=C(Br)C=C1CO O34085 [1,1,0,0,0,0|1,1,0]=4 583 B10R1.30 CC1=CC=C(C)C(CO)=C1 P37558 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.30 CC1=CC=C(Cl)C=C1CO P37211 [1,1,0,0,0,0|1,1,0]=4 585 B10R1.30 CC1=CC=C(F)C(CN)=N1 O31042 [1,1,0,0,0,0|2,0,0]=4 586 B10R1.30 CC1=CC=C(F)C(CO)=C1 Q68220 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.30 CC1=CC=C(F)C=C1CO Q67532 [1,1,0,0,0,0|1,0,0]=3 588 B10R1.30 CC1=CC=C(O)C(CO)=C1 N26156 [1,1,0,0,0,0|2,0,0]=4 589 B10R1.30 CC1=CC=C(O)C=C1CO N24525 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.30 CC1=CN=C(Cl)C(CN)=C1 O29663 [1,1,0,0,0,0|2,0,0]=4 591 B10R1.30 CC1=CN=C(Cl)C(CN)=C1 O31277 [1,1,0,0,0,0|2,0,0]=4 592 B10R1.30 CC1=CNC(=O)C(CN)=C1 Q58409 [1,1,0,0,0,0|2,0,0]=4 593 B10R1.30 CCC1=C(O)C=CC(Br)=C1 N24526 [1,1,0,0,0,0|0,1,0]=3 594 B10R1.30 CCC1=CC(Br)=CC=C1Cl Q66646 [1,1,0,0,0,0|0,1,0]=3 595 B10R1.30 CCC1=CC(Br)=CN=C1N O32561 [1,1,0,0,0,0|1,1,0]=4 596 B10R1.30 CCC1=CC(F)=CC=C1N O29402 [1,1,0,0,0,0|0,0,0]=2 597 B10R1.30 CNC1=CC(Br)=CC=C1N O31722 [1,1,0,0,0,0|1,1,0]=4 598 B10R1.30 COC1=C(C)C=CC(O)=C1 N24341 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.30 COC1=C(Cl)C=CC(O)=C1 N24761 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.30 COC1=CC(Br)=CC=C1I Q67115 [1,1,0,0,0,0|1,1,0]=4 601 B10R1.30 COC1=CC(C)=CC=C1Br Q66623 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.30 COC1=CC(Cl)=CC=C1N O30871 [1,1,0,0,0,0|1,1,0]=4 603 B10R1.30 COC1=CC(F)=CC=C1I N24671 [1,1,0,0,0,0|1,0,0]=3 604 B10R1.30 COC1=CC(F)=CC=C1N Q65477 [1,1,0,0,0,0|1,0,0]=3 605 B10R1.30 COC1=CC(F)=CN=C1Br O29528 [1,1,0,0,0,0|2,0,0]=4 606 B10R1.30 COC1=CC(O)=CC=C1Br Q67374 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.30 CSC1=C(C)C=CC(Br)=C1 N24432 [1,1,0,0,0,0|1,1,0]=4 608 B10R1.30 CSC1=CC(Br)=CC=C1Br N24626 [1,1,0,0,0,0|1,1,0]=4 609 B10R1.30 CSC1=CC(Br)=CC=C1F Q67732 [1,1,0,0,0,0|1,1,0]=4 610 B10R1.30 CSC1=CC(C)=CC=C1Br N27752 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.30 CSC1=CC(C)=CC=C1Cl N27754 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.30 CSC1=CC(C)=CC=C1F N27723 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.30 CSC1=CC(F)=CN=C1Br O30944 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.30 CSC1=CC(I)=CC=C1Br N24878 [1,1,0,0,0,0|1,1,0]=4 615 B10R1.30 ClC1=CC=C(Br)C=C1CBr O32711 [1,1,0,0,0,0|1,1,0]=4 616 B10R1.30 FC1=NC(CBr)=C(Br)C=C1 N26383 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.30 N#CC1=CC(F)=CC=C1Cl Q68121 [1,1,0,0,0,0|0,0,2]=4 618 B10R1.30 N#CC1=CC(F)=CC=C1I P51288 [1,1,0,0,0,0|0,0,2]=4 619 B10R1.30 NC1=CC=C(Br)C=C1CO G-7692 [1,1,0,0,0,0|1,1,0]=4 620 B10R1.30 NCC1=CC(Br)=CN=C1Cl O29649 [1,1,0,0,0,0|1,1,0]=4 621 B10R1.30 NCC1=CC(Br)=CN=C1Cl Q62471 [1,1,0,0,0,0|1,1,0]=4 622 B10R1.30 NCC1=CC(Br)=CN=C1F O31257 [1,1,0,0,0,0|1,1,0]=4 623 B10R1.30 NCC1=CC(Br)=CN=C1F Q51929 [1,1,0,0,0,0|1,1,0]=4 624 B10R1.30 NCC1=CC(Cl)=CN=C1O O31303 [1,1,0,0,0,0|1,1,0]=4 625 B10R1.30 NCC1=CC(F)=CN=C1Br O29617 [1,1,0,0,0,0|1,0,0]=3 626 B10R1.30 NCC1=CC(F)=CN=C1Cl O29653 [1,1,0,0,0,0|1,0,0]=3 627 B10R1.30 NCC1=CC(F)=NC=C1F H-8374 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.30 O=C1C=CC(=O)C(CO)=C1 P43227 [1,1,0,0,0,0|2,0,0]=4 629 B10R1.30 OCC1=C(F)C=CC(I)=C1 N27718 [1,1,0,0,0,0|1,1,0]=4 630 B10R1.30 OCC1=CC(Cl)=CC=C1F P40230 [1,1,0,0,0,0|1,1,0]=4 631 B10R1.30 OCC1=CC(F)=NC=C1Br N27812 [1,1,0,0,0,0|2,0,0]=4 632 B10R1.30 OCC1=CC(F)=NC=C1F H-8388 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.113 C=C(C)C1=CC(C)=CC=C1 P42602 [1,1,0,0,0,0|1,0,1]=4 634 B10R1.113 CC(=O)C1=CC(F)=CN=C1 P43295 [1,1,0,0,0,0|1,0,1]=4 635 B10R1.113 CC(C)C1=CC(Cl)=NC=C1 Q52823 [1,1,0,0,0,0|1,1,0]=4 636 B10R1.113 CC(C)C1=CC(O)=NC=C1 Q52824 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.113 CC(C)C1=CC=CC(I)=N1 N26566 [1,1,0,0,0,0|1,1,0]=4 638 B10R1.113 CC(C)C1=CN=CC(O)=C1 Q52825 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.113 CC(N)C1=CC(N)=CC=C1 P41777 [1,1,0,0,0,0|1,0,0]=3 640 B10R1.113 CC(N)C1=CC(O)=CC=C1 P36908 [1,1,0,0,0,0|1,0,0]=3 641 B10R1.113 CC(N)C1=CC=CC(Br)=C1 O34417 [1,1,0,0,0,0|0,1,0]=3 642 B10R1.113 CC(N)C1=CC=CC(Br)=C1 P36288 [1,1,0,0,0,0|0,1,0]=3 643 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 P39424 [1,1,0,0,0,0|0,1,0]=3 644 B10R1.113 CC(N)C1=CC=CC(F)=C1 P36296 [1,1,0,0,0,0|0,0,0]=2 645 B10R1.113 CC(N)C1=CN=CC(F)=C1 Q58352 [1,1,0,0,0,0|1,0,0]=3 646 B10R1.113 CC(N)C1=CN=CC(F)=C1 Q58353 [1,1,0,0,0,0|1,0,0]=3 647 B10R1.113 CC(O)C1=CC(Cl)=NC=C1 P42079 [1,1,0,0,0,0|1,1,0]=4 648 B10R1.113 CC(O)C1=NC=CC(Br)=C1 Q53431 [1,1,0,0,0,0|1,1,0]=4 649 B10R1.113 CC1=CC(C(C)N)=CC=C1 O30538 [1,1,0,0,0,0|1,0,0]=3 650 B10R1.113 CC1=CC(C(C)N)=CC=C1 P36543 [1,1,0,0,0,0|1,0,0]=3 651 B10R1.113 CC1=NC([C@@H](C)N)=CC=C1 Q58193 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.113 CC1=NC([C@H](C)N)=CC=C1 Q58196 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.113 CN(C)C1=CC=CC(F)=C1 P39813 [1,1,0,0,0,0|1,0,0]=3 654 B10R1.113 C[C@@H](N)C1=CC(Cl)=NC=C1 F-4328 [1,1,0,0,0,0|1,1,0]=4 655 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 O29507 [1,1,0,0,0,0|1,1,0]=4 656 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 P43499 [1,1,0,0,0,0|1,0,0]=3 657 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 P51333 [1,1,0,0,0,0|0,1,0]=3 658 B10R1.113 NC(=O)C1=CC(F)=CN=C1 P36523 [1,1,0,0,0,0|1,0,1]=4 659 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 P37042 [1,1,0,0,0,0|0,1,1]=4 660 B10R1.172 C#CC1=CC(CN)=CC=C1 M22910 [1,1,0,0,0,0|1,0,0]=3 661 B10R1.172 C#CC1=CC(NC)=CC=C1 M22825 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.172 C#CC1=CC=CC(SC)=C1 L20201 [1,1,0,0,0,0|2,0,0]=4 663 B10R1.172 CCC1=CC(C=O)=CC=C1 Q67834 [1,1,0,0,0,0|1,0,0]=3 664 B10R1.172 CCC1=CC=CC(C#N)=N1 Q52057 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.172 CCC1=CC=CC(CC)=N1 O30631 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.172 CCC1=CC=CC(CO)=C1 N25577 [1,1,0,0,0,0|1,0,0]=3 667 B10R1.172 CCC1=CC=CC(SC)=C1 N25802 [1,1,0,0,0,0|1,0,0]=3 668 B10R1.172 CCC1=NC(C=O)=CC=C1 Q60374 [1,1,0,0,0,0|2,0,0]=4 669 B10R1.172 CCC1=NC(OC)=CC=C1 N25274 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.172 COC1=CC(CN)=CC=N1 C-3608 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.172 COC1=CC(CN)=NC=C1 O31065 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.172 COC1=CC(CN)=NC=C1 P40117 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.172 COC1=CC=CC(CN)=N1 O30234 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.172 COC1=CC=CC(CN)=N1 O30597 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.172 COC1=CN=CC(CN)=C1 G-7874 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.172 COC1=NC=CC(CN)=C1 O30315 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.172 N#CC1=CC(CN)=CC=N1 Q58481 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.172 N#CC1=CC=CC(CN)=C1 P42879 [1,1,0,0,0,0|1,0,0]=3 679 B10R1.172 N#CC1=CC=CC(NN)=C1 O31167 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.172 NCC1=CC=CC(CO)=N1 O29765 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.172 O=CC1=CC=CC(CO)=C1 O34201 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.172 OCC1=CC=CC(CBr)=C1 P35928 [1,1,0,0,0,0|1,1,0]=4 683 B10R1.172 OCC1=CC=CC(CCl)=C1 P40497 [1,1,0,0,0,0|1,1,0]=4 684 B10R1.176 C#CC1=CC=C(F)C(F)=C1 P41247 [1,1,0,0,0,0|0,0,2]=4 685 B10R1.176 C#CC1=CC=C(N)C(F)=C1 P43098 [1,1,0,0,0,0|0,0,2]=4 686 B10R1.176 C=CC1=CC=C(F)C(F)=C1 P38224 [1,1,0,0,0,0|0,0,2]=4 687 B10R1.176 CC1=C(Cl)C=CC(CN)=C1 A-961 [1,1,0,0,0,0|1,0,0]=3 688 B10R1.176 CC1=C(Cl)C=CC(CO)=C1 N25889 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.176 CC1=C(Cl)N=CC(CN)=C1 O31410 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.176 CC1=CC(CN)=CC=C1Br P41109 [1,1,0,0,0,0|1,0,0]=3 691 B10R1.176 CC1=CC(CN)=CN=C1Cl N26394 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.176 CC1=CC(CN)=NC=C1Br O31342 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.176 CC1=CC(CO)=CC=C1Br N24431 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.176 CC1=CC=C(CO)C=C1Br Q67930 [1,1,0,0,0,0|1,1,0]=4 695 B10R1.176 CC1=NC(CN)=CC=C1O Q62258 [1,1,0,0,0,0|2,0,0]=4 696 B10R1.176 CCC1=CC=C(F)C(Br)=C1 N24841 [1,1,0,0,0,0|0,1,0]=3 697 B10R1.176 CCC1=CC=C(N)C(F)=C1 O34054 [1,1,0,0,0,0|0,0,0]=2 698 B10R1.176 CN1C=C(CN)C=CC1=O L22212 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.176 CN1C=C(CN)C=CC1=O Q51823 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.176 CN1C=CC(CN)=CC1=O C-3606 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.176 CN1C=CC(CN)=CC1=O G-6746 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.176 COC1=CC=C(Br)C(I)=C1 Q68050 [1,1,0,0,0,0|1,1,0]=4 703 B10R1.176 COC1=CC=C(Br)C(O)=C1 Q66993 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.176 COC1=CC=C(C)C(Br)=C1 N24125 [1,1,0,0,0,0|1,1,0]=4 705 B10R1.176 COC1=CC=C(C)C(F)=C1 Q67079 [1,1,0,0,0,0|1,0,0]=3 706 B10R1.176 COC1=CC=C(C)C(O)=C1 Q67987 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.176 COC1=CC=C(F)C(I)=C1 N24584 [1,1,0,0,0,0|1,1,0]=4 708 B10R1.176 COC1=CC=C(F)C(O)=C1 Q67529 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.176 COC1=CC=C(I)C(Br)=C1 Q67866 [1,1,0,0,0,0|1,1,0]=4 710 B10R1.176 COC1=CC=C(N)C(I)=C1 Q52916 [1,1,0,0,0,0|1,1,0]=4 711 B10R1.176 COC1=CC=C(N)C(O)=C1 M15200 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.176 COC1=CC=C(N)C(O)=C1 M15201 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.176 COC1=CC=C(O)C(C)=C1 Q67705 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.176 COC1=CN=C(Br)C(F)=C1 O29400 [1,1,0,0,0,0|2,0,0]=4 715 B10R1.176 COC1=NC=C(Br)C(F)=C1 P49377 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.176 CSC1=CC(F)=C(F)C=C1 N24442 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.176 CSC1=CC(O)=C(C)C=C1 N26961 [1,1,0,0,0,0|2,0,0]=4 718 B10R1.176 CSC1=CC(O)=C(F)C=C1 N27741 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.176 CSC1=CC=C(Br)C(C)=C1 N24368 [1,1,0,0,0,0|2,0,0]=4 720 B10R1.176 CSC1=CC=C(Br)C(F)=C1 N24385 [1,1,0,0,0,0|1,0,0]=3 721 B10R1.176 CSC1=CC=C(O)C(C)=C1 N24608 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.176 CSC1=CN=C(Br)C(F)=C1 O31247 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.176 FC1=CC(CCl)=CN=C1Cl O29750 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.176 NC1=CC=C(CO)C=C1Cl O27969 [1,1,0,0,0,0|1,1,0]=4 725 B10R1.176 NCC1=CC(Br)=C(Cl)N=C1 O29516 [1,1,0,0,0,0|1,1,0]=4 726 B10R1.176 NCC1=CC(Cl)=C(Cl)N=C1 O29515 [1,1,0,0,0,0|1,1,0]=4 727 B10R1.176 NCC1=CC(Cl)=C(Cl)N=C1 O31357 [1,1,0,0,0,0|1,1,0]=4 728 B10R1.176 NCC1=CC=C(Cl)C(F)=C1 P36420 [1,1,0,0,0,0|0,0,0]=2 729 B10R1.176 NCC1=CN=C(O)C(Br)=C1 P43424 [1,1,0,0,0,0|1,1,0]=4 730 B10R1.176 NCC1=CN=C(O)C(Cl)=C1 O29589 [1,1,0,0,0,0|1,1,0]=4 731 B10R1.176 NCC1=NC(Cl)=C(Cl)C=C1 P46505 [1,1,0,0,0,0|1,1,0]=4 732 B10R1.176 NCC1=NC(Cl)=C(Cl)C=C1 Q62451 [1,1,0,0,0,0|1,1,0]=4 733 B10R1.176 OCC1=CC(O)=C(F)C=C1 N25036 [1,1,0,0,0,0|2,0,0]=4 734 B10R1.176 OCC1=CC=C(Br)C(Cl)=C1 Q67931 [1,1,0,0,0,0|1,1,0]=4 735 B10R1.176 OCC1=CC=C(Cl)C(O)=C1 N25640 [1,1,0,0,0,0|2,0,0]=4 736 B10R1.176 OCC1=CC=C(O)C(Br)=C1 Q68849 [1,1,0,0,0,0|1,1,0]=4 737 B10R1.1 BrC1=CC=C(CCI)C=C1 P35777 [1,1,0,0,0,0|1,0,0]=3 738 B10R1.1 BrCCC1=CC=C(Br)C=C1 P40516 [1,1,0,0,0,0|1,0,0]=3 739 B10R1.1 CC1=CC=C(CCN)N=C1 Q58444 [1,1,0,0,0,0|1,0,0]=3 740 B10R1.1 CC1=CN=C(CCN)N=C1 Q58694 [1,1,0,0,0,0|2,0,0]=4 741 B10R1.1 CCCC1=CC=C(N)N=C1 Q52924 [1,1,0,0,0,0|2,0,0]=4 742 B10R1.1 CCNC1=CC=C(Br)C=C1 P36614 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.1 CCNC1=CC=C(Cl)C=C1 P41554 [1,1,0,0,0,0|2,0,0]=4 744 B10R1.1 CCNC1=CC=C(F)C=C1 O32514 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.1 CCNC1=CC=C(N)C=C1 P37237 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.1 CCOC1=CC=C(F)C=C1 M23303 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.1 CNCC1=CC=C(Cl)C=C1 P42874 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.1 CNCC1=CC=C(N)C=C1 P38425 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.1 CNCC1=CC=C(O)C=C1 P36065 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.1 COCC1=CC=C(Br)C=C1 Q67196 [1,1,0,0,0,0|2,0,0]=4 751 B10R1.1 FC1=CC=C(CCBr)C=C1 I-9285 [1,1,0,0,0,0|1,0,0]=3 752 B10R1.1 NCCC1=CC=C(Cl)N=C1 P37543 [1,1,0,0,0,0|1,0,0]=3 753 B10R1.1 NCCC1=CC=C(F)C=N1 Q58446 [1,1,0,0,0,0|1,0,0]=3 754 B10R1.1 NCCC1=CC=C(I)C=C1 P36354 [1,1,0,0,0,0|0,0,0]=2 755 B10R1.1 NCCC1=CN=C(Cl)N=C1 Q65338 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.1 NCCC1=CN=C(Cl)N=C1 Q65339 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.1 NCCC1=NC=C(Br)C=C1 G-5600 [1,1,0,0,0,0|1,0,0]=3 758 B10R1.1 NNCC1=CC=C(Br)C=C1 C-3250 [1,1,0,0,0,0|1,0,0]=3 759 B10R1.1 NNCC1=CC=C(Br)C=C1 I-9319 [1,1,0,0,0,0|1,0,0]=3 760 B10R1.1 NNCC1=CC=C(Cl)C=C1 C-3251 [1,1,0,0,0,0|1,0,0]=3 761 B10R1.1 NNCC1=CC=C(Cl)C=C1 Q51808 [1,1,0,0,0,0|1,0,0]=3 762 B10R1.1 NNCC1=CC=C(F)C=C1 C-3247 [1,1,0,0,0,0|1,0,0]=3 763 B10R1.1 NOCC1=CC=C(Cl)C=C1 O31868 [1,1,0,0,0,0|1,0,0]=3 764 B10R1.1 NOCC1=CC=C(F)C=C1 10767 [1,1,0,0,0,0|1,0,0]=3 765 B10R1.1 OCCC1=NC=C(Br)C=C1 G-5598 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.1 OCCC1=NC=C(F)C=C1 O33379 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.4 BrCCC1=CC=CC=C1Br O28100 [1,1,0,0,0,0|1,0,0]=3 768 B10R1.4 CC1=CC=CC=C1CCBr O28115 [1,1,0,0,0,0|1,0,0]=3 769 B10R1.4 CC1=CC=CN=C1CCN P35791 [1,1,0,0,0,0|1,0,0]=3 770 B10R1.4 CCCC1=C(C)C=CN=C1 N27219 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.4 CCNC1=CC=CC=C1Br P36583 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.4 CCNC1=CC=CC=C1Cl P41555 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.4 CCNC1=CC=CC=C1F P39148 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.4 CCNC1=CC=CC=C1N P39464 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.4 CNCC1=CC=CC=C1C P35580 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.4 CNCC1=CC=CC=C1N P40191 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.4 COCC1=CC=CC=C1Br Q67462 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.4 NC1=C(CCF)C=NC=C1 Q65355 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.4 NCCC1=C(Br)C=CC=N1 L13097 [1,1,0,0,0,0|1,0,0]=3 780 B10R1.4 NCCC1=CC=CC=C1N P42500 [1,1,0,0,0,0|0,0,0]=2 781 B10R1.4 NCCC1=CC=CC=C1O M22991 [1,1,0,0,0,0|0,0,0]=2 782 B10R1.4 NCCC1=NC=CC=C1F Q58445 [1,1,0,0,0,0|1,0,0]=3 783 B10R1.4 NCCN1C=CC=NC1=O L18972 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.4 NCCN1N=CC=CC1=O L20650 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.4 NNCC1=C(Br)C=CC=C1 G-5141 [1,1,0,0,0,0|1,0,0]=3 786 B10R1.4 NNCC1=C(Br)C=CC=C1 Q51807 [1,1,0,0,0,0|1,0,0]=3 787 B10R1.4 NNCC1=C(Cl)C=CC=C1 C-3252 [1,1,0,0,0,0|1,0,0]=3 788 B10R1.4 NNCC1=C(F)C=CC=C1 C-3249 [1,1,0,0,0,0|1,0,0]=3 789 B10R1.4 OC1=CC=CC=C1CCBr P37343 [1,1,0,0,0,0|1,0,0]=3 790 B10R1.4 OCCC1=C(Cl)C=NC=C1 Q69549 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.4 OCCC1=CC=CC=C1O P36102 [1,1,0,0,0,0|1,0,0]=3 792 B10R1.4 OCCC1=NC=CC=C1F L14825 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.15 CCC(N)C1=CC=CC=C1 P39015 [1,1,0,0,0,0|1,0,0]=3 794 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 P40939 [1,1,0,0,0,0|1,0,0]=3 795 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 P40176 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.15 CN[C@H](C)C1=CC=CC=C1 P37197 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.15 N=C(NN)C1=CC=CC=C1 O30004 [1,1,0,0,0,0|1,0,1]=4 798 B10R1.15 NC(CO)C1=CC=NC=C1 Q53510 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.15 NCC(N)C1=CC=CC=C1 P40726 [1,1,0,0,0,0|0,0,0]=2 800 B10R1.15 NCC(O)C1=CC=CN=C1 O32747 [1,1,0,0,0,0|1,0,0]=3 801 B10R1.15 NCC(O)C1=CC=CN=C1 P43089 [1,1,0,0,0,0|1,0,0]=3 802 B10R1.15 NCC(O)C1=CC=NC=C1 P35258 [1,1,0,0,0,0|1,0,0]=3 803 B10R1.15 NCC(O)C1=NC=CC=C1 P35259 [1,1,0,0,0,0|1,0,0]=3 804 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 P43243 [1,1,0,0,0,0|0,0,0]=2 805 B10R1.15 NC[C@H](O)C1=CC=CC=C1 P43317 [1,1,0,0,0,0|0,0,0]=2 806 B10R1.15 OC(CCl)C1=CC=CN=C1 O32660 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.17 C#CCOC1=CC=CC=C1 P41520 [1,1,0,0,0,0|1,0,1]=4 808 B10R1.17 C=COCC1=CC=CC=C1 I-9956 [1,1,0,0,0,0|1,0,1]=4 809 B10R1.17 CCCCC1=CC=NC=C1 O30545 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.17 CNCCC1=CC=CC=C1 P37213 [1,1,0,0,0,0|0,0,0]=2 811 B10R1.17 CNCCC1=CC=NC=C1 P37446 [1,1,0,0,0,0|1,0,0]=3 812 B10R1.17 CNCCC1=NC=CC=C1 P40087 [1,1,0,0,0,0|1,0,0]=3 813 B10R1.17 ICCCC1=CC=CC=C1 P38180 [1,1,0,0,0,0|1,0,0]=3 814 B10R1.17 NCC#CC1=CC=CC=N1 Q58471 [1,1,0,0,0,0|1,0,1]=4 815 B10R1.17 NCC#CC1=CC=CC=N1 Q58472 [1,1,0,0,0,0|1,0,1]=4 816 B10R1.17 NCCCC1=CC=NC=C1 P38929 [1,1,0,0,0,0|1,0,0]=3 817 B10R1.17 NCCNC1=NC=CC=C1 P34736 [1,1,0,0,0,0|1,0,0]=3 818 B10R1.17 NCCNC1=NC=CC=C1 P36299 [1,1,0,0,0,0|1,0,0]=3 819 B10R1.17 NCCOC1=CC=CN=C1 O34354 [1,1,0,0,0,0|1,0,0]=3 820 B10R1.17 NCCOC1=CC=NC=C1 P51450 [1,1,0,0,0,0|1,0,0]=3 821 B10R1.17 NCCOC1=NC=CC=C1 O34316 [1,1,0,0,0,0|1,0,0]=3 822 B10R1.17 NC\C=C\C1=CC=CN=C1 Q58489 [1,1,0,0,0,0|1,0,1]=4 823 B10R1.17 NNCCC1=CC=NC=C1 Q58254 [1,1,0,0,0,0|1,0,0]=3 824 B10R1.17 O=CCCC1=CC=NC=C1 Q60378 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.17 O=CCOC1=CC=CC=C1 K12296 [1,1,0,0,0,0|1,0,1]=4 826 B10R1.17 OCCCC1=NC=CC=C1 P39056 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.18 NC(=S)CC1=CC=NC=C1 Q58253 [1,1,0,0,0,0|1,0,1]=4 828 B10R1.187 NCCN1C(=O)C=CC1=O 10101 [0,1,0,0,1,0|2,0,0]=4 829 B10R1.187 NCCN1C(=O)C=CC1=O M23142 [0,1,0,0,1,0|2,0,0]=4 830 B12R1.24 CCC(=O)C1=CC=CC(F)=C1I O32085 [0,2,0,0,0,0|1,0,1]=4 831 B12R1.24 NCC(O)C1=CC=CC(Cl)=C1Cl P41636 [0,2,0,0,0,0|0,1,0]=3 832 B12R1.25 COCOC1=C(Br)C(F)=CC=C1 Q68019 [0,2,0,0,0,0|2,0,0]=4 833 B12R1.25 COCOC1=C(F)C(F)=CC=C1 Q67401 [0,2,0,0,0,0|2,0,0]=4 834 B12R1.25 COCOC1=CC=CC(F)=C1C Q66753 [0,2,0,0,0,0|2,0,0]=4 835 B12R1.25 NCCCC1=C(O)C(O)=CC=C1 P36042 [0,2,0,0,0,0|1,0,0]=3 836 B12R1.25 NCCOC1=CC=CC(Cl)=C1Cl P36654 [0,2,0,0,0,0|0,1,0]=3 837 B12R1.25 OCCCC1=CC=CC(F)=C1F P42804 [0,2,0,0,0,0|1,0,0]=3 838 B12R1.40 CCOC1=CC(Br)=CC(F)=C1F O29201 [0,2,0,0,0,0|2,0,0]=4 839 B12R1.224 CC(C)OC1=C(F)C(F)=CC=C1 Q67485 [0,2,0,0,0,0|2,0,0]=4 840 B12R1.497 CCOC1=C(Br)C=CC(F)=C1F N26964 [0,2,0,0,0,0|2,0,0]=4 841 B12R1.497 CCOC1=C(Cl)C(F)=CC=C1Br Q68560 [0,2,0,0,0,0|2,0,0]=4 842 B12R1.544 FC1=C(F)C(F)=C(CCBr)C=C1 L21645 [0,2,0,0,0,0|1,0,0]=3 843 B12R1.10 CCC(C)(N)C1=CC=CC(Cl)=C1 M22935 [0,2,0,0,0,0|1,1,0]=4 844 B12R1.13 COC(C#N)C1=CC(F)=CC=C1 L19078 [0,2,0,0,0,0|0,0,2]=4 845 B12R1.13 OCC(CO)C1=CC=CC(Br)=C1 P36126 [0,2,0,0,0,0|1,1,0]=4 846 B12R1.17 CC1=CC(C(N)CCO)=CC=C1 P36619 [0,2,0,0,0,0|2,0,0]=4 847 B12R1.17 CCCC(=O)C1=CC=CC(Cl)=C1 P39716 [0,2,0,0,0,0|1,1,0]=4 848 B12R1.17 N#CCC(=O)C1=CC=CC(F)=C1 P39701 [0,2,0,0,0,0|0,0,2]=4 849 B12R1.17 NC(CCO)C1=CC=CC(Br)=C1 P36053 [0,2,0,0,0,0|1,1,0]=4 850 B12R1.17 NC(CCO)C1=CC=CC(Cl)=C1 O30501 [0,2,0,0,0,0|1,1,0]=4 851 B12R1.17 NC(CCO)C1=CC=CC(F)=C1 P36600 [0,2,0,0,0,0|1,0,0]=3 852 B12R1.17 N[C@@H](CCO)C1=CC=CC(Cl)=C1 P42271 [0,2,0,0,0,0|1,1,0]=4 853 B12R1.17 N[C@@H](CCO)C1=CC=CC(F)=C1 P42264 [0,2,0,0,0,0|1,0,0]=3 854 B12R1.17 N[C@H](CCO)C1=CC=CC(Cl)=C1 P42256 [0,2,0,0,0,0|1,1,0]=4 855 B12R1.17 OCC[C@H](O)C1=CC=CC(Cl)=C1 Q69139 [0,2,0,0,0,0|1,1,0]=4 856 B12R1.225 CC(N)C(O)C1=CC(O)=CC=C1 L20369 [0,2,0,0,0,0|1,0,0]=3 857 B12R1.225 NC(C(=O)O)C1=CC=CC(F)=C1 P36389 [0,2,0,0,0,0|1,0,1]=4 858 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 P39302 [0,2,0,0,0,0|1,0,1]=4 859 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(F)=C1 P40985 [0,2,0,0,0,0|1,0,1]=4 860 B12R1.225 O=C(O)C(O)C1=CC=CC(F)=C1 P38344 [0,2,0,0,0,0|1,0,1]=4 861 B12R1.354 NCC(O)C1=CC(F)=CC=C1F P41635 [0,2,0,0,0,0|0,0,0]=2 862 B12R1.358 NC(CO)C1=CC(Cl)=CC(Cl)=C1 P38474 [0,2,0,0,0,0|1,1,0]=4 863 B12R1.358 NC(CO)C1=CC(F)=CC(F)=C1 P38381 [0,2,0,0,0,0|1,0,0]=3 864 B12R1.358 NCC(=O)C1=CC(F)=CC(F)=C1 P42401 [0,2,0,0,0,0|0,0,1]=3 865 B12R1.358 NCC(O)C1=CC(F)=CC(F)=C1 P41634 [0,2,0,0,0,0|0,0,0]=2 866 B12R1.367 CC1=CC=C(C(N)CO)C=C1C P35197 [0,2,0,0,0,0|2,0,0]=4 867 B12R1.367 CC1=CC=C(C(O)CN)C=C1C P36058 [0,2,0,0,0,0|1,0,0]=3 868 B12R1.367 NC(CO)C1=CC=C(Cl)C(F)=C1 P42063 [0,2,0,0,0,0|1,0,0]=3 869 B12R1.367 NC(CO)C1=CC=C(F)C(Cl)=C1 P35017 [0,2,0,0,0,0|1,1,0]=4 870 B12R1.367 NC(CO)C1=CC=C(F)C(F)=C1 P39677 [0,2,0,0,0,0|1,0,0]=3 871 B12R1.367 NCC(=O)C1=CC=C(Cl)C(Cl)=C1 P38157 [0,2,0,0,0,0|0,1,1]=4 872 B12R1.367 NCC(=O)C1=CC=C(F)C(F)=C1 P42286 [0,2,0,0,0,0|0,0,1]=3 873 B12R1.367 NCC(O)C1=CC=C(Cl)C(Cl)=C1 P38572 [0,2,0,0,0,0|0,1,0]=3 874 B12R1.367 NCC(O)C1=CC=C(F)C(F)=C1 P43069 [0,2,0,0,0,0|0,0,0]=2 875 B12R1.367 N[C@@H](CO)C1=CC=C(F)C(Cl)=C1 P35016 [0,2,0,0,0,0|1,1,0]=4 876 B12R1.367 N[C@@H](CO)C1=CC=C(F)C(F)=C1 P39117 [0,2,0,0,0,0|1,0,0]=3 877 B12R1.367 N[C@H](CO)C1=CC=C(F)C(Cl)=C1 P37881 [0,2,0,0,0,0|1,1,0]=4 878 B12R1.367 N[C@H](CO)C1=CC=C(F)C(F)=C1 P41874 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 P39449 [0,2,0,0,0,0|1,0,1]=4 880 B12R1.435 COC1=CC(C(N)CO)=CC=C1 P38813 [0,2,0,0,0,0|2,0,0]=4 881 B12R1.435 COC1=CC(C(O)CN)=CC=C1 P39138 [0,2,0,0,0,0|1,0,0]=3 882 B12R1.435 COC1=CC([C@@H](N)CO)=CC=C1 P36199 [0,2,0,0,0,0|2,0,0]=4 883 B12R1.435 COC1=CC([C@H](N)CO)=CC=C1 P42270 [0,2,0,0,0,0|2,0,0]=4 884 B12R1.28 BrCCCCC1=CC=CC(Br)=C1 M22716 [0,2,0,0,0,0|1,1,0]=4 885 B12R1.28 C=CCOCC1=CC=CC(Br)=C1 N25493 [0,2,0,0,0,0|1,1,0]=4 886 B12R1.28 CC1=CC(CCCCBr)=CC=C1 M22773 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.28 CC1=CC(CCCCI)=CC=C1 M22749 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.28 CC1=CC(CCCCN)=CC=C1 P41305 [0,2,0,0,0,0|1,0,0]=3 889 B12R1.28 CC1=CC(CCCCO)=CC=C1 P37676 [0,2,0,0,0,0|2,0,0]=4 890 B12R1.28 CCCNCC1=CC(Br)=CC=C1 N24121 [0,2,0,0,0,0|1,1,0]=4 891 B12R1.28 CCCNCC1=CC=CC(C)=C1 P40841 [0,2,0,0,0,0|2,0,0]=4 892 B12R1.28 CCCNCC1=CC=CC(Cl)=C1 P38354 [0,2,0,0,0,0|1,1,0]=4 893 B12R1.28 CCCNCC1=CC=CC(F)=C1 P35256 [0,2,0,0,0,0|1,0,0]=3 894 B12R1.28 CNCCOC1=CC=CC(F)=C1 P35491 [0,2,0,0,0,0|0,0,0]=2 895 B12R1.28 COCCOC1=CC(I)=CC=C1 P38376 [0,2,0,0,0,0|1,1,0]=4 896 B12R1.28 COCCOC1=CC(N)=CC=C1 P42657 [0,2,0,0,0,0|2,0,0]=4 897 B12R1.28 ClC1=CC(CCCCBr)=CC=C1 M22733 [0,2,0,0,0,0|1,1,0]=4 898 B12R1.28 FC1=CC(CCCCBr)=CC=C1 M22740 [0,2,0,0,0,0|1,0,0]=3 899 B12R1.28 NC1=CC(OCCCO)=CC=C1 P42246 [0,2,0,0,0,0|2,0,0]=4 900 B12R1.28 NCCCCC1=CC=CC(Cl)=C1 P40368 [0,2,0,0,0,0|0,1,0]=3 901 B12R1.28 NCCCCC1=CC=CC(F)=C1 P41608 [0,2,0,0,0,0|0,0,0]=2 902 B12R1.28 OCCCCC1=CC=CC(Br)=C1 P39680 [0,2,0,0,0,0|1,1,0]=4 903 B12R1.28 OCCCCC1=CC=CC(Cl)=C1 P36219 [0,2,0,0,0,0|1,1,0]=4 904 B12R1.28 OCCCCC1=CC=CC(F)=C1 P36220 [0,2,0,0,0,0|1,0,0]=3 905 B12R1.50 CC1=CC(CC(N)CO)=CC=C1 P38591 [0,2,0,0,0,0|1,0,0]=3 906 B12R1.50 CC1=CC(C[C@@H](N)CO)=CC=C1 P36120 [0,2,0,0,0,0|1,0,0]=3 907 B12R1.50 CCC(=O)CC1=CC=CC(C)=C1 P40770 [0,2,0,0,0,0|2,0,0]=4 908 B12R1.50 CCC(=O)CC1=CC=CC(F)=C1 P37115 [0,2,0,0,0,0|1,0,0]=3 909 B12R1.50 NC(CO)CC1=CC=CC(Br)=C1 P39329 [0,2,0,0,0,0|0,1,0]=3 910 B12R1.50 NC(CO)CC1=CC=CC(Cl)=C1 P38434 [0,2,0,0,0,0|0,1,0]=3 911 B12R1.50 NC(CO)CC1=CC=CC(F)=C1 P38589 [0,2,0,0,0,0|0,0,0]=2 912 B12R1.50 NNC(=O)CC1=CC=CC(Cl)=C1 P36762 [0,2,0,0,0,0|0,1,1]=4 913 B12R1.50 N[C@@H](CO)CC1=CC=CC(F)=C1 P36121 [0,2,0,0,0,0|0,0,0]=2 914 B12R1.50 N[C@H](CO)CC1=CC=CC(Br)=C1 P37966 [0,2,0,0,0,0|0,1,0]=3 915 B12R1.50 N[C@H](CO)CC1=CC=CC(Cl)=C1 P34978 [0,2,0,0,0,0|0,1,0]=3 916 B12R1.50 N[C@H](CO)CC1=CC=CC(F)=C1 P34977 [0,2,0,0,0,0|0,0,0]=2 917 B12R1.50 O=C(CBr)CC1=CC=CC(Br)=C1 O32163 [0,2,0,0,0,0|1,1,0]=4 918 B12R1.50 O=C(CBr)CC1=CC=CC(Cl)=C1 O29302 [0,2,0,0,0,0|1,1,0]=4 919 B12R1.100 C#CCOC1=CC(F)=CC(F)=C1 P38008 [0,2,0,0,0,0|1,0,1]=4 920 B12R1.100 CC1=CC(C)=CC(CCCN)=C1 P41303 [0,2,0,0,0,0|1,0,0]=3 921 B12R1.100 CCCOC1=CC(Br)=CC(Br)=C1 O29127 [0,2,0,0,0,0|1,1,0]=4 922 B12R1.100 COCOC1=CC(F)=CC(Br)=C1 Q67144 [0,2,0,0,0,0|2,0,0]=4 923 B12R1.100 COCOC1=CC(F)=CC(F)=C1 Q66861 [0,2,0,0,0,0|2,0,0]=4 924 B12R1.100 FC1=CC(F)=CC(CCCBr)=C1 P35595 [0,2,0,0,0,0|1,0,0]=3 925 B12R1.100 NCCCC1=CC(F)=CC(F)=C1 P42825 [0,2,0,0,0,0|0,0,0]=2 926 B12R1.100 NCCOC1=CC(Cl)=CC(Cl)=C1 P36644 [0,2,0,0,0,0|0,1,0]=3 927 B12R1.100 OCCCC1=CC(F)=CC(F)=C1 P42826 [0,2,0,0,0,0|1,0,0]=3 928 B12R1.226 CC(C)NCC1=CC=CC(Br)=C1 P42663 [0,2,0,0,0,0|1,1,0]=4 929 B12R1.226 CC(C)NCC1=CC=CC(Cl)=C1 P35254 [0,2,0,0,0,0|1,1,0]=4 930 B12R1.226 CC(C)NCC1=CC=CC(F)=C1 P35255 [0,2,0,0,0,0|1,0,0]=3 931 B12R1.226 CC1=CC(CCC(=O)O)=CC=C1 P38460 [0,2,0,0,0,0|2,0,0]=4 932 B12R1.226 CC1=CC(CNC(C)C)=CC=C1 P35131 [0,2,0,0,0,0|2,0,0]=4 933 B12R1.226 NC(=O)CCC1=CC=CC(Br)=C1 P37053 [0,2,0,0,0,0|0,1,0]=3 934 B12R1.226 O=C(O)CCC1=CC(F)=CN=C1 Q60660 [0,2,0,0,0,0|2,0,0]=4 935 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 P38005 [0,2,0,0,0,0|1,0,0]=3 936 B12R1.226 O=C(O)CCC1=CC=CC(I)=C1 P36632 [0,2,0,0,0,0|1,1,0]=4 937 B12R1.226 O=C(O)CCC1=NC=CC(F)=C1 Q60481 [0,2,0,0,0,0|2,0,0]=4 938 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 P38226 [0,2,0,0,0,0|1,0,1]=4 939 B12R1.374 CCCOC1=CC(F)=CC=C1Br Q68052 [0,2,0,0,0,0|1,0,0]=3 940 B12R1.374 COCOC1=CC(F)=CC=C1Br Q67338 [0,2,0,0,0,0|2,0,0]=4 941 B12R1.374 COCOC1=CC(F)=CC=C1C Q66966 [0,2,0,0,0,0|2,0,0]=4 942 B12R1.374 COCOC1=CC(F)=CC=C1F Q68138 [0,2,0,0,0,0|2,0,0]=4 943 B12R1.374 FC1=CC=C(F)C(CCCBr)=C1 P42799 [0,2,0,0,0,0|1,0,0]=3 944 B12R1.374 NC1=CC=C(F)C=C1OCCO P42988 [0,2,0,0,0,0|1,0,0]=3 945 B12R1.374 OCCCC1=CC(F)=CC=C1F P35584 [0,2,0,0,0,0|1,0,0]=3 946 B12R1.382 CCNCC1=CC=CC(OC)=C1 Q66019 [0,2,0,0,0,0|2,0,0]=4 947 B12R1.382 CNCCC1=CC=CC(OC)=C1 P38740 [0,2,0,0,0,0|1,0,0]=3 948 B12R1.382 COC1=CC(CCCBr)=CC=C1 P36566 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.382 COC1=CC(CCCN)=CC=C1 P40261 [0,2,0,0,0,0|1,0,0]=3 950 B12R1.382 COC1=CC(CCCO)=CC=C1 O28944 [0,2,0,0,0,0|2,0,0]=4 951 B12R1.382 COC1=CC(OCCN)=CC=C1 P36840 [0,2,0,0,0,0|1,0,0]=3 952 B12R1.382 COC1=CC(OCCO)=CC=C1 P38700 [0,2,0,0,0,0|2,0,0]=4 953 B12R1.385 CC1=CC(OCCN)=CC=C1Cl P36839 [0,2,0,0,0,0|1,0,0]=3 954 B12R1.385 CC1=CC=C(CCCN)C=C1C P41304 [0,2,0,0,0,0|1,0,0]=3 955 B12R1.385 CC1=CC=C(OCCBr)C=C1C P38742 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.385 CC1=CC=C(OCCN)C=C1C M23033 [0,2,0,0,0,0|1,0,0]=3 957 B12R1.385 CC1=CC=C(SCCO)C=C1Br O31390 [0,2,0,0,0,0|1,1,0]=4 958 B12R1.385 CCCOC1=CC=C(Br)C(F)=C1 Q67470 [0,2,0,0,0,0|1,0,0]=3 959 B12R1.385 CCCOC1=CC=C(C)C(Br)=C1 N26854 [0,2,0,0,0,0|1,1,0]=4 960 B12R1.385 CCCOC1=CC=C(N)C(N)=C1 O31767 [0,2,0,0,0,0|2,0,0]=4 961 B12R1.385 CNCCC1=CC=C(Cl)C(Cl)=C1 P37636 [0,2,0,0,0,0|0,1,0]=3 962 B12R1.385 COCOC1=CC=C(Br)C(F)=C1 Q67490 [0,2,0,0,0,0|2,0,0]=4 963 B12R1.385 COCOC1=CC=C(C)C(F)=C1 Q67160 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.385 COCOC1=CC=C(F)C(F)=C1 Q66975 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.385 FC1=CC=C(CCCBr)C=C1F P42798 [0,2,0,0,0,0|1,0,0]=3 966 B12R1.385 NCCCC1=CC=C(Cl)C(Cl)=C1 P36171 [0,2,0,0,0,0|0,1,0]=3 967 B12R1.385 NCCCC1=CC=C(Cl)C(F)=C1 P37976 [0,2,0,0,0,0|0,0,0]=2 968 B12R1.385 NCCCC1=CC=C(F)C(F)=C1 P38447 [0,2,0,0,0,0|0,0,0]=2 969 B12R1.385 NCCCC1=CC=C(O)C(O)=C1 P37643 [0,2,0,0,0,0|1,0,0]=3 970 B12R1.385 OCCCC1=CC=C(F)C(F)=C1 P38961 [0,2,0,0,0,0|1,0,0]=3 971 B12R1.41 CCOC1=CC(F)=CC(C=O)=C1 N25284 [0,2,0,0,0,0|2,0,0]=4 972 B12R1.41 CCOC1=CC(F)=CC(CO)=C1 N25765 [0,2,0,0,0,0|2,0,0]=4 973 B12R1.44 CCOC1=CC(F)=C(O)C(F)=C1 Q67682 [0,2,0,0,0,0|2,0,0]=4 974 B12R1.101 CC(C)OC1=CC(F)=CC(Br)=C1 N24800 [0,2,0,0,0,0|2,0,0]=4 975 B12R1.101 CC(C)OC1=CC(F)=CC(F)=C1 N24543 [0,2,0,0,0,0|2,0,0]=4 976 B12R1.101 CC1=CC(F)=CC(OC(C)C)=C1 N26546 [0,2,0,0,0,0|2,0,0]=4 977 B12R1.19 CC(C)OC1=CC=C(Br)C(F)=C1 Q67472 [0,2,0,0,0,0|2,0,0]=4 978 B12R1.19 CC(C)OC1=CC=C(F)C(F)=C1 N24491 [0,2,0,0,0,0|2,0,0]=4 979 B12R1.19 O=C(O)CC1=CC=C(Br)C(F)=C1 S70897 [0,2,0,0,0,0|1,0,1]=4 980 B12R1.127 CC(C)OC1=CC(F)=CC=C1Br Q67483 [0,2,0,0,0,0|2,0,0]=4 981 B12R1.1123 CCOC1=C(Cl)C=C(Br)C(F)=C1 N25810 [0,2,0,0,0,0|2,0,0]=4 982 B12R1.1123 CCOC1=C(F)C=C(Br)C(F)=C1 N25786 [0,2,0,0,0,0|2,0,0]=4 983 B12R1.1123 CCOC1=C(F)C=C(O)C(F)=C1 O29176 [0,2,0,0,0,0|2,0,0]=4 984 B12R1.1123 CCOC1=CC(F)=C(F)C=C1Br Q67487 [0,2,0,0,0,0|2,0,0]=4 985 B12R1.1123 FC1=CC(F)=C(CCBr)C=C1F I-9708 [0,2,0,0,0,0|1,0,0]=3 986 B12R1.278 CCOC1=CC(CCO)=CC=C1 Q66109 [0,2,0,0,0,0|2,0,0]=4 987 B12R1.279 NCCC1=CC(C(=O)O)=CC=C1 P36745 [0,2,0,0,0,0|1,0,0]=3 988 B12R1.279 NCCC1=CC=CC([N+](=O)[O-])=C1 P40197 [0,2,0,0,0,0|1,0,0]=3 989 B12R1.279 O=C(O)C1=CC=CC(CCO)=C1 O31031 [0,2,0,0,0,0|2,0,0]=4 990 B12R1.279 O=[N+]([O-])C1=CC(CCO)=CC=C1 O28059 [0,2,0,0,0,0|2,0,0]=4 991 B10R2.6 C1=CC(C2CC2)=CC=N1 N25361 [1,0,0,1,0,0|2,0,0]=4 992 B10R2.6 C1=CC=C(C2CN2)C=C1 P41085 [1,0,0,1,0,0|0,0,0]=2 993 B10R2.6 C1=CN=C(C2CC2)C=C1 K12338 [1,0,0,1,0,0|2,0,0]=4 994 B10R2.7 C1=CC=C2CNCC2=C1 P44607 [1,0,0,1,0,0|2,0,0]=4 995 B10R2.7 C1=CN=C2CCNC2=C1 O29585 [1,0,0,1,0,0|1,0,0]=3 996 B10R2.7 C1=CN=C2NCCC2=C1 C-3425 [1,0,0,1,0,0|1,0,0]=3 997 B10R2.320 NC1CC2=C1C=CC=C2 L19725 [1,0,0,1,0,0|0,0,0]=2 998 B12R2.82 FC1=C(Br)C=CC2=C1NC=C2 L13376 [0,1,0,1,0,0|0,0,2]=4 999 B12R2.82 FC1=C(Br)C=CC2=C1NCC2 P47167 [0,1,0,1,0,0|0,0,0]=2 1000 B12R2.82 FC1=C2NC=CC2=CC=C1Cl Q54493 [0,1,0,1,0,0|0,0,2]=4 1001 B12R2.82 FC1=C2NN=NC2=CC=C1Br O32385 [0,1,0,1,0,0|2,0,0]=4 1002 B12R2.82 FC1=CC=C2NC=NC2=C1Br P43451 [0,1,0,1,0,0|1,0,1]=4 1003 B12R2.82 FC1=CC=C2NC=NC2=C1Cl O29486 [0,1,0,1,0,0|1,0,1]=4 1004 B12R2.82 NC1=CC=C2C=CNC2=C1F Q63583 [0,1,0,1,0,0|0,0,2]=4 1005 B12R2.82 NC1=CC=C2C=NNC2=C1F Q63580 [0,1,0,1,0,0|1,0,1]=4 1006 B12R2.82 OC1=C(F)C=CC2=C1C=NN2 Q55667 [0,1,0,1,0,0|1,0,1]=4 1007 B12R2.202 NC1=NC2=CC=CC(F)=C2S1 P44408 [0,1,0,1,0,0|1,0,1]=4 1008 B12R2.202 O=C1CC2=CC=NC(F)=C2N1 Q53172 [0,1,0,1,0,0|1,0,1]=4 1009 B12R2.1081 BrC1=C2CCCNC2=CC=C1 I-9935 [0,1,0,1,0,0|1,1,0]=4 1010 B12R2.1081 BrC1=C2CCNCC2=CC=C1 Q56483 [0,1,0,1,0,0|1,1,0]=4 1011 B12R2.1081 BrC1=C2CNCCC2=CN=C1 L22244 [0,1,0,1,0,0|1,1,0]=4 1012 B12R2.1081 BrC1=CN=CC2=C1NCCC2 F-4134 [0,1,0,1,0,0|1,1,0]=4 1013 B12R2.1081 NC1=C2NCCCC2=CN=C1 L20096 [0,1,0,1,0,0|2,0,0]=4 1014 B12R2.1081 NC1=C2OCCOC2=CC=C1 C-2956 [0,1,0,1,0,0|2,0,0]=4 1015 B12R2.1081 OC1=C2NCCCC2=CC=C1 10586 [0,1,0,1,0,0|1,0,0]=3 1016 B12R2.80 NC1CC1C2=CC=CC(Cl)=C2 O34598 [0,1,0,1,0,0|0,1,0]=3 1017 B12R2.80 NC1CC1C2=CC=CC(F)=C2 O34562 [0,1,0,1,0,0|0,0,0]=2 1018 B12R2.132 CC1=CC2=C(C=C1)CCC2N P38544 [0,1,0,1,0,0|2,0,0]=4 1019 B12R2.132 FC1=CC2=C(C=C1)NN=C2Br O32912 [0,1,0,1,0,0|1,0,1]=4 1020 B12R2.132 FC1=CC2=C(C=C1)NN=C2I O30721 [0,1,0,1,0,0|1,0,1]=4 1021 B12R2.132 NC1=NNC2=C1C=C(F)C=C2 P51011 [0,1,0,1,0,0|1,0,1]=4 1022 B12R2.132 NC1CCC2=C1C=C(Br)C=C2 P42338 [0,1,0,1,0,0|1,1,0]=4 1023 B12R2.132 NC1CCC2=C1C=C(Cl)C=C2 P36711 [0,1,0,1,0,0|1,1,0]=4 1024 B12R2.132 NC1CCC2=C1C=C(F)C=C2 M23347 [0,1,0,1,0,0|1,0,0]=3 1025 B12R2.132 N[C@@H]1CCC2=C1C=C(O)C=C2 L18503 [0,1,0,1,0,0|2,0,0]=4 1026 B12R2.132 O=C1COC2=CC=C(F)C=C12 B-1139 [0,1,0,1,0,0|1,0,1]=4 1027 B12R2.132 OC1CCC2=C1C=C(Cl)C=C2 P37662 [0,1,0,1,0,0|1,1,0]=4 1028 B12R2.132 OC1CCC2=CC=C(Br)C=C21 N24956 [0,1,0,1,0,0|1,1,0]=4 1029 B12R2.196 CC1=CC=CC2=C1CCC2N M22843 [0,1,0,1,0,0|2,0,0]=4 1030 B12R2.196 CC1=NNC2=C1C=CC=C2F Q52505 [0,1,0,1,0,0|1,0,1]=4 1031 B12R2.196 FC1=C2NN=C(I)C2=CC=C1 L13617 [0,1,0,1,0,0|1,0,1]=4 1032 B12R2.196 NC1CCC2=C1C=CC=C2Br L22472 [0,1,0,1,0,0|1,1,0]=4 1033 B12R2.196 NC1CCC2=C1C=CC=C2Cl P36710 [0,1,0,1,0,0|1,1,0]=4 1034 B12R2.196 NC1CCC2=C1C=CC=C2F M23042 [0,1,0,1,0,0|1,0,0]=3 1035 B12R2.196 N[C@H]1CCC2=C1C=CC=C2F S72703 [0,1,0,1,0,0|1,0,0]=3 1036 B12R2.196 O=C1CCC2=C1C=CC=C2F P36547 [0,1,0,1,0,0|1,0,1]=4 1037 B12R2.196 O=C1COC2=C1C=CC=C2F S72794 [0,1,0,1,0,0|1,0,1]=4 1038 B12R2.196 O=C1CSC2=C(F)C=CC=C12 L19573 [0,1,0,1,0,0|1,0,1]=4 1039 B12R2.196 OC1=NNC2=C1C=CC=C2F M15118 [0,1,0,1,0,0|1,0,1]=4 1040 B12R2.196 OC1CCC2=C1C=CC=C2Br P40723 [0,1,0,1,0,0|1,1,0]=4 1041 B12R2.196 OC1CCC2=C1C=CC=C2Cl P38853 [0,1,0,1,0,0|1,1,0]=4 1042 B12R2.1282 CC1=CC(C2(N)CC2)=CC=C1 P37815 [0,1,0,1,0,0|2,0,0]=4 1043 B12R2.1282 NC1(C2=CC=CC(Br)=C2)CC1 P37506 [0,1,0,1,0,0|1,1,0]=4 1044 B12R2.1282 NC1(C2=CC=CC(Cl)=C2)CC1 P37942 [0,1,0,1,0,0|1,1,0]=4 1045 B12R2.1282 NC1(C2=CC=CC(F)=C2)CC1 P36192 [0,1,0,1,0,0|1,0,0]=3 1046 B12R2.1282 NC1(C2=CC=CC(I)=C2)CC1 P36098 [0,1,0,1,0,0|1,1,0]=4 1047 B12R2.2313 BrC1=CC(C2CCC2)=CC=C1 N25708 [0,1,0,1,0,0|1,1,0]=4 1048 B12R2.2313 BrC1=CC(C2CNC2)=CC=C1 O33220 [0,1,0,1,0,0|0,1,0]=3 1049 B12R2.2313 BrC1=CC(C2COC2)=CC=C1 G-7246 [0,1,0,1,0,0|1,1,0]=4 1050 B12R2.2313 BrC1=CC(N2CCC2)=CC=C1 Q69621 [0,1,0,1,0,0|1,1,0]=4 1051 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 G-6479 [0,1,0,1,0,0|1,1,0]=4 1052 B12R2.24 BrC1=CC2=C(C=C1)OCCC2 P38383 [0,1,0,1,0,0|1,1,0]=4 1053 B12R2.24 BrC1=CC=C2CCNCC2=C1 G-6480 [0,1,0,1,0,0|1,1,0]=4 1054 B12R2.24 BrC1=CC=C2CCNCC2=C1 G-6480-01 [0,1,0,1,0,0|1,1,0]=4 1055 B12R2.24 BrC1=CC=C2CNCCC2=C1 L13599 [0,1,0,1,0,0|0,1,0]=3 1056 B12R2.24 BrC1=CC=C2CNCCC2=C1 L14008 [0,1,0,1,0,0|0,1,0]=3 1057 B12R2.24 BrC1=CC=C2NCCOC2=C1 O34410 [0,1,0,1,0,0|0,1,0]=3 1058 B12R2.24 BrC1=CN=C2CNCCC2=C1 P45962 [0,1,0,1,0,0|1,1,0]=4 1059 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 O33320 [0,1,0,1,0,0|1,1,0]=4 1060 B12R2.24 ClC1=NC=C2CNCCC2=C1 10777 [0,1,0,1,0,0|1,1,0]=4 1061 B12R2.24 IC1=CC2=C(C=C1)OCCC2 P36651 [0,1,0,1,0,0|1,1,0]=4 1062 B12R2.24 IC1=CC=C2CCCNC2=C1 N25660 [0,1,0,1,0,0|1,1,0]=4 1063 B12R2.24 NC1=NC2=C(C=C1)CNCC2 O32378 [0,1,0,1,0,0|2,0,0]=4 1064 B12R2.24 NC1=NC2=C(C=C1)CNCC2 O32379 [0,1,0,1,0,0|2,0,0]=4 1065 B12R2.24 NC1=NC2=C(C=C1)CNCC2 Q69785 [0,1,0,1,0,0|2,0,0]=4 1066 B12R2.24 OC1=CC2=C(C=C1)CNCC2 L18301 [0,1,0,1,0,0|1,0,0]=3 1067 B12R2.24 OC1=CC=C2OCCOC2=C1 O33980 [0,1,0,1,0,0|2,0,0]=4 1068 B12R2.24 OC1=CN=C2NCCCC2=C1 L20356 [0,1,0,1,0,0|2,0,0]=4 1069 B12R2.203 CN1N=CC2=C1C(F)=CC=C2 L14710 [0,1,0,1,0,0|1,0,1]=4 1070 B12R2.203 NC1=CC=CC2=C1C(=O)CC2 O30109 [0,1,0,1,0,0|2,0,0]=4 1071 B12R2.612 CC1NCC2=C1C=CC(Br)=C2 10152 [0,1,0,1,0,0|1,1,0]=4 1072 B12R2.612 NC1CCC2=C1C=CC(Br)=C2 P40299 [0,1,0,1,0,0|0,1,0]=3 1073 B12R2.612 NC1CCC2=C1C=CC(F)=C2 Q66157 [0,1,0,1,0,0|0,0,0]=2 1074 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 O31598 [0,1,0,1,0,0|1,1,0]=4 1075 B12R2.612 O=C1NCC2=C1C=CC(F)=C2 O32491 [0,1,0,1,0,0|1,0,1]=4 1076 B12R2.612 OC1CCC2=C1C=CC(Br)=C2 Q66199 [0,1,0,1,0,0|1,1,0]=4 1077 B12R2.1286 BrC1=CC=CC(OC2CC2)=C1 P42912 [0,1,0,1,0,0|1,1,0]=4 1078 B12R2.246 CC1=CC2=C(NC=C2)C(F)=C1 Q55317 [0,1,0,1,0,0|0,0,2]=4 1079 B12R2.246 FC1=C2NC=CC2=CC(Br)=C1 C-3603 [0,1,0,1,0,0|0,0,2]=4 1080 B12R2.246 FC1=CC(Br)=C2NN=CC2=C1 L14820 [0,1,0,1,0,0|1,0,1]=4 1081 B12R2.246 FC1=CC(Br)=CC2=C1NCC2 S72625 [0,1,0,1,0,0|0,0,0]=2 1082 B12R2.246 FC1=CC(Br)=CC2=C1NN=C2 L14924 [0,1,0,1,0,0|1,0,1]=4 1083 B12R2.246 FC1=CC2=C(NC=C2)C(Cl)=C1 M15243 [0,1,0,1,0,0|0,0,2]=4 1084 B12R2.246 FC1=CC2=C(NC=C2)C(F)=C1 L22295 [0,1,0,1,0,0|0,0,2]=4 1085 B12R2.246 FC1=CC2=C(NN=C2)C(Cl)=C1 P51527 [0,1,0,1,0,0|1,0,1]=4 1086 B12R2.246 FC1=CC2=C(NN=C2)C(I)=C1 Q54550 [0,1,0,1,0,0|1,0,1]=4 1087 B12R2.246 NC1=C2NC=CC2=CC(F)=C1 L13933 [0,1,0,1,0,0|0,0,2]=4 1088 B12R2.246 NC1=CC2=C(NC=C2)C(F)=C1 C-3511 [0,1,0,1,0,0|0,0,2]=4 1089 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 C-2304 [0,1,0,1,0,0|1,0,1]=4 1090 B12R2.606 NC1=NC2=CC=C(F)C=C2S1 M22877 [0,1,0,1,0,0|1,0,1]=4 1091 B12R2.606 O=C1CC2=C(C=CC(F)=N2)N1 Q52847 [0,1,0,1,0,0|1,0,1]=4 1092 B12R2.606 O=C1CC2=CC(Br)=CC=C2N1 C-3428 [0,1,0,1,0,0|0,1,1]=4 1093 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 E-3094 [0,1,0,1,0,0|0,0,1]=3 1094 B12R2.606 O=C1CC2=CC(F)=CN=C2N1 C-2428 [0,1,0,1,0,0|1,0,1]=4 1095 B12R2.606 O=C1CC2=CC(F)=NC=C2N1 Q53173 [0,1,0,1,0,0|1,0,1]=4 1096 B12R2.221 FC1=C2NN=CC2=C(Br)C=C1 N25012 [0,1,0,1,0,0|1,0,1]=4 1097 B12R2.221 FC1=CC=C(Br)C2=C1NC=C2 M24098 [0,1,0,1,0,0|0,0,2]=4 1098 B12R2.1316 NC1=CC(C2CC2)=C(F)C=C1 M23684 [0,1,0,1,0,0|2,0,0]=4 1099 B12R2.44 COC1=CC2=C(C=C1)NCC2 P39671 [0,1,0,1,0,0|1,0,0]=3 1100 B12R2.44 COC1=NC=C2NCCC2=C1 Q62962 [0,1,0,1,0,0|2,0,0]=4 1101 B12R2.44 N#CC1=CC2=C(C=C1)NCC2 M15521 [0,1,0,1,0,0|1,0,0]=3 1102 B12R2.315 NCC1=CC=CC2=C1NCC2 O32388 [0,1,0,1,0,0|1,0,0]=3 1103 B12R2.315 NCC1=CC=CC2=C1NCC2 Q69699 [0,1,0,1,0,0|1,0,0]=3 1104 B12R2.100 FC1=C(Br)C=C2NC=CC2=C1 C-2934 [0,1,0,1,0,0|0,0,2]=4 1105 B12R2.100 FC1=C(Br)C=C2NN=CC2=C1 G-6505 [0,1,0,1,0,0|1,0,1]=4 1106 B12R2.100 FC1=C(Cl)C=C2NC=CC2=C1 B-1041 [0,1,0,1,0,0|0,0,2]=4 1107 B12R2.100 FC1=C(Cl)C=C2NN=CC2=C1 C-2105 [0,1,0,1,0,0|1,0,1]=4 1108 B12R2.100 FC1=CC2=C(C=C1Br)NN=N2 H-8815 [0,1,0,1,0,0|2,0,0]=4 1109 B12R2.100 FC1=CC2=C(C=C1F)NC=C2 O32300 [0,1,0,1,0,0|0,0,2]=4 1110 B12R2.100 FC1=CC2=C(C=C1F)NCC2 M15600 [0,1,0,1,0,0|0,0,0]=2 1111 B12R2.100 NC1=C(F)C=C2C=CNC2=C1 Q63581 [0,1,0,1,0,0|0,0,2]=4 1112 B12R2.100 NC1=C(F)C=C2C=NNC2=C1 Q63579 [0,1,0,1,0,0|1,0,1]=4 1113 B12R2.100 OC1=CC2=C(C=NN2)C=C1F Q55668 [0,1,0,1,0,0|1,0,1]=4 1114 B12R2.291 CC1=CC(C2CC2)=CC=C1Br N26041 [0,1,0,1,0,0|2,0,0]=4 1115 B12R2.291 ClC1=CC=C(C2CO2)C=C1Cl P37615 [0,1,0,1,0,0|1,1,0]=4 1116 B8R1.1 NCC1=CC(Br)=CS1 O33586 [1,0,0,0,1,0|1,1,0]=4 1117 B8R1.1 NCC1=CC(Cl)=CS1 L13105 [1,0,0,0,1,0|1,1,0]=4 1118 B8R1.1 NCC1=CC(Cl)=CS1 O31449 [1,0,0,0,1,0|1,1,0]=4 1119 B8R1.1 NCC1=CC=C(Br)S1 L14034 [1,0,0,0,1,0|1,1,0]=4 1120 B8R1.1 NCC1=CC=C(Cl)S1 I-9793 [1,0,0,0,1,0|1,1,0]=4 1121 B8R1.1 NCC1=CC=C(Cl)S1 P39739 [1,0,0,0,1,0|1,1,0]=4 1122 B8R1.1 NCC1=CC=C(F)S1 G-6513 [1,0,0,0,1,0|1,0,0]=3 1123 B8R1.1 NCC1=CSC(Br)=C1 O33369 [1,0,0,0,1,0|1,1,0]=4 1124 B8R1.1 NCC1=CSC(Br)=C1 O34212 [1,0,0,0,1,0|1,1,0]=4 1125 B8R1.1 NCC1=CSC(Cl)=C1 G-5520 [1,0,0,0,1,0|1,1,0]=4 1126 B8R1.1 NCC1=NNC(F)=C1 Q52442 [1,0,0,0,1,0|2,0,0]=4 1127 B8R1.1 OCC1=CC=C(F)S1 G-6512 [1,0,0,0,1,0|2,0,0]=4 1128 B8R1.11 NCC1=C(Cl)C=CS1 G-6088 [1,0,0,0,1,0|1,1,0]=4 1129 B8R1.8 NCCC1=CC=CO1 O34064 [1,0,0,0,1,0|1,0,0]=3 1130 B8R1.8 NCCC1=CSC=C1 G-7583 [1,0,0,0,1,0|1,0,0]=3 1131 B8R1.8 NCCN1C=CC=C1 P38998 [1,0,0,0,1,0|1,0,0]=3 1132 B8R1.8 NCCN1C=CC=N1 P43070 [1,0,0,0,1,0|2,0,0]=4 1133 B8R1.8 NCCN1C=CN=C1 O32262 [1,0,0,0,1,0|2,0,0]=4 1134 B8R1.8 NCCN1C=CN=C1 P37320 [1,0,0,0,1,0|2,0,0]=4 1135 B8R1.8 OCCC1=CC=CS1 I-9194 [1,0,0,0,1,0|2,0,0]=4