0 B12R1.270 CCOC1=CC(C=O)=CC=C1O SY011364 [0,0,0,0,0,0|0,0,0]=0 1 B11R1.182 CC1=C(OCCl)C=C(Br)C=C1 SY298463 [1,0,0,0,0,0|3,0,0]=4 2 B11R1.182 CC1=CC=C(C)C(OCCl)=C1 SY298328 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.182 CNCC1=CC(Br)=CC=C1O SY018706 [1,0,0,0,0,0|3,0,0]=4 4 B11R1.182 CNCC1=CC(Cl)=CC=C1O SY018708 [1,0,0,0,0,0|3,0,0]=4 5 B11R1.182 CNCC1=CC(F)=CC=C1O SY018704 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.182 FC1=C(OCCl)C=C(Br)C=C1 SY298340 [1,0,0,0,0,0|3,0,0]=4 7 B11R1.189 CCCC1=CC(OC)=CC=C1 SY251462 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.189 CCOC1=CC(C#N)=CC=C1 SY061633 [1,0,0,0,0,0|1,0,1]=3 9 B11R1.189 CCOC1=CC(C=O)=CN=C1 SY028844 [1,0,0,0,0,0|1,0,0]=2 10 B11R1.189 CCOC1=CC(ON)=CC=C1 SY282303 [1,0,0,0,0,0|2,0,0]=3 11 B11R1.189 CCOC1=CC(ON)=CC=C1 SY282304 [1,0,0,0,0,0|2,0,0]=3 12 B11R1.189 COC1=CC=CC(OCCl)=C1 SY298498 [1,0,0,0,0,0|3,0,0]=4 13 B11R1.280 CCC1=CC(C#N)=CC=C1F SY025757 [1,0,0,0,0,0|2,0,1]=4 14 B11R1.280 COC1=C(Cl)C=CC(C#N)=C1 SY007168 [1,0,0,0,0,0|2,0,1]=4 15 B11R1.280 COC1=C(F)C=CC(C#N)=C1 SY006997 [1,0,0,0,0,0|2,0,1]=4 16 B11R1.280 COC1=C(F)C=CC(C=O)=C1 SY003349 [1,0,0,0,0,0|1,0,0]=2 17 B11R1.280 COC1=CC(C#N)=CC=C1Br SY025036 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.280 COC1=CC(C#N)=CC=C1N SY035407 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.280 COC1=CC(C=O)=CC=C1Br SY047648 [1,0,0,0,0,0|1,0,0]=2 20 B11R1.280 COC1=CC(C=O)=CC=C1Cl SY021859 [1,0,0,0,0,0|1,0,0]=2 21 B11R1.280 COC1=CC(C=O)=CC=C1I SY028995 [1,0,0,0,0,0|1,0,0]=2 22 B11R1.280 COC1=CC(C=O)=CC=C1O SY224451 [1,0,0,0,0,0|0,0,0]=1 23 B11R1.280 COC1=CC(CN)=CC=C1F SY026389 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.280 COC1=CC(CN)=CC=C1O SY018614 [1,0,0,0,0,0|1,0,1]=3 25 B11R1.280 COC1=CC(CO)=CC=C1N SY102854 [1,0,0,0,0,0|1,0,2]=4 26 B11R1.280 COC1=CC(CO)=CC=C1O SY013849 [1,0,0,0,0,0|0,0,2]=3 27 B11R1.280 COC1=CC(OC)=C(Br)C=C1 SY014971 [1,0,0,0,0,0|3,0,0]=4 28 B11R1.280 COC1=CC(ON)=CC=C1Cl SY282423 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.280 COC1=CC(ON)=CC=C1Cl SY282424 [1,0,0,0,0,0|3,0,0]=4 30 B11R1.280 COC1=CC=C(I)C(OC)=C1 SY050269 [1,0,0,0,0,0|3,0,0]=4 31 B11R1.280 N#CC1=CC(C=O)=CC=C1Cl SY240517 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.280 N#CC1=CC(C=O)=CC=C1F SY002652 [1,0,0,0,0,0|2,0,1]=4 33 B11R1.280 O=CC1=CC=C(O)C(C=O)=C1 SY050884 [1,0,0,0,0,0|1,0,1]=3 34 B13R1.97 O=CC1=CC=C(F)C(OC(F)F)=C1 SY026393 [0,1,0,0,0,0|2,0,0]=3 35 B13R1.354 CCOC1=CC(B(O)O)=CC=C1Cl SY104728 [0,1,0,0,0,0|2,0,1]=4 36 B13R1.354 CCOC1=CC([N+](=O)[O-])=CC=C1Br SY046583 [0,1,0,0,0,0|2,0,0]=3 37 B13R1.355 CCOC1=CC(C#N)=CC=C1OC SY056573 [0,1,0,0,0,0|1,0,1]=3 38 B13R1.355 CCOC1=CC(C=O)=CC=C1OC SY004271 [0,1,0,0,0,0|0,0,0]=1 39 B13R1.2431 COC(=O)C1=CC(C=O)=CC=C1O SY002304 [0,1,0,0,0,0|2,0,0]=3 40 B13R2.57 COC1=CC=C2OCCNC2=C1 SY130734 [0,0,0,1,0,0|3,0,0]=4 41 B13R2.57 NCC1=CC=C2OCCOC2=C1 SY035067 [0,0,0,1,0,0|1,0,1]=3 42 B13R2.57 NNC1=CC=C2OCCOC2=C1 SY027278 [0,0,0,1,0,0|2,0,0]=3 43 B13R2.57 NOC1=CC=C2OCCOC2=C1 SY282256 [0,0,0,1,0,0|2,0,0]=3 44 B13R2.57 NOC1=CC=C2OCCOC2=C1 SY282257 [0,0,0,1,0,0|2,0,0]=3 45 B13R2.57 O=CC1=CC=C2CCOCC2=C1 SY253047 [0,0,0,1,0,0|3,0,0]=4 46 B13R2.57 O=CC1=CC=C2OCCOC2=C1 SY001133 [0,0,0,1,0,0|0,0,0]=1 47 B13R2.2121 CC1=CC2=C(C=C(C=O)C=C2)N1 SY253640 [0,0,0,1,0,0|2,0,1]=4 48 B13R2.2121 NC1=NC2=CC=C(C=O)C=C2O1 SY271629 [0,0,0,1,0,0|2,0,1]=4 49 B10R1.4 CC1=CC=CC=C1OCCl SY298330 [2,0,0,0,0,0|2,0,0]=4 50 B10R1.4 CCOC1=C(Br)C=CC=C1 SY018463 [2,0,0,0,0,0|1,0,0]=3 51 B10R1.4 CCOC1=C(C)C=CN=C1 SY129406 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.4 CCOC1=CC=CN=C1F SY035897 [2,0,0,0,0,0|2,0,0]=4 53 B10R1.4 CCOC1=CC=CNC1=O SY023905 [2,0,0,0,0,0|1,0,1]=4 54 B10R1.4 CCOC1=NC=CC=C1Br SY053418 [2,0,0,0,0,0|2,0,0]=4 55 B10R1.4 COCC1=CC=CC=C1O SY026429 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.4 ClCOC1=C(I)C=CC=C1 SY298441 [2,0,0,0,0,0|2,0,0]=4 57 B10R1.4 ClCOC1=CC=CC=C1Br SY298326 [2,0,0,0,0,0|2,0,0]=4 58 B10R1.4 ClCOC1=CC=CC=C1Cl SY298558 [2,0,0,0,0,0|2,0,0]=4 59 B10R1.4 NCCC1=CC=CC=C1O SY040467 [2,0,0,0,0,0|2,0,0]=4 60 B10R1.4 OCCC1=CC=CC=C1O SY066615 [2,0,0,0,0,0|2,0,0]=4 61 B10R1.10 CCNC1=CC=CC(Br)=C1 SY040310 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.10 CCOC1=CC(Br)=CC=C1 SY049073 [2,0,0,0,0,0|1,0,0]=3 63 B10R1.10 CCOC1=CC(Cl)=NC=C1 SY032380 [2,0,0,0,0,0|2,0,0]=4 64 B10R1.10 CCOC1=CC=NC(N)=C1 SY006018 [2,0,0,0,0,0|2,0,0]=4 65 B10R1.10 CCOC1=CN=CC(N)=C1 SY032850 [2,0,0,0,0,0|2,0,0]=4 66 B10R1.10 CCOC1=NC=CC(N)=C1 SY013227 [2,0,0,0,0,0|2,0,0]=4 67 B10R1.10 ClCOC1=CC(Br)=CC=C1 SY293036 [2,0,0,0,0,0|2,0,0]=4 68 B10R1.10 ClCOC1=CC(Cl)=CC=C1 SY298324 [2,0,0,0,0,0|2,0,0]=4 69 B10R1.10 FC1=CC=CC(OCCl)=C1 SY298336 [2,0,0,0,0,0|2,0,0]=4 70 B10R1.30 CCC1=CC(Br)=CC=C1I SY021073 [2,0,0,0,0,0|2,0,0]=4 71 B10R1.30 CCC1=CC(Cl)=CC=C1Br SY070323 [2,0,0,0,0,0|2,0,0]=4 72 B10R1.30 CCC1=NC(C)=CC=C1O SY021192 [2,0,0,0,0,0|1,0,1]=4 73 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 SY018959 [2,0,0,0,0,0|2,0,0]=4 74 B10R1.30 COC1=C(Br)C=CC(F)=C1 SY014353 [2,0,0,0,0,0|2,0,0]=4 75 B10R1.30 COC1=C(C)C=CC(O)=C1 SY224175 [2,0,0,0,0,0|1,0,1]=4 76 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 SY007597 [2,0,0,0,0,0|2,0,0]=4 77 B10R1.30 COC1=C(N)C=CC(Br)=C1 SY018328 [2,0,0,0,0,0|2,0,0]=4 78 B10R1.30 COC1=C(N)C=CC(O)=C1 SY007233 [2,0,0,0,0,0|1,0,1]=4 79 B10R1.30 COC1=C(O)C=CC(Br)=C1 SY004455 [2,0,0,0,0,0|1,0,0]=3 80 B10R1.30 COC1=CC(Br)=CC=C1C SY041361 [2,0,0,0,0,0|2,0,0]=4 81 B10R1.30 COC1=CC(Br)=CC=C1F SY014351 [2,0,0,0,0,0|2,0,0]=4 82 B10R1.30 COC1=CC(Br)=CC=C1I SY035398 [2,0,0,0,0,0|2,0,0]=4 83 B10R1.30 COC1=CC(C)=CC=C1I SY262824 [2,0,0,0,0,0|1,0,1]=4 84 B10R1.30 COC1=CC(C)=CC=C1N SY035523 [2,0,0,0,0,0|1,0,1]=4 85 B10R1.30 COC1=CC(C)=CC=C1O SY036778 [2,0,0,0,0,0|0,0,1]=3 86 B10R1.30 COC1=CC(Cl)=CC=C1N SY104152 [2,0,0,0,0,0|2,0,0]=4 87 B10R1.30 COC1=CC(Cl)=CC=C1O SY048539 [2,0,0,0,0,0|1,0,0]=3 88 B10R1.30 COC1=CC(F)=CC=C1N SY026829 [2,0,0,0,0,0|2,0,0]=4 89 B10R1.30 COC1=CC(F)=CC=C1O SY027495 [2,0,0,0,0,0|1,0,0]=3 90 B10R1.30 COC1=CC(I)=CC=C1Br SY024852 [2,0,0,0,0,0|2,0,0]=4 91 B10R1.30 COC1=CC(N)=CC=C1Br SY027521 [2,0,0,0,0,0|2,0,0]=4 92 B10R1.30 COC1=CC(N)=CC=C1C SY007315 [2,0,0,0,0,0|2,0,0]=4 93 B10R1.30 COC1=CC(N)=CC=C1F SY002987 [2,0,0,0,0,0|2,0,0]=4 94 B10R1.30 COC1=CC(N)=CC=C1O SY051139 [2,0,0,0,0,0|1,0,0]=3 95 B10R1.30 COC1=CC(O)=CC=C1Br SY027414 [2,0,0,0,0,0|1,0,1]=4 96 B10R1.30 COC1=CC(O)=CC=C1Br SY294049 [2,0,0,0,0,0|1,0,1]=4 97 B10R1.30 COC1=CC(O)=CC=C1Cl SY027442 [2,0,0,0,0,0|1,0,1]=4 98 B10R1.30 COC1=CC(O)=CC=C1F SY045539 [2,0,0,0,0,0|1,0,1]=4 99 B10R1.30 COC1=CC(O)=CC=C1N SY006410 [2,0,0,0,0,0|1,0,1]=4 100 B10R1.30 COC1=NC(Br)=CC=C1O SY278164 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.30 OCC1=C(O)C=CC(Br)=C1 SY017692 [2,0,0,0,0,0|2,0,0]=4 102 B10R1.172 C#CC1=CC(C=O)=CC=C1 SY273914 [2,0,0,0,0,0|0,0,2]=4 103 B10R1.172 C#CC1=CC=CC(OC)=C1 SY021654 [2,0,0,0,0,0|1,0,1]=4 104 B10R1.172 COC1=CC(C=O)=CC=C1 SY001070 [2,0,0,0,0,0|0,0,0]=2 105 B10R1.172 COC1=CC(C=O)=CC=N1 SY022287 [2,0,0,0,0,0|1,0,0]=3 106 B10R1.172 COC1=CC(C=O)=NC=C1 SY067656 [2,0,0,0,0,0|1,0,0]=3 107 B10R1.172 COC1=CC(CO)=CC=C1 SY017865 [2,0,0,0,0,0|0,0,2]=4 108 B10R1.172 COC1=CC(NN)=CC=C1 SY031446 [2,0,0,0,0,0|2,0,0]=4 109 B10R1.172 COC1=CC(ON)=CC=C1 SY282041 [2,0,0,0,0,0|2,0,0]=4 110 B10R1.172 COC1=CC(ON)=CC=C1 SY282042 [2,0,0,0,0,0|2,0,0]=4 111 B10R1.172 COC1=CC=CC(C=O)=N1 SY013134 [2,0,0,0,0,0|1,0,0]=3 112 B10R1.172 COC1=CC=CC(CN)=C1 SY004059 [2,0,0,0,0,0|1,0,1]=4 113 B10R1.172 COC1=CN=CC(C=O)=C1 SY002727 [2,0,0,0,0,0|1,0,0]=3 114 B10R1.172 N#CC1=CC(C=O)=CC=C1 SY009078 [2,0,0,0,0,0|1,0,1]=4 115 B10R1.172 O=CC1=CC=CC(C=O)=C1 SY007029 [2,0,0,0,0,0|1,0,1]=4 116 B10R1.172 O=CC1=CC=CC(CBr)=C1 SY033935 [2,0,0,0,0,0|1,0,0]=3 117 B10R1.172 O=CC1=CC=CC(CO)=C1 SY237876 [2,0,0,0,0,0|1,0,0]=3 118 B10R1.172 [C-]#[N+]C1=CC=CC(OC)=C1 SY263037 [2,0,0,0,0,0|2,0,0]=4 119 B10R1.176 C=CC1=CC=C(O)C(O)=C1 SY298155 [2,0,0,0,0,0|1,0,0]=3 120 B10R1.176 CC1=C(Br)C=CC(C=O)=N1 SY030886 [2,0,0,0,0,0|2,0,0]=4 121 B10R1.176 CC1=C(F)N=CC(C=O)=C1 SY066915 [2,0,0,0,0,0|2,0,0]=4 122 B10R1.176 CC1=CC(C=O)=CC=C1Br SY020689 [2,0,0,0,0,0|1,0,0]=3 123 B10R1.176 CC1=CC(C=O)=CC=C1F SY017835 [2,0,0,0,0,0|1,0,0]=3 124 B10R1.176 CC1=CC(C=O)=CN=C1Cl SY067101 [2,0,0,0,0,0|2,0,0]=4 125 B10R1.176 CC1=CC(C=O)=NC=C1Br SY111452 [2,0,0,0,0,0|2,0,0]=4 126 B10R1.176 CC1=CC=C(C=O)C=C1Br SY035903 [2,0,0,0,0,0|2,0,0]=4 127 B10R1.176 CC1=CC=C(C=O)C=C1C SY004808 [2,0,0,0,0,0|1,0,0]=3 128 B10R1.176 CC1=CC=C(C=O)C=C1Cl SY109951 [2,0,0,0,0,0|2,0,0]=4 129 B10R1.176 CC1=CC=C(C=O)C=C1F SY018906 [2,0,0,0,0,0|2,0,0]=4 130 B10R1.176 N#CC1=CC=C(O)C(O)=C1 SY001648 [2,0,0,0,0,0|1,0,1]=4 131 B10R1.176 NC1=CC=C(C=O)C=C1O SY274222 [2,0,0,0,0,0|1,0,0]=3 132 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 SY014362 [2,0,0,0,0,0|2,0,0]=4 133 B10R1.176 O=CC1=CC(F)=C(O)C=C1 SY016482 [2,0,0,0,0,0|1,0,0]=3 134 B10R1.176 O=CC1=CC=C(Br)C(Br)=C1 SY059440 [2,0,0,0,0,0|2,0,0]=4 135 B10R1.176 O=CC1=CC=C(Br)C(Cl)=C1 SY014683 [2,0,0,0,0,0|2,0,0]=4 136 B10R1.176 O=CC1=CC=C(Cl)C(Br)=C1 SY014684 [2,0,0,0,0,0|2,0,0]=4 137 B10R1.176 O=CC1=CC=C(Cl)C(F)=C1 SY013909 [2,0,0,0,0,0|2,0,0]=4 138 B10R1.176 O=CC1=CC=C(Cl)C(O)=C1 SY104928 [2,0,0,0,0,0|1,0,0]=3 139 B10R1.176 O=CC1=CC=C(F)C(Br)=C1 SY001679 [2,0,0,0,0,0|2,0,0]=4 140 B10R1.176 O=CC1=CC=C(F)C(Cl)=C1 SY001803 [2,0,0,0,0,0|2,0,0]=4 141 B10R1.176 O=CC1=CC=C(F)C(F)=C1 SY001586 [2,0,0,0,0,0|2,0,0]=4 142 B10R1.176 O=CC1=CC=C(O)C(Br)=C1 SY040634 [2,0,0,0,0,0|1,0,0]=3 143 B10R1.176 O=CC1=CC=C(O)C(Cl)=C1 SY009040 [2,0,0,0,0,0|1,0,0]=3 144 B10R1.176 O=CC1=CC=C(O)C(I)=C1 SY082945 [2,0,0,0,0,0|1,0,0]=3 145 B10R1.176 O=CC1=CC=C(O)C(O)=C1 SY001411 [2,0,0,0,0,0|0,0,0]=2 146 B10R1.176 O=CC1=CN=C(O)C(Cl)=C1 SY229656 [2,0,0,0,0,0|2,0,0]=4 147 B12R1.268 CCOC1=C(C#N)C=CC(Br)=C1 SY023236 [1,1,0,0,0,0|2,0,0]=4 148 B12R1.268 CCOC1=CC(Br)=CC=C1OC SY263068 [1,1,0,0,0,0|1,0,0]=3 149 B12R1.268 COC1=C(OCCl)C=C(F)C=C1 SY298520 [1,1,0,0,0,0|2,0,0]=4 150 B12R1.354 CCC(=O)C1=CC(Cl)=CC=C1O SY129597 [1,1,0,0,0,0|2,0,0]=4 151 B12R1.374 BrCCOC1=CC(Br)=CC=C1Br SY059668 [1,1,0,0,0,0|2,0,0]=4 152 B12R1.374 CCNCC1=CC(Br)=CC=C1O SY018707 [1,1,0,0,0,0|2,0,0]=4 153 B12R1.374 CCNCC1=CC(Cl)=CC=C1O SY018709 [1,1,0,0,0,0|2,0,0]=4 154 B12R1.374 CCNCC1=CC(F)=CC=C1O SY018705 [1,1,0,0,0,0|2,0,0]=4 155 B12R1.374 COCOC1=CC(Br)=CC=C1F SY284152 [1,1,0,0,0,0|2,0,0]=4 156 B12R1.374 OCCOC1=CC(Br)=CC=C1Br SY059675 [1,1,0,0,0,0|2,0,0]=4 157 B12R1.279 CCOC1=CC(B(O)O)=CC=C1 SY024923 [1,1,0,0,0,0|1,0,1]=4 158 B12R1.279 CCOC1=CC=CC(C(=O)O)=C1 SY003340 [1,1,0,0,0,0|0,0,0]=2 159 B12R1.279 CCOC1=NC=CC([N+](=O)[O-])=C1 SY013191 [1,1,0,0,0,0|2,0,0]=4 160 B12R1.382 C=CCOC1=CC(C=O)=CC=C1 SY025669 [1,1,0,0,0,0|0,0,1]=3 161 B12R1.382 COC1=CC(OCCN)=CC=C1 SY008274 [1,1,0,0,0,0|2,0,0]=4 162 B12R1.382 N#CC1=CC(OCCN)=CC=C1 SY008280 [1,1,0,0,0,0|1,0,1]=4 163 B12R1.435 COC(=O)C1=CC(C=O)=CC=C1 SY004534 [1,1,0,0,0,0|2,0,0]=4 164 B12R1.438 O=CC1=CC(OC(F)F)=NC=C1 SY277876 [1,1,0,0,0,0|2,0,0]=4 165 B12R1.438 O=CC1=CC=CC(OC(F)F)=C1 SY062608 [1,1,0,0,0,0|1,0,0]=3 166 B12R1.56 CCC1=CC(B(O)O)=CC=C1O SY266977 [1,1,0,0,0,0|1,0,1]=4 167 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=C1 SY012299 [1,1,0,0,0,0|1,0,0]=3 168 B12R1.56 COC1=C(Br)C=CC([N+](=O)[O-])=C1 SY010666 [1,1,0,0,0,0|2,0,0]=4 169 B12R1.56 COC1=C(Cl)C=CC([N+](=O)[O-])=C1 SY010997 [1,1,0,0,0,0|2,0,0]=4 170 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 SY013659 [1,1,0,0,0,0|1,0,0]=3 171 B12R1.56 COC1=C(F)C=CC([N+](=O)[O-])=C1 SY014355 [1,1,0,0,0,0|2,0,0]=4 172 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 SY009075 [1,1,0,0,0,0|1,0,0]=3 173 B12R1.56 COC1=C(O)C=CC(N(=O)=O)=C1 SY004543 [1,1,0,0,0,0|1,0,0]=3 174 B12R1.56 COC1=CC(C(=O)O)=CC=C1C SY005692 [1,1,0,0,0,0|1,0,0]=3 175 B12R1.56 COC1=CC(C(=O)O)=CC=C1O SY001450 [1,1,0,0,0,0|0,0,0]=2 176 B12R1.56 COC1=CC(C(C)=O)=CC=C1Br SY035677 [1,1,0,0,0,0|1,0,0]=3 177 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1C SY008149 [1,1,0,0,0,0|2,0,0]=4 178 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1I SY025092 [1,1,0,0,0,0|2,0,0]=4 179 B12R1.56 NCC1=CC(C(=O)O)=CC=C1F SY250007 [1,1,0,0,0,0|2,0,0]=4 180 B12R1.56 O=CC1=CC(C(=O)O)=CC=C1O SY110468 [1,1,0,0,0,0|1,0,1]=4 181 B12R1.78 C#CC1=CC=C(OC)C(OC)=C1 SY036899 [1,1,0,0,0,0|1,0,1]=4 182 B12R1.78 C=CC1=CC=C(OC)C(OC)=C1 SY032032 [1,1,0,0,0,0|1,0,0]=3 183 B12R1.78 CCC1=CC=C(OC)C(OC)=C1 SY115240 [1,1,0,0,0,0|1,0,1]=4 184 B12R1.78 COC1=CC=C(C=O)C=C1OC SY004136 [1,1,0,0,0,0|0,0,0]=2 185 B12R1.78 COC1=CC=C(CCl)C=C1OC SY028529 [1,1,0,0,0,0|1,0,1]=4 186 B12R1.78 COC1=CC=C(CO)C(OC)=C1 SY027624 [1,1,0,0,0,0|2,0,0]=4 187 B12R1.78 COC1=CC=C(CO)C=C1OC SY001541 [1,1,0,0,0,0|0,0,2]=4 188 B12R1.78 COC1=CC=C(OC)C(OC)=C1 SY014691 [1,1,0,0,0,0|2,0,0]=4 189 B12R1.78 COC1=CC=C(ON)C(OC)=C1 SY282209 [1,1,0,0,0,0|2,0,0]=4 190 B12R1.78 COC1=CC=C(ON)C(OC)=C1 SY282210 [1,1,0,0,0,0|2,0,0]=4 191 B12R1.78 COC1=CC=C(ON)C=C1OC SY282138 [1,1,0,0,0,0|2,0,0]=4 192 B12R1.78 COC1=CC=C(ON)C=C1OC SY282139 [1,1,0,0,0,0|2,0,0]=4 193 B12R1.300 CCC1=CC(C#N)=CC(C)=C1O SY129779 [1,1,0,0,0,0|1,0,1]=4 194 B12R1.300 COC1=C(O)C(Br)=CC(C=O)=C1 SY017954 [1,1,0,0,0,0|0,0,0]=2 195 B12R1.300 COC1=C(O)C(F)=CC(C=O)=C1 SY031494 [1,1,0,0,0,0|0,0,0]=2 196 B12R1.300 COC1=C(O)C(I)=CC(C=O)=C1 SY048617 [1,1,0,0,0,0|0,0,0]=2 197 B12R1.449 COC1=C(Br)C=C(O)C(C=O)=C1 SY025557 [1,1,0,0,0,0|1,0,0]=3 198 B12R1.449 COC1=C(Cl)C=C(O)C(C=O)=C1 SY233058 [1,1,0,0,0,0|1,0,0]=3 199 B12R1.449 COC1=C(F)C=C(F)C(C=O)=C1 SY027572 [1,1,0,0,0,0|1,0,0]=3 200 B12R1.449 COC1=C(O)C=C(Br)C(C=O)=C1 SY026935 [1,1,0,0,0,0|0,0,0]=2 201 B12R1.449 COC1=C(O)C=C(O)C(C=O)=C1 SY264741 [1,1,0,0,0,0|0,0,0]=2 202 B12R1.453 COC1=CC=C(O)C(C(C)C)=C1 SY023037 [1,1,0,0,0,0|2,0,0]=4 203 B12R1.453 O=CC1=CC(C(=O)O)=C(O)C=C1 SY003307 [1,1,0,0,0,0|1,0,1]=4 204 B12R1.453 O=CC1=CC=C(O)C([N+](=O)[O-])=C1 SY003511 [1,1,0,0,0,0|2,0,0]=4 205 B14R1.2336 O=CC1=CC=C(O)C(OC(F)(F)F)=C1 SY023030 [0,2,0,0,0,0|1,0,0]=3 206 B14R1.3723 COC1=CC=C(C=O)C=C1OC(C)=O SY017392 [0,2,0,0,0,0|0,0,1]=3 207 B14R1.441 CCOC1=CC(C(F)F)=CC=C1OC SY265734 [0,2,0,0,0,0|1,0,1]=4 208 B14R1.2315 COC(=O)C1=CC(C=O)=CC=C1OC SY002305 [0,2,0,0,0,0|2,0,0]=4 209 B12R1.312 CCOC(=O)C1=CC=C(C=O)N1 SY101682 [0,0,1,1,0,0|2,0,0]=4 210 B12R2.24 BrC1=CC=C2NCCOC2=C1 SY024400 [1,0,0,1,0,0|2,0,0]=4 211 B12R2.24 BrC1=CC=C2NCCOC2=C1 SY102184 [1,0,0,1,0,0|2,0,0]=4 212 B12R2.24 BrC1=CC=C2OCCCC2=C1 SY101625 [1,0,0,1,0,0|2,0,0]=4 213 B12R2.24 BrC1=CC=C2OCCNC2=C1 SY056883 [1,0,0,1,0,0|2,0,0]=4 214 B12R2.24 BrC1=CC=C2OCCOC2=C1 SY014054 [1,0,0,1,0,0|1,0,0]=3 215 B12R2.24 BrC1=CN=C2OCCOC2=C1 SY045906 [1,0,0,1,0,0|2,0,0]=4 216 B12R2.24 CC1=CC=C2NCCOC2=C1 SY130742 [1,0,0,1,0,0|1,0,1]=4 217 B12R2.24 ClC1=CC=C2NCCOC2=C1 SY105077 [1,0,0,1,0,0|2,0,0]=4 218 B12R2.24 ClC1=CC=C2OCCNC2=C1 SY130738 [1,0,0,1,0,0|2,0,0]=4 219 B12R2.24 FC1=CC=C2NCCOC2=C1 SY130739 [1,0,0,1,0,0|2,0,0]=4 220 B12R2.24 FC1=CC=C2OCCNC2=C1 SY045510 [1,0,0,1,0,0|2,0,0]=4 221 B12R2.24 NC1=CC=C2NCCOC2=C1 SY130748 [1,0,0,1,0,0|2,0,0]=4 222 B12R2.24 NC1=CC=C2OCCNC2=C1 SY130747 [1,0,0,1,0,0|2,0,0]=4 223 B12R2.24 NC1=CC=C2OCCOC2=N1 SY253549 [1,0,0,1,0,0|2,0,0]=4 224 B12R2.24 OC1=CC2=C(C=C1)NCCO2 SY014537 [1,0,0,1,0,0|1,0,1]=4 225 B12R2.24 OC1=CC=C2OCCOC2=C1 SY017444 [1,0,0,1,0,0|0,0,1]=3 226 B12R2.44 C(=O)C1=CC2=C(C=C1)OCC2 SY003331 [1,0,0,1,0,0|2,0,0]=4 227 B12R2.44 O=CC1=CC=C2C=COC2=C1 SY026601 [1,0,0,1,0,0|0,0,2]=4 228 B12R2.315 O=CC1=C2C=COC2=CC=C1 SY024355 [1,0,0,1,0,0|0,0,2]=4 229 B12R2.315 O=CC1=C2OCOC2=CC=C1 SY040440 [1,0,0,1,0,0|1,0,0]=3 230 B14R2.3303 O=CC1=CC2=C(C=C1)OC(F)(F)O2 SY009382 [0,1,0,1,0,0|1,0,0]=3 231 B14R2.601 CC1=NC2=CC(C(=O)O)=CC=C2O1 SY056798 [0,1,0,1,0,0|1,0,1]=4 232 B14R2.601 CC1=NC2=CC=C(C(=O)O)C=C2O1 SY015995 [0,1,0,1,0,0|1,0,1]=4 233 B14R2.781 CC(=O)C1=CC2=C(C=C1)OCCO2 SY021598 [0,1,0,1,0,0|0,0,0]=2 234 B14R2.781 FC(F)C1=CC=C2OCCOC2=C1 SY265637 [0,1,0,1,0,0|1,0,1]=4 235 B14R2.781 O=C(O)C1=CC2=C(C=C1)NCCC2 SY003732 [0,1,0,1,0,0|2,0,0]=4 236 B14R2.781 O=C(O)C1=CC2=C(C=C1)NCCC2 SY031266 [0,1,0,1,0,0|2,0,0]=4 237 B14R2.781 O=C(O)C1=CC=C2OCCOC2=C1 SY005169 [0,1,0,1,0,0|0,0,0]=2 238 B14R2.781 O=[N+]([O-])C1=CC=C2NCCOC2=C1 SY107093 [0,1,0,1,0,0|2,0,0]=4 239 B14R2.781 O=[N+]([O-])C1=CC=C2OCCNC2=C1 SY130733 [0,1,0,1,0,0|2,0,0]=4 240 B14R2.781 OB(O)C1=CC2=C(C=C1)OCCO2 SY021600 [0,1,0,1,0,0|1,0,1]=4 241 B12R1.114 CCOC1=CC=C(C=O)C=C1Br SY041357 [0,0,0,0,1,1|1,0,0]=3