0 B9R1.8 C1=CC(=CN=C1)CC#N P137656 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.8 C1=CC(=CN=C1)CCN A151786 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.8 C1=CC(=CN=C1)CCN A169450 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.8 C1=CC=C(C=C1)C#CBr B464040 [0,0,0,0,0,0|2,0,2]=4 4 B9R1.8 C1=CC=C(C=C1)C#CCl C464026 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.8 C1=CC=C(C=C1)C=CBr B152003 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.8 C1=CC=C(C=C1)C=NN B589372 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.8 C1=CC=C(C=C1)C=NO T135657 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.8 C1=CC=C(C=C1)CC=O P105078 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.8 C1=CC=C(C=C1)CC=O P105080 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.8 C1=CC=C(C=C1)CC=O P420978 [0,0,0,0,0,0|2,0,1]=3 11 B9R1.8 C1=CC=C(C=C1)CCBr B106895 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.8 C1=CC=C(C=C1)CCCl C136679 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.8 C1=CC=C(C=C1)CCI I138375 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.8 C1=CC=C(C=C1)CCN P105641 [0,0,0,0,0,0|2,0,0]=2 15 B9R1.8 C1=CC=C(C=C1)CCN P160641 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.8 C1=CC=C(C=C1)CCN P290339 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.8 C1=CC=C(C=C1)CCN P408003 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.8 C1=CC=C(C=C1)CCN P421867 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.8 C1=CC=C(C=C1)CCN P425250 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.8 C1=CC=C(C=C1)CCN P491880 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.8 C1=CC=C(C=C1)CCN P493037 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.8 C1=CC=C(C=C1)CCN P493125 [0,0,0,0,0,0|2,0,0]=2 23 B9R1.8 C1=CC=C(C=C1)CCO P108195 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.8 C1=CC=C(C=C1)CCO P108197 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.8 C1=CC=C(C=C1)CCO P424995 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.8 C1=CC=C(C=C1)CCS P160530 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.8 C1=CC=C(C=C1)CNN B122576 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.8 C1=CC=C(C=C1)CNN B137990 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.8 C1=CC=C(C=C1)CNN B464175 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.8 C1=CC=C(C=C1)CNO I137166 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.8 C1=CC=C(C=C1)CON O159948 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.8 C1=CC=C(C=C1)CON O189173 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.8 C1=CC=C(C=C1)N=C=O P304914 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.8 C1=CC=C(C=C1)N=C=S P110634 [0,0,0,0,0,0|3,0,1]=4 35 B9R1.8 C1=CC=C(C=C1)N=C=S P110635 [0,0,0,0,0,0|3,0,1]=4 36 B9R1.8 C1=CC=C(C=C1)N=C=S P110636 [0,0,0,0,0,0|3,0,1]=4 37 B9R1.8 C1=CC=C(C=C1)N=S=O N159148 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.8 C1=CC=C(C=C1)N=[N+]=[N-] A462925 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.8 C1=CC=C(C=C1)NC=O F112354 [0,0,0,0,0,0|3,0,1]=4 40 B9R1.8 C1=CC=C(C=C1)OC=O P305264 [0,0,0,0,0,0|3,0,1]=4 41 B9R1.8 C1=CC=C(C=C1)SCCl C101827 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.8 C1=CC=C(C=C1)[Se]C#N P168654 [0,0,0,0,0,0|3,0,1]=4 43 B9R1.8 C1=CC=NC(=C1)C=NO P160056 [0,0,0,0,0,0|2,0,1]=3 44 B9R1.8 C1=CC=NC(=C1)CC#N P160781 [0,0,0,0,0,0|1,0,1]=2 45 B9R1.8 C1=CC=NC(=C1)CCBr B186289 [0,0,0,0,0,0|1,0,0]=1 46 B9R1.8 C1=CC=NC(=C1)CCN A151790 [0,0,0,0,0,0|1,0,0]=1 47 B9R1.8 C1=CC=NC(=C1)CCO P160791 [0,0,0,0,0,0|1,0,0]=1 48 B9R1.8 C1=CC=[N+](C=C1)CC#N C154126 [0,0,0,0,0,0|3,0,1]=4 49 B9R1.8 C1=CN=C(C=N1)CCS M103122 [0,0,0,0,0,0|2,0,0]=2 50 B9R1.8 C1=CN=CC=C1CC#N D302357 [0,0,0,0,0,0|3,0,1]=4 51 B9R1.8 C1=CN=CC=C1CC#N P304979 [0,0,0,0,0,0|3,0,1]=4 52 B9R1.8 C1=CN=CC=C1CCN A109738 [0,0,0,0,0,0|3,0,0]=3 53 B9R1.8 C1=CN=CC=C1CCS P134707 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.8 C1=CN=CC=C1CCS P478833 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.8 C=CCC1=CC=CC=C1 A101037 [0,0,0,0,0,0|1,0,2]=3 56 B9R1.8 C=CSC1=CC=CC=C1 P101810 [0,0,0,0,0,0|2,0,2]=4 57 B9R1.8 C=C[CH-]C1=CC=CC=C1 P129181 [0,0,0,0,0,0|1,0,3]=4 58 B9R1.8 CC#CC1=CC=CC=C1 P141240 [0,0,0,0,0,0|1,0,2]=3 59 B9R1.8 CC=CC1=CC=CC=C1 C153576 [0,0,0,0,0,0|1,0,2]=3 60 B9R1.8 CC=CC1=CC=CC=C1 M136687 [0,0,0,0,0,0|1,0,2]=3 61 B9R1.8 CC=CC1=CC=CC=C1 T134052 [0,0,0,0,0,0|1,0,2]=3 62 B9R1.8 CC=CC1=CC=CC=C1 T301941 [0,0,0,0,0,0|1,0,2]=3 63 B9R1.8 CCCC1=CC=CC=C1 P104621 [0,0,0,0,0,0|1,0,0]=1 64 B9R1.8 CCCC1=CC=CC=C1 P104624 [0,0,0,0,0,0|1,0,0]=1 65 B9R1.8 CCCC1=CC=CC=C1 P104625 [0,0,0,0,0,0|1,0,0]=1 66 B9R1.8 CCCC1=CC=CC=C1 P104626 [0,0,0,0,0,0|1,0,0]=1 67 B9R1.8 CCCC1=CC=CC=C1 P128158 [0,0,0,0,0,0|1,0,0]=1 68 B9R1.8 CCCC1=CC=CC=N1 P160637 [0,0,0,0,0,0|0,0,0]=0 69 B9R1.8 CCCC1=CC=NC=C1 P160632 [0,0,0,0,0,0|2,0,0]=2 70 B9R1.8 CCCC1=NC=CN=C1 P132679 [0,0,0,0,0,0|1,0,0]=1 71 B9R1.8 CCC[N+]1=CC=CC=C1 P404861 [0,0,0,0,0,0|2,0,0]=2 72 B9R1.8 CCNC1=CC=CC=C1 E103974 [0,0,0,0,0,0|2,0,0]=2 73 B9R1.8 CCOC1=CC=CC=C1 E108654 [0,0,0,0,0,0|2,0,0]=2 74 B9R1.8 CCOC1=CC=CC=C1 E108655 [0,0,0,0,0,0|2,0,0]=2 75 B9R1.8 CCOC1=CC=CC=N1 E137467 [0,0,0,0,0,0|1,0,0]=1 76 B9R1.8 CCOC1=NC=CN=C1 E136587 [0,0,0,0,0,0|2,0,0]=2 77 B9R1.8 CCSC1=CC=CC=C1 E101809 [0,0,0,0,0,0|2,0,0]=2 78 B9R1.8 CNCC1=CC=CC=C1 B106919 [0,0,0,0,0,0|2,0,0]=2 79 B9R1.8 CNCC1=CC=CC=N1 M168526 [0,0,0,0,0,0|1,0,0]=1 80 B9R1.8 CNCC1=CN=CC=C1 M138441 [0,0,0,0,0,0|3,0,0]=3 81 B9R1.8 COCC1=CC=CC=C1 B103161 [0,0,0,0,0,0|2,0,0]=2 82 B9R1.8 COCC1=CC=CC=C1 B591251 [0,0,0,0,0,0|2,0,0]=2 83 B9R1.8 CSCC1=CC=CC=C1 B152510 [0,0,0,0,0,0|2,0,0]=2 84 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B153177 [0,0,0,0,0,0|2,0,1]=3 85 B8R1.2 C#CC1=CC=CC=C1 P107030 [1,0,0,0,0,0|1,0,2]=4 86 B8R1.2 C#CC1=CC=CC=C1 P332820 [1,0,0,0,0,0|1,0,2]=4 87 B8R1.2 C#CC1=CC=CC=N1 E106166 [1,0,0,0,0,0|0,0,2]=3 88 B8R1.2 C#CC1=NC=CC=N1 E170018 [1,0,0,0,0,0|1,0,2]=4 89 B8R1.2 C1=CC(=CN=C1)CBr B137612 [1,0,0,0,0,0|3,0,0]=4 90 B8R1.2 C1=CC(=CN=C1)CCl P135883 [1,0,0,0,0,0|3,0,0]=4 91 B8R1.2 C1=CC(=CN=C1)CN P160053 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.2 C1=CC(=CN=C1)CO P106580 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.2 C1=CC(=NN=C1)C#N P170871 [1,0,0,0,0,0|2,0,1]=4 94 B8R1.2 C1=CC=C(C=C1)C#N B104457 [1,0,0,0,0,0|2,0,1]=4 95 B8R1.2 C1=CC=C(C=C1)C#N B104458 [1,0,0,0,0,0|2,0,1]=4 96 B8R1.2 C1=CC=C(C=C1)C#N B110114 [1,0,0,0,0,0|2,0,1]=4 97 B8R1.2 C1=CC=C(C=C1)C#N B113726 [1,0,0,0,0,0|2,0,1]=4 98 B8R1.2 C1=CC=C(C=C1)C#N B119686 [1,0,0,0,0,0|2,0,1]=4 99 B8R1.2 C1=CC=C(C=C1)C#N B121683 [1,0,0,0,0,0|2,0,1]=4 100 B8R1.2 C1=CC=C(C=C1)C=O B110459 [1,0,0,0,0,0|2,0,1]=4 101 B8R1.2 C1=CC=C(C=C1)C=O B110460 [1,0,0,0,0,0|2,0,1]=4 102 B8R1.2 C1=CC=C(C=C1)C=O B110463 [1,0,0,0,0,0|2,0,1]=4 103 B8R1.2 C1=CC=C(C=C1)C=O B110464 [1,0,0,0,0,0|2,0,1]=4 104 B8R1.2 C1=CC=C(C=C1)C=O B266083 [1,0,0,0,0,0|2,0,1]=4 105 B8R1.2 C1=CC=C(C=C1)C=O B420281 [1,0,0,0,0,0|2,0,1]=4 106 B8R1.2 C1=CC=C(C=C1)C=O B472001 [1,0,0,0,0,0|2,0,1]=4 107 B8R1.2 C1=CC=C(C=C1)CBr B108549 [1,0,0,0,0,0|2,0,0]=3 108 B8R1.2 C1=CC=C(C=C1)CBr B471999 [1,0,0,0,0,0|2,0,0]=3 109 B8R1.2 C1=CC=C(C=C1)CBr B472021 [1,0,0,0,0,0|2,0,0]=3 110 B8R1.2 C1=CC=C(C=C1)CCl B110580 [1,0,0,0,0,0|2,0,0]=3 111 B8R1.2 C1=CC=C(C=C1)CCl B110581 [1,0,0,0,0,0|2,0,0]=3 112 B8R1.2 C1=CC=C(C=C1)CCl B110582 [1,0,0,0,0,0|2,0,0]=3 113 B8R1.2 C1=CC=C(C=C1)CCl B141153 [1,0,0,0,0,0|2,0,0]=3 114 B8R1.2 C1=CC=C(C=C1)CCl B431204 [1,0,0,0,0,0|2,0,0]=3 115 B8R1.2 C1=CC=C(C=C1)CCl B472028 [1,0,0,0,0,0|2,0,0]=3 116 B8R1.2 C1=CC=C(C=C1)CCl B472041 [1,0,0,0,0,0|2,0,0]=3 117 B8R1.2 C1=CC=C(C=C1)CN A348464 [1,0,0,0,0,0|2,0,0]=3 118 B8R1.2 C1=CC=C(C=C1)CN B108477 [1,0,0,0,0,0|2,0,0]=3 119 B8R1.2 C1=CC=C(C=C1)CN B152179 [1,0,0,0,0,0|2,0,0]=3 120 B8R1.2 C1=CC=C(C=C1)CN B152887 [1,0,0,0,0,0|2,0,0]=3 121 B8R1.2 C1=CC=C(C=C1)CN B152949 [1,0,0,0,0,0|2,0,0]=3 122 B8R1.2 C1=CC=C(C=C1)CN B304428 [1,0,0,0,0,0|2,0,0]=3 123 B8R1.2 C1=CC=C(C=C1)CN B485378 [1,0,0,0,0,0|2,0,0]=3 124 B8R1.2 C1=CC=C(C=C1)CN P493007 [1,0,0,0,0,0|2,0,0]=3 125 B8R1.2 C1=CC=C(C=C1)CN P493016 [1,0,0,0,0,0|2,0,0]=3 126 B8R1.2 C1=CC=C(C=C1)CN P493100 [1,0,0,0,0,0|2,0,0]=3 127 B8R1.2 C1=CC=C(C=C1)CO B108199 [1,0,0,0,0,0|2,0,0]=3 128 B8R1.2 C1=CC=C(C=C1)CO B108202 [1,0,0,0,0,0|2,0,0]=3 129 B8R1.2 C1=CC=C(C=C1)CO B108203 [1,0,0,0,0,0|2,0,0]=3 130 B8R1.2 C1=CC=C(C=C1)CO B108204 [1,0,0,0,0,0|2,0,0]=3 131 B8R1.2 C1=CC=C(C=C1)CO B108205 [1,0,0,0,0,0|2,0,0]=3 132 B8R1.2 C1=CC=C(C=C1)CO B163018 [1,0,0,0,0,0|2,0,0]=3 133 B8R1.2 C1=CC=C(C=C1)CO B346959 [1,0,0,0,0,0|2,0,0]=3 134 B8R1.2 C1=CC=C(C=C1)CO B420278 [1,0,0,0,0,0|2,0,0]=3 135 B8R1.2 C1=CC=C(C=C1)CO B472101 [1,0,0,0,0,0|2,0,0]=3 136 B8R1.2 C1=CC=C(C=C1)CS B109256 [1,0,0,0,0,0|2,0,0]=3 137 B8R1.2 C1=CC=C(C=C1)I=O I157626 [1,0,0,0,0,0|3,0,0]=4 138 B8R1.2 C1=CC=C(C=C1)N=O N159156 [1,0,0,0,0,0|3,0,0]=4 139 B8R1.2 C1=CC=C(C=C1)NN P104684 [1,0,0,0,0,0|3,0,0]=4 140 B8R1.2 C1=CC=C(C=C1)NN P108563 [1,0,0,0,0,0|3,0,0]=4 141 B8R1.2 C1=CC=C(C=C1)NN P112739 [1,0,0,0,0,0|3,0,0]=4 142 B8R1.2 C1=CC=C(C=C1)NN P579459 [1,0,0,0,0,0|3,0,0]=4 143 B8R1.2 C1=CC=C(C=C1)NO N131374 [1,0,0,0,0,0|3,0,0]=4 144 B8R1.2 C1=CC=C(C=C1)ON O464484 [1,0,0,0,0,0|3,0,0]=4 145 B8R1.2 C1=CC=C(C=C1)[As]=O P336440 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.2 C1=CC=C(C=C1)[Hg]Cl P598721 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.2 C1=CC=C(C=C1)[Se]Cl P160704 [1,0,0,0,0,0|3,0,0]=4 148 B8R1.2 C1=CC=NC(=C1)C#N P106583 [1,0,0,0,0,0|1,0,1]=3 149 B8R1.2 C1=CC=NC(=C1)C=O P105912 [1,0,0,0,0,0|1,0,1]=3 150 B8R1.2 C1=CC=NC(=C1)CBr B169474 [1,0,0,0,0,0|1,0,0]=2 151 B8R1.2 C1=CC=NC(=C1)CCl C117226 [1,0,0,0,0,0|1,0,0]=2 152 B8R1.2 C1=CC=NC(=C1)CN P107146 [1,0,0,0,0,0|1,0,0]=2 153 B8R1.2 C1=CC=NC(=C1)CO P106578 [1,0,0,0,0,0|1,0,0]=2 154 B8R1.2 C1=CC=NC(=C1)NN H133458 [1,0,0,0,0,0|2,0,0]=3 155 B8R1.2 C1=CN=C(C=N1)C#N P121629 [1,0,0,0,0,0|2,0,1]=4 156 B8R1.2 C1=CN=C(C=N1)C=O P176847 [1,0,0,0,0,0|2,0,1]=4 157 B8R1.2 C1=CN=C(C=N1)CN P175485 [1,0,0,0,0,0|2,0,0]=3 158 B8R1.2 C1=CN=C(C=N1)NN H176751 [1,0,0,0,0,0|3,0,0]=4 159 B8R1.2 C1=CN=C(N=C1)C#N P121628 [1,0,0,0,0,0|2,0,1]=4 160 B8R1.2 C1=CN=C(N=C1)CN P176301 [1,0,0,0,0,0|2,0,0]=3 161 B8R1.2 C1=CN=C(N=C1)CO P176469 [1,0,0,0,0,0|2,0,0]=3 162 B8R1.2 C1=CN=C(N=C1)NN H186413 [1,0,0,0,0,0|3,0,0]=4 163 B8R1.2 C1=CN=CC=C1CBr B135280 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.2 C1=CN=CC=C1CCl C107154 [1,0,0,0,0,0|3,0,0]=4 165 B8R1.2 C1=CN=CC=C1CN A107215 [1,0,0,0,0,0|3,0,0]=4 166 B8R1.2 C1=CN=CC=C1CN P194376 [1,0,0,0,0,0|3,0,0]=4 167 B8R1.2 C1=CN=CC=C1CO P107414 [1,0,0,0,0,0|3,0,0]=4 168 B8R1.2 C1=CN=CN=C1CO P176166 [1,0,0,0,0,0|2,0,0]=3 169 B8R1.2 C=CC1=CC=CC=C1 A304890 [1,0,0,0,0,0|1,0,2]=4 170 B8R1.2 C=CC1=CC=CC=C1 P107084 [1,0,0,0,0,0|1,0,2]=4 171 B8R1.2 C=CC1=CC=CC=C1 P107085 [1,0,0,0,0,0|1,0,2]=4 172 B8R1.2 C=CC1=CC=CC=C1 P107086 [1,0,0,0,0,0|1,0,2]=4 173 B8R1.2 C=CC1=CC=CC=C1 P107087 [1,0,0,0,0,0|1,0,2]=4 174 B8R1.2 C=CC1=CC=CC=C1 P107088 [1,0,0,0,0,0|1,0,2]=4 175 B8R1.2 C=CC1=CC=CC=C1 P107089 [1,0,0,0,0,0|1,0,2]=4 176 B8R1.2 C=CC1=CC=CC=C1 P107090 [1,0,0,0,0,0|1,0,2]=4 177 B8R1.2 C=CC1=CC=CC=C1 P107091 [1,0,0,0,0,0|1,0,2]=4 178 B8R1.2 C=CC1=CC=CC=C1 P107772 [1,0,0,0,0,0|1,0,2]=4 179 B8R1.2 C=CC1=CC=CC=C1 P107773 [1,0,0,0,0,0|1,0,2]=4 180 B8R1.2 C=CC1=CC=CC=C1 P107774 [1,0,0,0,0,0|1,0,2]=4 181 B8R1.2 C=CC1=CC=CC=C1 P107775 [1,0,0,0,0,0|1,0,2]=4 182 B8R1.2 C=CC1=CC=CC=C1 P107776 [1,0,0,0,0,0|1,0,2]=4 183 B8R1.2 C=CC1=CC=CC=C1 P107777 [1,0,0,0,0,0|1,0,2]=4 184 B8R1.2 C=CC1=CC=CC=C1 P107778 [1,0,0,0,0,0|1,0,2]=4 185 B8R1.2 C=CC1=CC=CC=C1 P107779 [1,0,0,0,0,0|1,0,2]=4 186 B8R1.2 C=CC1=CC=CC=C1 P107780 [1,0,0,0,0,0|1,0,2]=4 187 B8R1.2 C=CC1=CC=CC=C1 P107782 [1,0,0,0,0,0|1,0,2]=4 188 B8R1.2 C=CC1=CC=CC=C1 P107783 [1,0,0,0,0,0|1,0,2]=4 189 B8R1.2 C=CC1=CC=CC=C1 P107784 [1,0,0,0,0,0|1,0,2]=4 190 B8R1.2 C=CC1=CC=CC=C1 P107786 [1,0,0,0,0,0|1,0,2]=4 191 B8R1.2 C=CC1=CC=CC=C1 P107787 [1,0,0,0,0,0|1,0,2]=4 192 B8R1.2 C=CC1=CC=CC=C1 P107789 [1,0,0,0,0,0|1,0,2]=4 193 B8R1.2 C=CC1=CC=CC=C1 P107790 [1,0,0,0,0,0|1,0,2]=4 194 B8R1.2 C=CC1=CC=CC=C1 P107791 [1,0,0,0,0,0|1,0,2]=4 195 B8R1.2 C=CC1=CC=CC=C1 P107792 [1,0,0,0,0,0|1,0,2]=4 196 B8R1.2 C=CC1=CC=CC=C1 P107793 [1,0,0,0,0,0|1,0,2]=4 197 B8R1.2 C=CC1=CC=CC=C1 P107794 [1,0,0,0,0,0|1,0,2]=4 198 B8R1.2 C=CC1=CC=CC=C1 P107795 [1,0,0,0,0,0|1,0,2]=4 199 B8R1.2 C=CC1=CC=CC=C1 P107796 [1,0,0,0,0,0|1,0,2]=4 200 B8R1.2 C=CC1=CC=CC=C1 P107797 [1,0,0,0,0,0|1,0,2]=4 201 B8R1.2 C=CC1=CC=CC=C1 P107798 [1,0,0,0,0,0|1,0,2]=4 202 B8R1.2 C=CC1=CC=CC=C1 P107801 [1,0,0,0,0,0|1,0,2]=4 203 B8R1.2 C=CC1=CC=CC=C1 P107802 [1,0,0,0,0,0|1,0,2]=4 204 B8R1.2 C=CC1=CC=CC=C1 P107803 [1,0,0,0,0,0|1,0,2]=4 205 B8R1.2 C=CC1=CC=CC=C1 P107804 [1,0,0,0,0,0|1,0,2]=4 206 B8R1.2 C=CC1=CC=CC=C1 P107805 [1,0,0,0,0,0|1,0,2]=4 207 B8R1.2 C=CC1=CC=CC=C1 P107806 [1,0,0,0,0,0|1,0,2]=4 208 B8R1.2 C=CC1=CC=CC=C1 P107807 [1,0,0,0,0,0|1,0,2]=4 209 B8R1.2 C=CC1=CC=CC=C1 P107808 [1,0,0,0,0,0|1,0,2]=4 210 B8R1.2 C=CC1=CC=CC=C1 P107809 [1,0,0,0,0,0|1,0,2]=4 211 B8R1.2 C=CC1=CC=CC=C1 P107810 [1,0,0,0,0,0|1,0,2]=4 212 B8R1.2 C=CC1=CC=CC=C1 P107811 [1,0,0,0,0,0|1,0,2]=4 213 B8R1.2 C=CC1=CC=CC=C1 P107812 [1,0,0,0,0,0|1,0,2]=4 214 B8R1.2 C=CC1=CC=CC=C1 P107813 [1,0,0,0,0,0|1,0,2]=4 215 B8R1.2 C=CC1=CC=CC=C1 P107814 [1,0,0,0,0,0|1,0,2]=4 216 B8R1.2 C=CC1=CC=CC=C1 P119494 [1,0,0,0,0,0|1,0,2]=4 217 B8R1.2 C=CC1=CC=CC=C1 P119495 [1,0,0,0,0,0|1,0,2]=4 218 B8R1.2 C=CC1=CC=CC=C1 P119496 [1,0,0,0,0,0|1,0,2]=4 219 B8R1.2 C=CC1=CC=CC=C1 P119498 [1,0,0,0,0,0|1,0,2]=4 220 B8R1.2 C=CC1=CC=CC=C1 P119572 [1,0,0,0,0,0|1,0,2]=4 221 B8R1.2 C=CC1=CC=CC=C1 P304886 [1,0,0,0,0,0|1,0,2]=4 222 B8R1.2 C=CC1=CC=CC=C1 P304889 [1,0,0,0,0,0|1,0,2]=4 223 B8R1.2 C=CC1=CC=CC=C1 P434446 [1,0,0,0,0,0|1,0,2]=4 224 B8R1.2 C=CC1=CC=CC=C1 P434450 [1,0,0,0,0,0|1,0,2]=4 225 B8R1.2 C=CC1=CC=CC=C1 P434455 [1,0,0,0,0,0|1,0,2]=4 226 B8R1.2 C=CC1=CC=CC=C1 P476626 [1,0,0,0,0,0|1,0,2]=4 227 B8R1.2 C=CC1=CC=CC=C1 P490073 [1,0,0,0,0,0|1,0,2]=4 228 B8R1.2 C=CC1=CC=CC=C1 P638578 [1,0,0,0,0,0|1,0,2]=4 229 B8R1.2 C=CC1=CC=CC=C1 S110374 [1,0,0,0,0,0|1,0,2]=4 230 B8R1.2 C=CC1=CC=CC=C1 S110375 [1,0,0,0,0,0|1,0,2]=4 231 B8R1.2 C=CC1=CC=CC=C1 S110376 [1,0,0,0,0,0|1,0,2]=4 232 B8R1.2 C=CC1=CC=CC=C1 S110377 [1,0,0,0,0,0|1,0,2]=4 233 B8R1.2 C=CC1=CC=CC=C1 S110378 [1,0,0,0,0,0|1,0,2]=4 234 B8R1.2 C=CC1=CC=CC=C1 S121282 [1,0,0,0,0,0|1,0,2]=4 235 B8R1.2 C=CC1=CC=CC=N1 V106227 [1,0,0,0,0,0|0,0,2]=3 236 B8R1.2 CCC1=CC=CC=C1 E108144 [1,0,0,0,0,0|1,0,0]=2 237 B8R1.2 CCC1=CC=CC=C1 E108145 [1,0,0,0,0,0|1,0,0]=2 238 B8R1.2 CCC1=CC=CC=C1 E108146 [1,0,0,0,0,0|1,0,0]=2 239 B8R1.2 CCC1=CC=CC=C1 E108148 [1,0,0,0,0,0|1,0,0]=2 240 B8R1.2 CCC1=CC=CC=C1 E108149 [1,0,0,0,0,0|1,0,0]=2 241 B8R1.2 CCC1=CC=CC=C1 E117364 [1,0,0,0,0,0|1,0,0]=2 242 B8R1.2 CCC1=CC=CC=N1 E156565 [1,0,0,0,0,0|0,0,0]=1 243 B8R1.2 CCC1=CC=NC=C1 E106225 [1,0,0,0,0,0|2,0,0]=3 244 B8R1.2 CCC1=CN=CC=C1 E156048 [1,0,0,0,0,0|2,0,0]=3 245 B8R1.2 CCC1=NC=CN=C1 E156371 [1,0,0,0,0,0|1,0,0]=2 246 B8R1.2 CC[N+]1=CC=CC=C1 E102660 [1,0,0,0,0,0|2,0,0]=3 247 B8R1.2 CC[N+]1=CC=CC=C1 E102661 [1,0,0,0,0,0|2,0,0]=3 248 B8R1.2 CNC1=CC=CC=C1 M109539 [1,0,0,0,0,0|2,0,0]=3 249 B8R1.2 CNC1=CC=CC=C1 M109540 [1,0,0,0,0,0|2,0,0]=3 250 B8R1.2 CNC1=CC=CC=N1 M158828 [1,0,0,0,0,0|1,0,0]=2 251 B8R1.2 CNC1=CC=NC=C1 M119978 [1,0,0,0,0,0|3,0,0]=4 252 B8R1.2 CNC1=CN=CC=C1 M158833 [1,0,0,0,0,0|3,0,0]=4 253 B8R1.2 CNC1=NC=CC=N1 N339574 [1,0,0,0,0,0|2,0,0]=3 254 B8R1.2 COC1=CC=CC=C1 A103680 [1,0,0,0,0,0|2,0,0]=3 255 B8R1.2 COC1=CC=CC=C1 A103683 [1,0,0,0,0,0|2,0,0]=3 256 B8R1.2 COC1=CC=CC=C1 A103684 [1,0,0,0,0,0|2,0,0]=3 257 B8R1.2 COC1=CC=CC=C1 A105952 [1,0,0,0,0,0|2,0,0]=3 258 B8R1.2 COC1=CC=CC=C1 A472026 [1,0,0,0,0,0|2,0,0]=3 259 B8R1.2 COC1=CC=CC=N1 M120557 [1,0,0,0,0,0|1,0,0]=2 260 B8R1.2 COC1=CC=NC=C1 M120571 [1,0,0,0,0,0|3,0,0]=4 261 B8R1.2 COC1=CN=CC=C1 M134006 [1,0,0,0,0,0|3,0,0]=4 262 B8R1.2 COC1=NC=CN=C1 M136222 [1,0,0,0,0,0|2,0,0]=3 263 B8R1.2 COC1=NC=NC=C1 M158443 [1,0,0,0,0,0|2,0,0]=3 264 B8R1.2 COC1=NN=CC=C1 M157842 [1,0,0,0,0,0|2,0,0]=3 265 B8R1.2 CSC1=CC=CC=C1 T107511 [1,0,0,0,0,0|2,0,0]=3 266 B8R1.2 CSC1=CC=CC=N1 M132299 [1,0,0,0,0,0|1,0,0]=2 267 B8R1.2 CSC1=NC=CC=N1 M186764 [1,0,0,0,0,0|2,0,0]=3 268 B8R1.2 CSC1=NC=CN=C1 M132836 [1,0,0,0,0,0|2,0,0]=3 269 B8R1.2 CSC1=NC=CN=N1 M169273 [1,0,0,0,0,0|3,0,0]=4 270 B8R1.2 C[Si]C1=CC=CC=C1 M338232 [1,0,0,0,0,0|1,1,0]=3 271 B8R1.2 [C-]#CC1=CC=CC=C1 C282525 [1,0,0,0,0,0|1,0,2]=4 272 B8R1.2 [C-]#CC1=CC=CC=C1 P331408 [1,0,0,0,0,0|1,0,2]=4 273 B10R1.1 C1=CC(=CC=C1CC#N)Br B100849 [0,1,0,0,0,0|2,0,1]=4 274 B10R1.1 C1=CC(=CC=C1CC#N)Cl C124714 [0,1,0,0,0,0|2,0,1]=4 275 B10R1.1 C1=CC(=CC=C1CC#N)F F156616 [0,1,0,0,0,0|2,0,1]=4 276 B10R1.1 C1=CC(=CC=C1CC#N)I I170725 [0,1,0,0,0,0|2,0,1]=4 277 B10R1.1 C1=CC(=CC=C1CC#N)N A107271 [0,1,0,0,0,0|2,0,1]=4 278 B10R1.1 C1=CC(=CC=C1CC#N)O H121848 [0,1,0,0,0,0|2,0,1]=4 279 B10R1.1 C1=CC(=CC=C1CCBr)Br B167924 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.1 C1=CC(=CC=C1CCBr)Cl C121844 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.1 C1=CC(=CC=C1CCBr)F F121611 [0,1,0,0,0,0|2,0,0]=3 282 B10R1.1 C1=CC(=CC=C1CCBr)O H167212 [0,1,0,0,0,0|2,0,0]=3 283 B10R1.1 C1=CC(=CC=C1CCCl)F F156671 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.1 C1=CC(=CC=C1CCN)Br B101709 [0,1,0,0,0,0|2,0,0]=3 285 B10R1.1 C1=CC(=CC=C1CCN)Br B494194 [0,1,0,0,0,0|2,0,0]=3 286 B10R1.1 C1=CC(=CC=C1CCN)Br B494196 [0,1,0,0,0,0|2,0,0]=3 287 B10R1.1 C1=CC(=CC=C1CCN)Cl C153968 [0,1,0,0,0,0|2,0,0]=3 288 B10R1.1 C1=CC(=CC=C1CCN)Cl C493551 [0,1,0,0,0,0|2,0,0]=3 289 B10R1.1 C1=CC(=CC=C1CCN)F F131906 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.1 C1=CC(=CC=C1CCN)F F292669 [0,1,0,0,0,0|2,0,0]=3 291 B10R1.1 C1=CC(=CC=C1CCN)F F302836 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.1 C1=CC(=CC=C1CCN)F F493198 [0,1,0,0,0,0|2,0,0]=3 293 B10R1.1 C1=CC(=CC=C1CCN)N A151503 [0,1,0,0,0,0|2,0,0]=3 294 B10R1.1 C1=CC(=CC=C1CCN)O T105543 [0,1,0,0,0,0|2,0,0]=3 295 B10R1.1 C1=CC(=CC=C1CCN)O T107153 [0,1,0,0,0,0|2,0,0]=3 296 B10R1.1 C1=CC(=CC=C1CCN)O T424437 [0,1,0,0,0,0|2,0,0]=3 297 B10R1.1 C1=CC(=CC=C1CCO)Br B153115 [0,1,0,0,0,0|2,0,0]=3 298 B10R1.1 C1=CC(=CC=C1CCO)Cl C121856 [0,1,0,0,0,0|2,0,0]=3 299 B10R1.1 C1=CC(=CC=C1CCO)F F136730 [0,1,0,0,0,0|2,0,0]=3 300 B10R1.1 C1=CC(=CC=C1CCO)N A151120 [0,1,0,0,0,0|2,0,0]=3 301 B10R1.1 C1=CC(=CC=C1CCO)O H106325 [0,1,0,0,0,0|2,0,0]=3 302 B10R1.1 C1=CC(=CC=C1CCO)O H118576 [0,1,0,0,0,0|2,0,0]=3 303 B10R1.1 C1=CC(=CC=C1CCO)O H424324 [0,1,0,0,0,0|2,0,0]=3 304 B10R1.1 C1=CC(=CC=C1CON)F A184897 [0,1,0,0,0,0|3,0,0]=4 305 B10R1.1 C1=CC(=NC=C1Br)CC#N B176084 [0,1,0,0,0,0|1,0,1]=3 306 B10R1.1 C=CCC1=CC=C(C=C1)O A589273 [0,1,0,0,0,0|1,0,2]=4 307 B10R1.1 CC1=CC=C(C=C1)CC#N P160068 [0,1,0,0,0,0|2,0,1]=4 308 B10R1.1 CC1=CC=C(C=C1)CC=C A169644 [0,1,0,0,0,0|1,0,2]=4 309 B10R1.1 CC1=CC=C(C=C1)CC=O P586228 [0,1,0,0,0,0|2,0,1]=4 310 B10R1.1 CC1=CC=C(C=C1)CCBr M469504 [0,1,0,0,0,0|2,0,0]=3 311 B10R1.1 CC1=CC=C(C=C1)CCN M493506 [0,1,0,0,0,0|2,0,0]=3 312 B10R1.1 CC1=CC=C(C=C1)CCN P101999 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.1 CC1=CC=C(C=C1)CCO I135268 [0,1,0,0,0,0|2,0,0]=3 314 B10R1.1 CC1=CC=C(C=C1)CNC N300479 [0,1,0,0,0,0|2,0,0]=3 315 B10R1.1 CCCC1=CC=C(C=C1)Br B101884 [0,1,0,0,0,0|1,0,0]=2 316 B10R1.1 CCCC1=CC=C(C=C1)C P160392 [0,1,0,0,0,0|1,0,0]=2 317 B10R1.1 CCCC1=CC=C(C=C1)Cl C303901 [0,1,0,0,0,0|1,0,0]=2 318 B10R1.1 CCCC1=CC=C(C=C1)N P136525 [0,1,0,0,0,0|1,0,0]=2 319 B10R1.1 CCCC1=CC=C(C=C1)O P136692 [0,1,0,0,0,0|1,0,0]=2 320 B10R1.1 CCNC1=CC=C(C=C1)C N158982 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.1 CCNC1=NN=C(C=C1)Cl C349279 [0,1,0,0,0,0|2,0,0]=3 322 B10R1.1 CCOC1=CC=C(C=C1)Br B113334 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.1 CCOC1=CC=C(C=C1)Cl C304178 [0,1,0,0,0,0|2,0,0]=3 324 B10R1.1 CCOC1=CC=C(C=C1)F F156673 [0,1,0,0,0,0|2,0,0]=3 325 B10R1.1 CCOC1=CC=C(C=C1)I I111883 [0,1,0,0,0,0|2,0,0]=3 326 B10R1.1 CCOC1=CC=C(C=C1)N E108459 [0,1,0,0,0,0|2,0,0]=3 327 B10R1.1 CCOC1=CC=C(C=C1)N P160470 [0,1,0,0,0,0|2,0,0]=3 328 B10R1.1 CCOC1=CC=C(C=C1)O E124314 [0,1,0,0,0,0|2,0,0]=3 329 B10R1.1 CCOC1=NC=C(C=C1)Br B122972 [0,1,0,0,0,0|1,0,0]=2 330 B10R1.1 CCOC1=NC=C(C=C1)Cl C588198 [0,1,0,0,0,0|1,0,0]=2 331 B10R1.1 CCOC1=NN=C(C=C1)N E184272 [0,1,0,0,0,0|2,0,0]=3 332 B10R1.1 CNCC1=CC=C(C=C1)Br B186104 [0,1,0,0,0,0|2,0,0]=3 333 B10R1.1 CNCC1=CC=C(C=C1)Cl C153967 [0,1,0,0,0,0|2,0,0]=3 334 B10R1.1 CNCC1=CC=C(C=C1)F F156709 [0,1,0,0,0,0|2,0,0]=3 335 B10R1.1 COCC1=CC=C(C=C1)Br B181671 [0,1,0,0,0,0|2,0,0]=3 336 B10R1.1 COCC1=CC=C(C=C1)O M170858 [0,1,0,0,0,0|2,0,0]=3 337 B10R1.4 C1=CC=C(C(=C1)CC#N)Br B468900 [0,1,0,0,0,0|2,0,1]=4 338 B10R1.4 C1=CC=C(C(=C1)CC#N)Cl C140252 [0,1,0,0,0,0|2,0,1]=4 339 B10R1.4 C1=CC=C(C(=C1)CC#N)F F133645 [0,1,0,0,0,0|2,0,1]=4 340 B10R1.4 C1=CC=C(C(=C1)CC#N)I I170176 [0,1,0,0,0,0|2,0,1]=4 341 B10R1.4 C1=CC=C(C(=C1)CC#N)N A133628 [0,1,0,0,0,0|2,0,1]=4 342 B10R1.4 C1=CC=C(C(=C1)CCBr)Cl C167804 [0,1,0,0,0,0|2,0,0]=3 343 B10R1.4 C1=CC=C(C(=C1)CCBr)F F469846 [0,1,0,0,0,0|2,0,0]=3 344 B10R1.4 C1=CC=C(C(=C1)CCN)Br B122727 [0,1,0,0,0,0|2,0,0]=3 345 B10R1.4 C1=CC=C(C(=C1)CCN)Cl C153971 [0,1,0,0,0,0|2,0,0]=3 346 B10R1.4 C1=CC=C(C(=C1)CCN)F F292844 [0,1,0,0,0,0|2,0,0]=3 347 B10R1.4 C1=CC=C(C(=C1)CCN)F W135956 [0,1,0,0,0,0|2,0,0]=3 348 B10R1.4 C1=CC=C(C(=C1)CCN)N A189849 [0,1,0,0,0,0|2,0,0]=3 349 B10R1.4 C1=CC=C(C(=C1)CCN)O A191948 [0,1,0,0,0,0|2,0,0]=3 350 B10R1.4 C1=CC=C(C(=C1)CCO)Br B102011 [0,1,0,0,0,0|2,0,0]=3 351 B10R1.4 C1=CC=C(C(=C1)CCO)Cl C135333 [0,1,0,0,0,0|2,0,0]=3 352 B10R1.4 C1=CC=C(C(=C1)CCO)F F134481 [0,1,0,0,0,0|2,0,0]=3 353 B10R1.4 C1=CC=C(C(=C1)CCO)N A151124 [0,1,0,0,0,0|2,0,0]=3 354 B10R1.4 C1=CC=C(C(=C1)CCO)O H139263 [0,1,0,0,0,0|2,0,0]=3 355 B10R1.4 C1=CC=C(C(=C1)CON)F O192052 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.4 C=CCC1=CC=CC=C1Br A467291 [0,1,0,0,0,0|1,0,2]=4 357 B10R1.4 C=CCC1=CC=CC=C1N A151777 [0,1,0,0,0,0|1,0,2]=4 358 B10R1.4 C=CCC1=CC=CC=C1O A151090 [0,1,0,0,0,0|1,0,2]=4 359 B10R1.4 CC1=CC=CC=C1CC#N O160033 [0,1,0,0,0,0|2,0,1]=4 360 B10R1.4 CC1=CC=CC=C1CC=C A167621 [0,1,0,0,0,0|1,0,2]=4 361 B10R1.4 CC1=CC=CC=C1CCBr B587606 [0,1,0,0,0,0|2,0,0]=3 362 B10R1.4 CC1=CC=CC=C1CCO O159910 [0,1,0,0,0,0|2,0,0]=3 363 B10R1.4 CC1=CC=CC=C1CNC B301431 [0,1,0,0,0,0|2,0,0]=3 364 B10R1.4 CCCC1=CC=CC=C1C P160377 [0,1,0,0,0,0|1,0,0]=2 365 B10R1.4 CCCC1=CC=CC=C1N P160189 [0,1,0,0,0,0|1,0,0]=2 366 B10R1.4 CCCC1=CC=CC=C1O P160564 [0,1,0,0,0,0|1,0,0]=2 367 B10R1.4 CCNC1=CC=CC=C1C N158979 [0,1,0,0,0,0|2,0,0]=3 368 B10R1.4 CCOC1=C(C=CC=N1)Br B139026 [0,1,0,0,0,0|1,0,0]=2 369 B10R1.4 CCOC1=C(C=CC=N1)Cl C154075 [0,1,0,0,0,0|1,0,0]=2 370 B10R1.4 CCOC1=C(C=CC=N1)I E134848 [0,1,0,0,0,0|1,0,0]=2 371 B10R1.4 CCOC1=CC=CC=C1Cl C405475 [0,1,0,0,0,0|2,0,0]=3 372 B10R1.4 CCOC1=CC=CC=C1N E100407 [0,1,0,0,0,0|2,0,0]=3 373 B10R1.4 CCOC1=CC=CC=C1O E156224 [0,1,0,0,0,0|2,0,0]=3 374 B10R1.4 CCOC1=NC=CN=C1C E156373 [0,1,0,0,0,0|2,0,0]=3 375 B10R1.4 CNCC1=CC=CC=C1Br B194652 [0,1,0,0,0,0|2,0,0]=3 376 B10R1.4 CNCC1=CC=CC=C1Cl C469889 [0,1,0,0,0,0|2,0,0]=3 377 B10R1.4 CNCC1=CC=CC=C1O H156922 [0,1,0,0,0,0|2,0,0]=3 378 B10R1.10 C1=CC(=CC(=C1)Br)CC#N B122843 [0,1,0,0,0,0|2,0,1]=4 379 B10R1.10 C1=CC(=CC(=C1)Br)CCN B101708 [0,1,0,0,0,0|2,0,0]=3 380 B10R1.10 C1=CC(=CC(=C1)Br)CCO B102008 [0,1,0,0,0,0|2,0,0]=3 381 B10R1.10 C1=CC(=CC(=C1)Cl)CC#N C132151 [0,1,0,0,0,0|2,0,1]=4 382 B10R1.10 C1=CC(=CC(=C1)Cl)CCBr C167806 [0,1,0,0,0,0|2,0,0]=3 383 B10R1.10 C1=CC(=CC(=C1)Cl)CCN C153963 [0,1,0,0,0,0|2,0,0]=3 384 B10R1.10 C1=CC(=CC(=C1)Cl)CCO C153312 [0,1,0,0,0,0|2,0,0]=3 385 B10R1.10 C1=CC(=CC(=C1)F)CC#N F122867 [0,1,0,0,0,0|2,0,1]=4 386 B10R1.10 C1=CC(=CC(=C1)F)CCBr F135723 [0,1,0,0,0,0|2,0,0]=3 387 B10R1.10 C1=CC(=CC(=C1)F)CCN W133696 [0,1,0,0,0,0|2,0,0]=3 388 B10R1.10 C1=CC(=CC(=C1)F)CCO F156602 [0,1,0,0,0,0|2,0,0]=3 389 B10R1.10 C1=CC(=CC(=C1)I)CC#N I157675 [0,1,0,0,0,0|2,0,1]=4 390 B10R1.10 C1=CC(=CC(=C1)N)CCO A589356 [0,1,0,0,0,0|2,0,0]=3 391 B10R1.10 C1=CC(=CC(=C1)O)CC#N M350354 [0,1,0,0,0,0|2,0,1]=4 392 B10R1.10 C1=CC(=CC(=C1)O)CCO H167016 [0,1,0,0,0,0|2,0,0]=3 393 B10R1.10 CC1=CC(=CC=C1)CC#N M158779 [0,1,0,0,0,0|2,0,1]=4 394 B10R1.10 CC1=CC(=CC=C1)CC=C A169645 [0,1,0,0,0,0|1,0,2]=4 395 B10R1.10 CC1=CC(=CC=C1)CCBr M332837 [0,1,0,0,0,0|2,0,0]=3 396 B10R1.10 CC1=CC(=CC=C1)CCCl C193160 [0,1,0,0,0,0|2,0,0]=3 397 B10R1.10 CC1=CC(=CC=C1)CCN M170979 [0,1,0,0,0,0|2,0,0]=3 398 B10R1.10 CC1=CC(=CC=C1)CCO M157912 [0,1,0,0,0,0|2,0,0]=3 399 B10R1.10 CC1=CC(=CC=C1)CNC M158625 [0,1,0,0,0,0|2,0,0]=3 400 B10R1.10 CCCC1=CC=CC(=C1)C P160391 [0,1,0,0,0,0|1,0,0]=2 401 B10R1.10 CCNC1=CC=CC(=C1)C E140164 [0,1,0,0,0,0|2,0,0]=3 402 B10R1.10 CCNC1=NC(=NC=C1)Cl C195400 [0,1,0,0,0,0|2,0,0]=3 403 B10R1.10 CCOC1=CC(=CC=C1)Br B136517 [0,1,0,0,0,0|2,0,0]=3 404 B10R1.10 CCOC1=CC(=CC=C1)S E101783 [0,1,0,0,0,0|2,0,0]=3 405 B10R1.10 CCOC1=CC(=CN=C1)Br B152240 [0,1,0,0,0,0|3,0,0]=4 406 B10R1.10 CCOC1=CC(=NC=C1)N A589357 [0,1,0,0,0,0|3,0,0]=4 407 B10R1.10 CCOC1=CC=CC(=C1)N E101872 [0,1,0,0,0,0|2,0,0]=3 408 B10R1.10 CCOC1=CC=CC(=C1)O E156223 [0,1,0,0,0,0|2,0,0]=3 409 B10R1.10 CCOC1=NC(=CC=C1)Cl C154060 [0,1,0,0,0,0|1,0,0]=2 410 B10R1.10 CCOC1=NC=CC(=C1)N A187936 [0,1,0,0,0,0|1,0,0]=2 411 B10R1.10 CCOC1=NC=NC(=C1)C E339561 [0,1,0,0,0,0|2,0,0]=3 412 B10R1.10 CCSC1=CC(=CC=C1)Br B168061 [0,1,0,0,0,0|2,0,0]=3 413 B10R1.10 CNCC1=CC(=CC=C1)Br B121859 [0,1,0,0,0,0|2,0,0]=3 414 B10R1.10 CNCC1=CC(=CC=C1)Br B140813 [0,1,0,0,0,0|2,0,0]=3 415 B10R1.10 CNCC1=CC(=CC=C1)Cl C170092 [0,1,0,0,0,0|2,0,0]=3 416 B10R1.10 CNCC1=CC(=CC=C1)F F156708 [0,1,0,0,0,0|2,0,0]=3 417 B10R1.10 CNCC1=CC(=CC=C1)N A151692 [0,1,0,0,0,0|2,0,0]=3 418 B10R1.15 C#CC(C1=CC=CC=C1)O P107039 [0,1,0,0,0,0|1,0,2]=4 419 B10R1.15 C1=CC=C(C=C1)C(=O)CBr B103328 [0,1,0,0,0,0|2,0,1]=4 420 B10R1.15 C1=CC=C(C=C1)C(=O)CBr B131582 [0,1,0,0,0,0|2,0,1]=4 421 B10R1.15 C1=CC=C(C=C1)C(=O)CCl C475739 [0,1,0,0,0,0|2,0,1]=4 422 B10R1.15 C1=CC=C(C=C1)C(=O)CN A123237 [0,1,0,0,0,0|2,0,1]=4 423 B10R1.15 C1=CC=C(C=C1)C(=O)CO H102370 [0,1,0,0,0,0|2,0,1]=4 424 B10R1.15 C1=CC=C(C=C1)C(C#N)N P170863 [0,1,0,0,0,0|2,0,1]=4 425 B10R1.15 C1=CC=C(C=C1)C(CBr)Br D304999 [0,1,0,0,0,0|2,0,0]=3 426 B10R1.15 C1=CC=C(C=C1)C(CBr)O B192257 [0,1,0,0,0,0|2,0,0]=3 427 B10R1.15 C1=CC=C(C=C1)C(CCl)O R304018 [0,1,0,0,0,0|2,0,0]=3 428 B10R1.15 C1=CC=C(C=C1)C(CCl)O S304439 [0,1,0,0,0,0|2,0,0]=3 429 B10R1.15 C1=CC=C(C=C1)C(CN)O A102440 [0,1,0,0,0,0|2,0,0]=3 430 B10R1.15 C1=CC=C(C=C1)C(CN)O A151123 [0,1,0,0,0,0|2,0,0]=3 431 B10R1.15 C1=CC=C(C=C1)C(CN)O R138565 [0,1,0,0,0,0|2,0,0]=3 432 B10R1.15 C1=CC=C(C=C1)C(CO)N P109343 [0,1,0,0,0,0|2,0,0]=3 433 B10R1.15 C1=CC=C(C=C1)C(CO)N P117139 [0,1,0,0,0,0|2,0,0]=3 434 B10R1.15 C1=CC=C(C=C1)C(CO)N P160161 [0,1,0,0,0,0|2,0,0]=3 435 B10R1.15 C1=CC=C(C=C1)C(CO)O P100518 [0,1,0,0,0,0|2,0,0]=3 436 B10R1.15 C1=CC=C(C=C1)C(CO)O P100519 [0,1,0,0,0,0|2,0,0]=3 437 B10R1.15 C1=CC=C(C=C1)C(CO)O P112689 [0,1,0,0,0,0|2,0,0]=3 438 B10R1.15 C1=CC=NC(=C1)C(=NO)N P167968 [0,1,0,0,0,0|2,0,1]=4 439 B10R1.15 C1=CC=NC(=C1)C(=O)CBr B182147 [0,1,0,0,0,0|1,0,1]=3 440 B10R1.15 C1=CC=NC(=C1)C(=O)NN P123196 [0,1,0,0,0,0|2,0,1]=4 441 B10R1.15 C1=CN=C(N=C1)C(=O)CBr B174576 [0,1,0,0,0,0|2,0,1]=4 442 B10R1.15 C=CC(C1=CC=CC=C1)Cl V303368 [0,1,0,0,0,0|1,0,2]=4 443 B10R1.15 C=CC(C1=CC=CC=C1)O V189138 [0,1,0,0,0,0|1,0,2]=4 444 B10R1.15 CC(C#N)C1=CC=CC=C1 M468313 [0,1,0,0,0,0|2,0,1]=4 445 B10R1.15 CC(C1=CC=CC=C1)NC I168221 [0,1,0,0,0,0|2,0,0]=3 446 B10R1.15 CC(C1=CC=CC=C1)NC I171118 [0,1,0,0,0,0|2,0,0]=3 447 B10R1.15 CC(C1=CC=CC=C1)NC I286935 [0,1,0,0,0,0|2,0,0]=3 448 B10R1.15 CC(C1=CC=CC=C1)[N+]#[C-] B300007 [0,1,0,0,0,0|2,0,1]=4 449 B10R1.15 CC(C=O)C1=CC=CC=C1 P160754 [0,1,0,0,0,0|2,0,1]=4 450 B10R1.15 CC(CN)C1=CC=CC=C1 P191947 [0,1,0,0,0,0|2,0,0]=3 451 B10R1.15 CC(CN)C1=CC=CC=C1 R160849 [0,1,0,0,0,0|2,0,0]=3 452 B10R1.15 CC(CO)C1=CC=CC=C1 P160710 [0,1,0,0,0,0|2,0,0]=3 453 B10R1.15 CC(CO)C1=CC=CC=C1 R489486 [0,1,0,0,0,0|2,0,0]=3 454 B10R1.15 CCC(=C)C1=CC=CC=C1 B302726 [0,1,0,0,0,0|1,0,1]=3 455 B10R1.15 CCC(=O)C1=CN=CC=C1 P131764 [0,1,0,0,0,0|2,0,1]=4 456 B10R1.15 CCC(C)C1=CC=CC=C1 B100253 [0,1,0,0,0,0|1,0,0]=2 457 B10R1.15 CCC(C)C1=CC=CC=C1 B100254 [0,1,0,0,0,0|1,0,0]=2 458 B10R1.15 CCC(C)C1=CC=CC=C1 B128164 [0,1,0,0,0,0|1,0,0]=2 459 B10R1.15 CCC(C1=CC=CC=C1)N E334013 [0,1,0,0,0,0|1,0,0]=2 460 B10R1.15 CCC(C1=CC=CC=C1)N R138647 [0,1,0,0,0,0|1,0,0]=2 461 B10R1.15 CCC(C1=CC=CC=C1)N R639496 [0,1,0,0,0,0|1,0,0]=2 462 B10R1.15 CCC(C1=CC=CC=C1)N S135110 [0,1,0,0,0,0|1,0,0]=2 463 B10R1.15 CCC(C1=CC=CC=C1)O P107008 [0,1,0,0,0,0|1,0,0]=2 464 B10R1.15 CCC(C1=CC=CC=C1)O R138307 [0,1,0,0,0,0|1,0,0]=2 465 B10R1.15 CCC(C1=CC=CC=C1)O S161360 [0,1,0,0,0,0|1,0,0]=2 466 B10R1.15 CCC(C1=CC=CC=N1)N P586083 [0,1,0,0,0,0|0,0,0]=1 467 B10R1.15 CCN(C)C1=CC=CC=C1 N589658 [0,1,0,0,0,0|2,0,0]=3 468 B10R1.15 CNC(=O)C1=CC=CC=C1 N304144 [0,1,0,0,0,0|2,0,1]=4 469 B10R1.15 COC(=N)C1=CC=CC=C1 M158319 [0,1,0,0,0,0|2,0,1]=4 470 B10R1.15 COC(=N)C1=CC=CC=N1 M157825 [0,1,0,0,0,0|1,0,1]=3 471 B10R1.15 COC(=O)C1=CC=CC=C1 M108588 [0,1,0,0,0,0|2,0,1]=4 472 B10R1.15 COC(=O)C1=CC=CC=C1 M108589 [0,1,0,0,0,0|2,0,1]=4 473 B10R1.15 COC(=O)C1=CC=CC=C1 M108590 [0,1,0,0,0,0|2,0,1]=4 474 B10R1.15 COC(=O)C1=CC=CC=C1 M108591 [0,1,0,0,0,0|2,0,1]=4 475 B10R1.15 COC(=O)C1=CC=CC=C1 M282394 [0,1,0,0,0,0|2,0,1]=4 476 B10R1.15 COC(=O)C1=CC=CC=N1 M157799 [0,1,0,0,0,0|1,0,1]=3 477 B10R1.15 COC(=O)C1=NC=CC=N1 M129074 [0,1,0,0,0,0|2,0,1]=4 478 B10R1.15 COC(=O)C1=NC=CN=C1 M158371 [0,1,0,0,0,0|2,0,1]=4 479 B10R1.15 COS(=O)C1=CC=CC=C1 M158264 [0,1,0,0,0,0|3,0,0]=4 480 B10R1.15 C[C@H](CO)C1=CC=CC=C1 S489449 [0,1,0,0,0,0|2,0,0]=3 481 B10R1.15 C\C=C(\C)/C1=CC=CC=C1 C348081 [0,1,0,0,0,0|1,0,2]=4 482 B10R1.17 C#CCCC1=CC=CC=C1 P160653 [0,1,0,0,0,0|1,0,1]=3 483 B10R1.17 C#CCOC1=CC=CC=C1 P113824 [0,1,0,0,0,0|1,0,2]=4 484 B10R1.17 C#CCSC1=CC=CC=C1 P101830 [0,1,0,0,0,0|1,0,2]=4 485 B10R1.17 C1=CC=C(C=C1)C#CCCl C101885 [0,1,0,0,0,0|1,0,2]=4 486 B10R1.17 C1=CC=C(C=C1)C#CCN P353326 [0,1,0,0,0,0|1,0,2]=4 487 B10R1.17 C1=CC=C(C=C1)C#CCO P111395 [0,1,0,0,0,0|1,0,2]=4 488 B10R1.17 C1=CC=C(C=C1)C=CCBr B163067 [0,1,0,0,0,0|1,0,2]=4 489 B10R1.17 C1=CC=C(C=C1)C=CCCl C102165 [0,1,0,0,0,0|1,0,2]=4 490 B10R1.17 C1=CC=C(C=C1)C=CCO C110605 [0,1,0,0,0,0|1,0,2]=4 491 B10R1.17 C1=CC=C(C=C1)C=CCO C110606 [0,1,0,0,0,0|1,0,2]=4 492 B10R1.17 C1=CC=C(C=C1)C=CCO E303728 [0,1,0,0,0,0|1,0,2]=4 493 B10R1.17 C1=CC=C(C=C1)CCC#N P160077 [0,1,0,0,0,0|1,0,1]=3 494 B10R1.17 C1=CC=C(C=C1)CCC=O P109695 [0,1,0,0,0,0|1,0,1]=3 495 B10R1.17 C1=CC=C(C=C1)CCCBr B106986 [0,1,0,0,0,0|1,0,0]=2 496 B10R1.17 C1=CC=C(C=C1)CCCCl C122445 [0,1,0,0,0,0|1,0,0]=2 497 B10R1.17 C1=CC=C(C=C1)CCCI I469194 [0,1,0,0,0,0|1,0,0]=2 498 B10R1.17 C1=CC=C(C=C1)CCCN P109694 [0,1,0,0,0,0|1,0,0]=2 499 B10R1.17 C1=CC=C(C=C1)CCCN P292870 [0,1,0,0,0,0|1,0,0]=2 500 B10R1.17 C1=CC=C(C=C1)CCCO P103663 [0,1,0,0,0,0|1,0,0]=2 501 B10R1.17 C1=CC=C(C=C1)CCNN P132003 [0,1,0,0,0,0|2,0,0]=3 502 B10R1.17 C1=CC=C(C=C1)CCNN P421872 [0,1,0,0,0,0|2,0,0]=3 503 B10R1.17 C1=CC=C(C=C1)CN=C=O B133636 [0,1,0,0,0,0|2,0,1]=4 504 B10R1.17 C1=CC=C(C=C1)CN=C=S B140288 [0,1,0,0,0,0|2,0,1]=4 505 B10R1.17 C1=CC=C(C=C1)CN=C=S B425154 [0,1,0,0,0,0|2,0,1]=4 506 B10R1.17 C1=CC=C(C=C1)CN=[N+]=[N-] B189174 [0,1,0,0,0,0|3,0,0]=4 507 B10R1.17 C1=CC=C(C=C1)CNC=O N159287 [0,1,0,0,0,0|2,0,1]=4 508 B10R1.17 C1=CC=C(C=C1)COC=O B152855 [0,1,0,0,0,0|2,0,1]=4 509 B10R1.17 C1=CC=C(C=C1)COCCl B107578 [0,1,0,0,0,0|2,0,0]=3 510 B10R1.17 C1=CC=C(C=C1)CSC#N B152183 [0,1,0,0,0,0|2,0,1]=4 511 B10R1.17 C1=CC=C(C=C1)NCC#N P192616 [0,1,0,0,0,0|2,0,1]=4 512 B10R1.17 C1=CC=C(C=C1)NCCN N159346 [0,1,0,0,0,0|2,0,0]=3 513 B10R1.17 C1=CC=C(C=C1)NCCO N140440 [0,1,0,0,0,0|2,0,0]=3 514 B10R1.17 C1=CC=C(C=C1)OCC#N P160111 [0,1,0,0,0,0|2,0,1]=4 515 B10R1.17 C1=CC=C(C=C1)OCCBr B100876 [0,1,0,0,0,0|2,0,0]=3 516 B10R1.17 C1=CC=C(C=C1)OCCCl B135225 [0,1,0,0,0,0|2,0,0]=3 517 B10R1.17 C1=CC=C(C=C1)OCCN P132517 [0,1,0,0,0,0|2,0,0]=3 518 B10R1.17 C1=CC=C(C=C1)OCCO E109367 [0,1,0,0,0,0|2,0,0]=3 519 B10R1.17 C1=CC=C(C=C1)OCCO E109368 [0,1,0,0,0,0|2,0,0]=3 520 B10R1.17 C1=CC=C(C=C1)OCCO E109369 [0,1,0,0,0,0|2,0,0]=3 521 B10R1.17 C1=CC=C(C=C1)OCCO E109370 [0,1,0,0,0,0|2,0,0]=3 522 B10R1.17 C1=CC=C(C=C1)OCCO P407596 [0,1,0,0,0,0|2,0,0]=3 523 B10R1.17 C1=CC=C(C=C1)SCC#N P160109 [0,1,0,0,0,0|2,0,1]=4 524 B10R1.17 C1=CC=C(C=C1)SCCBr B152504 [0,1,0,0,0,0|2,0,0]=3 525 B10R1.17 C1=CC=C(C=C1)SCCCl C101832 [0,1,0,0,0,0|2,0,0]=3 526 B10R1.17 C1=CC=C(C=C1)SCCO P101545 [0,1,0,0,0,0|2,0,0]=3 527 B10R1.17 C1=CC=NC(=C1)CCCO P133143 [0,1,0,0,0,0|0,0,0]=1 528 B10R1.17 C1=CN=CC=C1CCCN P192638 [0,1,0,0,0,0|2,0,0]=3 529 B10R1.17 C1=CN=CC=C1CCCO P160633 [0,1,0,0,0,0|2,0,0]=3 530 B10R1.17 C=CCCC1=CC=CC=C1 P160313 [0,1,0,0,0,0|1,0,1]=3 531 B10R1.17 C=CCNC1=CC=CC=C1 N159240 [0,1,0,0,0,0|1,0,2]=4 532 B10R1.17 C=CCOC1=CC=CC=C1 A101096 [0,1,0,0,0,0|1,0,2]=4 533 B10R1.17 C=CCSC1=CC=CC=C1 A140290 [0,1,0,0,0,0|1,0,2]=4 534 B10R1.17 C=COCC1=CC=CC=C1 B178307 [0,1,0,0,0,0|1,0,2]=4 535 B10R1.17 CCC#CC1=CC=CC=C1 P107031 [0,1,0,0,0,0|1,0,1]=3 536 B10R1.17 CCCCC1=CC=CC=C1 B100020 [0,1,0,0,0,0|1,0,0]=2 537 B10R1.17 CCCCC1=CC=CC=C1 B100021 [0,1,0,0,0,0|1,0,0]=2 538 B10R1.17 CCCCC1=CC=CC=C1 B128171 [0,1,0,0,0,0|1,0,0]=2 539 B10R1.17 CCCCC1=CN=CC=C1 B115782 [0,1,0,0,0,0|2,0,0]=3 540 B10R1.17 CCCC[N+]1=CC=CC=C1 B101511 [0,1,0,0,0,0|2,0,0]=3 541 B10R1.17 CCCC[N+]1=CC=CC=C1 B102654 [0,1,0,0,0,0|2,0,0]=3 542 B10R1.17 CCCC[N+]1=CC=CC=C1 B102663 [0,1,0,0,0,0|2,0,0]=3 543 B10R1.17 CCCC[N+]1=CC=CC=C1 B120504 [0,1,0,0,0,0|2,0,0]=3 544 B10R1.17 CCCOC1=CC=CC=C1 P405762 [0,1,0,0,0,0|1,0,0]=2 545 B10R1.17 CCNCC1=CC=CC=C1 E113368 [0,1,0,0,0,0|1,0,0]=2 546 B10R1.17 CCNCC1=CC=CC=N1 N170728 [0,1,0,0,0,0|0,0,0]=1 547 B10R1.17 CCNCC1=CC=CC=N1 N598953 [0,1,0,0,0,0|0,0,0]=1 548 B10R1.17 CCNCC1=CC=NC=C1 E124679 [0,1,0,0,0,0|2,0,0]=3 549 B10R1.17 CCOCC1=CC=CC=C1 E193820 [0,1,0,0,0,0|1,0,0]=2 550 B10R1.17 CNCCC1=CC=CC=C1 N159074 [0,1,0,0,0,0|1,0,0]=2 551 B10R1.17 CNCCC1=CC=CC=N1 B102783 [0,1,0,0,0,0|0,0,0]=1 552 B10R1.17 CNCCC1=CC=CC=N1 B152161 [0,1,0,0,0,0|0,0,0]=1 553 B10R1.17 CNCCC1=CC=CC=N1 B301305 [0,1,0,0,0,0|0,0,0]=1 554 B10R1.17 CNCCC1=CC=CC=N1 B424673 [0,1,0,0,0,0|0,0,0]=1 555 B10R1.17 CNCCC1=CC=CC=N1 M424771 [0,1,0,0,0,0|0,0,0]=1 556 B10R1.17 COCCC1=CC=CC=C1 P160567 [0,1,0,0,0,0|1,0,0]=2 557 B10R1.17 COCCC1=CC=CC=N1 M157981 [0,1,0,0,0,0|0,0,0]=1 558 B10R1.17 COCSC1=CC=CC=C1 M158419 [0,1,0,0,0,0|2,0,0]=3 559 B10R1.18 C1=CC=C(C=C1)CC(=N)N P192301 [0,1,0,0,0,0|2,0,1]=4 560 B10R1.18 C1=CC=C(C=C1)CC(=O)Cl P109202 [0,1,0,0,0,0|2,0,1]=4 561 B10R1.18 C1=CC=C(C=C1)CC(=O)N P160461 [0,1,0,0,0,0|2,0,1]=4 562 B10R1.18 C1=CC=C(C=C1)CC(=O)N P420433 [0,1,0,0,0,0|2,0,1]=4 563 B10R1.18 C1=CC=C(C=C1)CC(=O)O P346939 [0,1,0,0,0,0|2,0,1]=4 564 B10R1.18 C1=CC=C(C=C1)CC(=S)N P160307 [0,1,0,0,0,0|2,0,1]=4 565 B10R1.18 C1=CC=C(C=C1)C[N+](=O)[O-] N171226 [0,1,0,0,0,0|3,0,0]=4 566 B10R1.18 C1=CC=C(C=C1)OC(F)F D404170 [0,1,0,0,0,0|3,0,0]=4 567 B10R1.18 C1=CC=NC(=C1)CC(=O)O P106866 [0,1,0,0,0,0|1,0,1]=3 568 B10R1.18 C1=CC=NC(=C1)NC(=S)N N138220 [0,1,0,0,0,0|2,0,1]=4 569 B10R1.18 CC(=CC1=CC=CC=C1)C M158507 [0,1,0,0,0,0|1,0,2]=4 570 B10R1.18 CC(=O)CC1=CC=NC=C1 P134516 [0,1,0,0,0,0|2,0,1]=4 571 B10R1.18 CC(=O)CC1=CN=CC=C1 A355123 [0,1,0,0,0,0|2,0,1]=4 572 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 A151480 [0,1,0,0,0,0|2,0,1]=4 573 B10R1.18 CC(=O)NC1=CC=CC=C1 A103954 [0,1,0,0,0,0|2,0,1]=4 574 B10R1.18 CC(=O)NC1=CC=CC=C1 A103955 [0,1,0,0,0,0|2,0,1]=4 575 B10R1.18 CC(=O)NC1=CC=CC=C1 A103956 [0,1,0,0,0,0|2,0,1]=4 576 B10R1.18 CC(=O)NC1=CC=CC=C1 A103957 [0,1,0,0,0,0|2,0,1]=4 577 B10R1.18 CC(=O)NC1=CC=CC=C1 A119548 [0,1,0,0,0,0|2,0,1]=4 578 B10R1.18 CC(=O)NC1=CC=CC=N1 A151788 [0,1,0,0,0,0|1,0,1]=3 579 B10R1.18 CC(=O)OC1=CC=CC=C1 P108579 [0,1,0,0,0,0|2,0,1]=4 580 B10R1.18 CC(=O)OC1=CC=CC=C1 P342578 [0,1,0,0,0,0|2,0,1]=4 581 B10R1.18 CC(=O)SC1=CC=CC=C1 P101831 [0,1,0,0,0,0|2,0,1]=4 582 B10R1.18 CC(=S)NC1=CC=CC=C1 T161816 [0,1,0,0,0,0|2,0,1]=4 583 B10R1.18 CC(C)CC1=CC=CC=C1 I108918 [0,1,0,0,0,0|1,0,0]=2 584 B10R1.18 CC(C)CC1=CC=CC=C1 I108919 [0,1,0,0,0,0|1,0,0]=2 585 B10R1.18 CC(C)CC1=CC=CC=C1 I108920 [0,1,0,0,0,0|1,0,0]=2 586 B10R1.18 CC(C)NC1=CC=CC=C1 I101922 [0,1,0,0,0,0|2,0,0]=3 587 B10R1.18 CC(C)NC1=CC=CC=C1 I101923 [0,1,0,0,0,0|2,0,0]=3 588 B10R1.18 CC(C)OC1=CC=CC=C1 I183364 [0,1,0,0,0,0|2,0,0]=3 589 B10R1.18 CC(C)OC1=CC=CC=N1 I191256 [0,1,0,0,0,0|1,0,0]=2 590 B10R1.18 CC(CC1=CC=CC=C1)Br B168545 [0,1,0,0,0,0|1,0,0]=2 591 B10R1.18 CC(CC1=CC=CC=C1)O P160708 [0,1,0,0,0,0|1,0,0]=2 592 B10R1.18 CN(C)CC1=CC=CC=C1 D110949 [0,1,0,0,0,0|2,0,0]=3 593 B10R1.18 CN(C)CC1=CC=CC=C1 D110950 [0,1,0,0,0,0|2,0,0]=3 594 B10R1.18 CN(C)CC1=CC=CC=[C-]1 D129151 [0,1,0,0,0,0|2,0,0]=3 595 B10R1.18 CS(=O)CC1=CC=CC=C1 M334699 [0,1,0,0,0,0|2,0,0]=3 596 B10R1.18 C[Si](C)CC1=CC=CC=C1 B305093 [0,1,0,0,0,0|1,1,0]=3 597 B8R0.1 CCOC(=O)C=CC=O E189100 [0,0,1,0,0,0|3,0,0]=4 598 B8R0.4 CCCCCC=CC=O O105936 [0,0,1,0,0,0|1,0,2]=4 599 B8R0.4 CCCCCC=CC=O O303154 [0,0,1,0,0,0|1,0,2]=4 600 B10R2.6 C1C(N1)C2=CC=CC=C2 P357784 [0,0,0,1,0,0|2,0,0]=3 601 B10R2.6 C1C(O1)C2=CC=CC=C2 I132554 [0,0,0,1,0,0|2,0,0]=3 602 B10R2.6 C1C(O1)C2=CC=CC=C2 I133271 [0,0,0,1,0,0|2,0,0]=3 603 B10R2.6 C1C(O1)C2=CC=CC=C2 I137101 [0,0,0,1,0,0|2,0,0]=3 604 B10R2.6 C1C(O1)C2=CC=CC=C2 S106990 [0,0,0,1,0,0|2,0,0]=3 605 B10R2.6 C1C(O1)C2=CC=CC=C2 S165282 [0,0,0,1,0,0|2,0,0]=3 606 B10R2.6 C1CC1C2=CC=CC=C2 C300934 [0,0,0,1,0,0|1,0,0]=2 607 B10R2.7 C1=CC2=C(C=CN2)N=C1 H135749 [0,0,0,1,0,0|1,0,2]=4 608 B10R2.7 C1=CC2=C(C=NN2)N=C1 I169192 [0,0,0,1,0,0|2,0,1]=4 609 B10R2.7 C1=CC2=C(N=C1)N=CN2 A113516 [0,0,0,1,0,0|2,0,1]=4 610 B10R2.7 C1=CC2=C(NC=C2)N=C1 A124841 [0,0,0,1,0,0|1,0,2]=4 611 B10R2.7 C1=CC2=C(NN=C2)N=C1 P123108 [0,0,0,1,0,0|2,0,1]=4 612 B10R2.7 C1=CC2=NNN=C2N=C1 H157243 [0,0,0,1,0,0|3,0,0]=4 613 B10R2.7 C1C2=CC=CC=C2CN1 I102308 [0,0,0,1,0,0|2,0,0]=3 614 B10R2.7 C1C2=CC=CC=C2CN1 I123491 [0,0,0,1,0,0|2,0,0]=3 615 B10R2.7 C1C=CC2=CC=CC=C21 I105567 [0,0,0,1,0,0|1,0,2]=4 616 B10R2.7 C1C=CC2=CC=CC=C21 I105568 [0,0,0,1,0,0|1,0,2]=4 617 B10R2.7 C1C=CC2=CC=CC=C21 I105569 [0,0,0,1,0,0|1,0,2]=4 618 B10R2.7 C1CC2=C(C1)N=CC=C2 C101917 [0,0,0,1,0,0|0,0,0]=1 619 B10R2.7 C1CC2=C(C1)N=CC=C2 C616548 [0,0,0,1,0,0|0,0,0]=1 620 B10R2.7 C1CC2=CC=CC=C2C1 I105445 [0,0,0,1,0,0|1,0,0]=2 621 B10R2.7 C1CNC2=C1C=CC=N2 D122895 [0,0,0,1,0,0|1,0,0]=2 622 B10R2.7 C1CNC2=CC=CC=C21 I103557 [0,0,0,1,0,0|2,0,0]=3 623 B10R2.7 C1COC2=CC=CC=C21 D170588 [0,0,0,1,0,0|2,0,0]=3 624 B10R2.7 C1OC2=CC=CC=C2O1 B101357 [0,0,0,1,0,0|3,0,0]=4 625 B10R2.320 C1C(C2=CC=CC=C21)Br W132718 [0,0,0,1,0,0|2,0,0]=3 626 B8R1.8 C1=C(C=NN1)CCCl C589127 [0,0,0,0,1,0|3,0,0]=4 627 B8R1.8 C1=C(C=NN1)CCO H587730 [0,0,0,0,1,0|3,0,0]=4 628 B8R1.8 C1=C(NC=N1)CCN H106192 [0,0,0,0,1,0|2,0,1]=4 629 B8R1.8 C1=C(NC=N1)CCN H110868 [0,0,0,0,1,0|2,0,1]=4 630 B8R1.8 C1=C(NC=N1)CCN H111796 [0,0,0,0,1,0|2,0,1]=4 631 B8R1.8 C1=C(NC=N1)CCN H424422 [0,0,0,0,1,0|2,0,1]=4 632 B8R1.8 C1=C(NC=N1)CCN H424438 [0,0,0,0,1,0|2,0,1]=4 633 B8R1.8 C1=C(NC=N1)CCO H177821 [0,0,0,0,1,0|2,0,1]=4 634 B8R1.8 C1=C(NN=C1)CCN B344644 [0,0,0,0,1,0|2,0,1]=4 635 B8R1.8 C1=C(NN=C1)CCN B421467 [0,0,0,0,1,0|2,0,1]=4 636 B8R1.8 C1=CN(C=C1)CCBr B152722 [0,0,0,0,1,0|2,0,0]=3 637 B8R1.8 C1=CN(C=C1)CCCl C153496 [0,0,0,0,1,0|2,0,0]=3 638 B8R1.8 C1=CN(C=C1)CCN H169363 [0,0,0,0,1,0|2,0,0]=3 639 B8R1.8 C1=CN(C=C1)CCO H140284 [0,0,0,0,1,0|2,0,0]=3 640 B8R1.8 C1=CN(C=N1)CCCl N342105 [0,0,0,0,1,0|3,0,0]=4 641 B8R1.8 C1=CN(C=N1)CCN I304034 [0,0,0,0,1,0|3,0,0]=4 642 B8R1.8 C1=CN(C=N1)CCO H140402 [0,0,0,0,1,0|3,0,0]=4 643 B8R1.8 C1=CN(N=C1)CCO H185686 [0,0,0,0,1,0|2,0,0]=3 644 B8R1.8 C1=CSC(=C1)CC#N T117284 [0,0,0,0,1,0|2,0,1]=4 645 B8R1.8 C1=CSC(=C1)CCN T107627 [0,0,0,0,1,0|2,0,0]=3 646 B8R1.8 C1=CSC(=C1)CCN T493549 [0,0,0,0,1,0|2,0,0]=3 647 B8R1.8 C1=CSC(=C1)CCO T107405 [0,0,0,0,1,0|2,0,0]=3 648 B8R1.8 C1=CSC=C1CC#N T162812 [0,0,0,0,1,0|2,0,1]=4 649 B8R1.8 C1=CSC=C1CCN T176215 [0,0,0,0,1,0|2,0,0]=3 650 B8R1.8 C1=CSC=C1CCN T337701 [0,0,0,0,1,0|2,0,0]=3 651 B8R1.8 C1=CSC=C1CCO T162832 [0,0,0,0,1,0|2,0,0]=3 652 B8R1.8 CCCC1=CC=CO1 P160277 [0,0,0,0,1,0|1,0,0]=2 653 B8R1.8 CCCC1=CC=CS1 P167542 [0,0,0,0,1,0|1,0,0]=2 654 B8R1.8 CCCC1=CSC=C1 P160669 [0,0,0,0,1,0|1,0,0]=2 655 B8R1.8 CCCC1=NC=CN1 P135164 [0,0,0,0,1,0|1,0,0]=2 656 B8R1.8 CCCC1=NC=CS1 P160319 [0,0,0,0,1,0|1,0,0]=2 657 B8R1.8 CCCC1=NCCN1 P302987 [0,0,0,0,1,0|1,0,2]=4 658 B8R1.8 CCCC1=NCCO1 P160311 [0,0,0,0,1,0|1,0,2]=4 659 B8R1.8 CCCN1C=CN=C1 P135093 [0,0,0,0,1,0|2,0,0]=3 660 B8R1.8 CCOC1=NC=CS1 E135543 [0,0,0,0,1,0|2,0,0]=3 661 B8R1.8 CNCC1=CC=CO1 I170508 [0,0,0,0,1,0|2,0,0]=3 662 B8R1.8 COCN1C=CN=C1 M191910 [0,0,0,0,1,0|3,0,0]=4 663 B8R1.8 CSCC1=CC=CO1 F102908 [0,0,0,0,1,0|2,0,0]=3 664 B8R1.8 NCCC1=C[NH]C=N1 H408357 [0,0,0,0,1,0|2,0,0]=3 665 B7R0.1 CCC=CC=CC=O H102914 [1,0,1,0,0,0|1,0,0]=3 666 B7R0.1 CCCCC=CC=O T161484 [1,0,1,0,0,0|1,0,1]=4 667 B7R0.3 COC(=O)C=CC=C M167458 [1,0,1,0,0,0|2,0,0]=4 668 B7R0.7 CCCC(=O)OC=C V162944 [1,0,1,0,0,0|2,0,0]=4 669 B7R1.3 Brc1ccccc1 B128157 [2,0,0,0,0,0|2,0,0]=4 670 B7R1.3 C1=CC(=NN=C1)Br B590520 [2,0,0,0,0,0|2,0,0]=4 671 B7R1.3 C1=CC(=NN=C1)Cl C177666 [2,0,0,0,0,0|2,0,0]=4 672 B7R1.3 C1=CC(=NN=C1)N A123467 [2,0,0,0,0,0|2,0,0]=4 673 B7R1.3 C1=CC(=O)NC=C1 H108693 [2,0,0,0,0,0|1,0,1]=4 674 B7R1.3 C1=CC(=O)NC=C1 H421556 [2,0,0,0,0,0|1,0,1]=4 675 B7R1.3 C1=CC(=O)OC=C1 A136345 [2,0,0,0,0,0|2,0,0]=4 676 B7R1.3 C1=CC(=S)NC=C1 M101871 [2,0,0,0,0,0|1,0,1]=4 677 B7R1.3 C1=CC=C(C=C1)Br B103388 [2,0,0,0,0,0|2,0,0]=4 678 B7R1.3 C1=CC=C(C=C1)Br B103389 [2,0,0,0,0,0|2,0,0]=4 679 B7R1.3 C1=CC=C(C=C1)Br B103390 [2,0,0,0,0,0|2,0,0]=4 680 B7R1.3 C1=CC=C(C=C1)Br B121294 [2,0,0,0,0,0|2,0,0]=4 681 B7R1.3 C1=CC=C(C=C1)Br B473807 [2,0,0,0,0,0|2,0,0]=4 682 B7R1.3 C1=CC=C(C=C1)Cl C105081 [2,0,0,0,0,0|2,0,0]=4 683 B7R1.3 C1=CC=C(C=C1)Cl C105082 [2,0,0,0,0,0|2,0,0]=4 684 B7R1.3 C1=CC=C(C=C1)Cl C105083 [2,0,0,0,0,0|2,0,0]=4 685 B7R1.3 C1=CC=C(C=C1)Cl C105084 [2,0,0,0,0,0|2,0,0]=4 686 B7R1.3 C1=CC=C(C=C1)Cl C119461 [2,0,0,0,0,0|2,0,0]=4 687 B7R1.3 C1=CC=C(C=C1)Cl C342726 [2,0,0,0,0,0|2,0,0]=4 688 B7R1.3 C1=CC=C(C=C1)Cl C431386 [2,0,0,0,0,0|2,0,0]=4 689 B7R1.3 C1=CC=C(C=C1)Cl C639739 [2,0,0,0,0,0|2,0,0]=4 690 B7R1.3 C1=CC=C(C=C1)F F107096 [2,0,0,0,0,0|2,0,0]=4 691 B7R1.3 C1=CC=C(C=C1)F F107098 [2,0,0,0,0,0|2,0,0]=4 692 B7R1.3 C1=CC=C(C=C1)F F107099 [2,0,0,0,0,0|2,0,0]=4 693 B7R1.3 C1=CC=C(C=C1)F F107100 [2,0,0,0,0,0|2,0,0]=4 694 B7R1.3 C1=CC=C(C=C1)F F128178 [2,0,0,0,0,0|2,0,0]=4 695 B7R1.3 C1=CC=C(C=C1)F F128179 [2,0,0,0,0,0|2,0,0]=4 696 B7R1.3 C1=CC=C(C=C1)I I104581 [2,0,0,0,0,0|2,0,0]=4 697 B7R1.3 C1=CC=C(C=C1)I I104582 [2,0,0,0,0,0|2,0,0]=4 698 B7R1.3 C1=CC=C(C=C1)N A108448 [2,0,0,0,0,0|2,0,0]=4 699 B7R1.3 C1=CC=C(C=C1)N A111640 [2,0,0,0,0,0|2,0,0]=4 700 B7R1.3 C1=CC=C(C=C1)N A112119 [2,0,0,0,0,0|2,0,0]=4 701 B7R1.3 C1=CC=C(C=C1)N A112120 [2,0,0,0,0,0|2,0,0]=4 702 B7R1.3 C1=CC=C(C=C1)N A112122 [2,0,0,0,0,0|2,0,0]=4 703 B7R1.3 C1=CC=C(C=C1)N A112123 [2,0,0,0,0,0|2,0,0]=4 704 B7R1.3 C1=CC=C(C=C1)N A112124 [2,0,0,0,0,0|2,0,0]=4 705 B7R1.3 C1=CC=C(C=C1)N A112125 [2,0,0,0,0,0|2,0,0]=4 706 B7R1.3 C1=CC=C(C=C1)N A117353 [2,0,0,0,0,0|2,0,0]=4 707 B7R1.3 C1=CC=C(C=C1)N A117354 [2,0,0,0,0,0|2,0,0]=4 708 B7R1.3 C1=CC=C(C=C1)N A117355 [2,0,0,0,0,0|2,0,0]=4 709 B7R1.3 C1=CC=C(C=C1)N A121681 [2,0,0,0,0,0|2,0,0]=4 710 B7R1.3 C1=CC=C(C=C1)N A133014 [2,0,0,0,0,0|2,0,0]=4 711 B7R1.3 C1=CC=C(C=C1)N A135834 [2,0,0,0,0,0|2,0,0]=4 712 B7R1.3 C1=CC=C(C=C1)N A151130 [2,0,0,0,0,0|2,0,0]=4 713 B7R1.3 C1=CC=C(C=C1)N A151150 [2,0,0,0,0,0|2,0,0]=4 714 B7R1.3 C1=CC=C(C=C1)N A283803 [2,0,0,0,0,0|2,0,0]=4 715 B7R1.3 C1=CC=C(C=C1)N A344406 [2,0,0,0,0,0|2,0,0]=4 716 B7R1.3 C1=CC=C(C=C1)N P492994 [2,0,0,0,0,0|2,0,0]=4 717 B7R1.3 C1=CC=C(C=C1)N P492999 [2,0,0,0,0,0|2,0,0]=4 718 B7R1.3 C1=CC=C(C=C1)O P100761 [2,0,0,0,0,0|2,0,0]=4 719 B7R1.3 C1=CC=C(C=C1)O P100762 [2,0,0,0,0,0|2,0,0]=4 720 B7R1.3 C1=CC=C(C=C1)O P100765 [2,0,0,0,0,0|2,0,0]=4 721 B7R1.3 C1=CC=C(C=C1)O P100767 [2,0,0,0,0,0|2,0,0]=4 722 B7R1.3 C1=CC=C(C=C1)O P100769 [2,0,0,0,0,0|2,0,0]=4 723 B7R1.3 C1=CC=C(C=C1)O P100770 [2,0,0,0,0,0|2,0,0]=4 724 B7R1.3 C1=CC=C(C=C1)O P121281 [2,0,0,0,0,0|2,0,0]=4 725 B7R1.3 C1=CC=C(C=C1)O P128316 [2,0,0,0,0,0|2,0,0]=4 726 B7R1.3 C1=CC=C(C=C1)O P397150 [2,0,0,0,0,0|2,0,0]=4 727 B7R1.3 C1=CC=C(C=C1)O P472012 [2,0,0,0,0,0|2,0,0]=4 728 B7R1.3 C1=CC=C(C=C1)[O-] P171611 [2,0,0,0,0,0|2,0,0]=4 729 B7R1.3 C1=CC=C(C=C1)[O-] S110499 [2,0,0,0,0,0|2,0,0]=4 730 B7R1.3 C1=CC=C(C=C1)[O-] S190796 [2,0,0,0,0,0|2,0,0]=4 731 B7R1.3 C1=CC=C(C=C1)[S-] C355238 [2,0,0,0,0,0|2,0,0]=4 732 B7R1.3 C1=CC=C(C=C1)[S-] S195897 [2,0,0,0,0,0|2,0,0]=4 733 B7R1.3 C1=CC=C(C=C1)[Se] B121193 [2,0,0,0,0,0|2,0,0]=4 734 B7R1.3 C1=CC=C(C=C1)[Si] P160608 [2,0,0,0,0,0|1,1,0]=4 735 B7R1.3 C1=CC=NC(=C1)Br B109679 [2,0,0,0,0,0|1,0,0]=3 736 B7R1.3 C1=CC=NC(=C1)Cl C104870 [2,0,0,0,0,0|1,0,0]=3 737 B7R1.3 C1=CC=NC(=C1)F F120342 [2,0,0,0,0,0|1,0,0]=3 738 B7R1.3 C1=CC=NC(=C1)I I111393 [2,0,0,0,0,0|1,0,0]=3 739 B7R1.3 C1=CC=NC(=C1)N A105221 [2,0,0,0,0,0|1,0,0]=3 740 B7R1.3 C1=CC=NC(=C1)N A105222 [2,0,0,0,0,0|1,0,0]=3 741 B7R1.3 C1=CN=C(C=N1)Br B135014 [2,0,0,0,0,0|2,0,0]=4 742 B7R1.3 C1=CN=C(C=N1)Cl C124227 [2,0,0,0,0,0|2,0,0]=4 743 B7R1.3 C1=CN=C(C=N1)F F119252 [2,0,0,0,0,0|2,0,0]=4 744 B7R1.3 C1=CN=C(C=N1)I I157423 [2,0,0,0,0,0|2,0,0]=4 745 B7R1.3 C1=CN=C(C=N1)N A111242 [2,0,0,0,0,0|2,0,0]=4 746 B7R1.3 C1=CN=C(N=C1)Br B120301 [2,0,0,0,0,0|2,0,0]=4 747 B7R1.3 C1=CN=C(N=C1)Cl C132282 [2,0,0,0,0,0|2,0,0]=4 748 B7R1.3 C1=CN=C(N=C1)I I404595 [2,0,0,0,0,0|2,0,0]=4 749 B7R1.3 C1=CN=C(N=C1)N A109732 [2,0,0,0,0,0|2,0,0]=4 750 B7R1.3 C1=CN=CN=C1N A151327 [2,0,0,0,0,0|2,0,0]=4 751 B7R1.3 C1=CNC(=O)N=C1 H111812 [2,0,0,0,0,0|2,0,0]=4 752 B7R1.3 C1=CNC(=O)N=C1 P303873 [2,0,0,0,0,0|2,0,0]=4 753 B7R1.3 C1=CNC(=S)N=C1 M158441 [2,0,0,0,0,0|2,0,0]=4 754 B7R1.3 CC1=CC=CC=C1 T102274 [2,0,0,0,0,0|1,0,0]=3 755 B7R1.3 CC1=CC=CC=C1 T102275 [2,0,0,0,0,0|1,0,0]=3 756 B7R1.3 CC1=CC=CC=C1 T102276 [2,0,0,0,0,0|1,0,0]=3 757 B7R1.3 CC1=CC=CC=C1 T399619 [2,0,0,0,0,0|1,0,0]=3 758 B7R1.3 CC1=CC=CC=C1 T399633 [2,0,0,0,0,0|1,0,0]=3 759 B7R1.3 CC1=CC=CC=C1 T399640 [2,0,0,0,0,0|1,0,0]=3 760 B7R1.3 CC1=CC=CC=C1 T399643 [2,0,0,0,0,0|1,0,0]=3 761 B7R1.3 CC1=CC=CC=C1 T399652 [2,0,0,0,0,0|1,0,0]=3 762 B7R1.3 CC1=CC=CC=C1 T399677 [2,0,0,0,0,0|1,0,0]=3 763 B7R1.3 CC1=CC=CC=C1 T399681 [2,0,0,0,0,0|1,0,0]=3 764 B7R1.3 CC1=CC=CC=N1 M108694 [2,0,0,0,0,0|0,0,0]=2 765 B7R1.3 CC1=CC=CC=N1 M108695 [2,0,0,0,0,0|0,0,0]=2 766 B7R1.3 CC1=CC=CC=N1 P122349 [2,0,0,0,0,0|0,0,0]=2 767 B7R1.3 CC1=CC=NC=C1 P105226 [2,0,0,0,0,0|2,0,0]=4 768 B7R1.3 CC1=CCC=CC1 M113652 [2,0,0,0,0,0|1,0,1]=4 769 B7R1.3 CC1=CN=CC=C1 P109209 [2,0,0,0,0,0|2,0,0]=4 770 B7R1.3 CC1=CN=CC=C1 P109210 [2,0,0,0,0,0|2,0,0]=4 771 B7R1.3 CC1=NC=CN=C1 M158369 [2,0,0,0,0,0|1,0,0]=3 772 B7R1.3 CC1=NC=NC=C1 M134934 [2,0,0,0,0,0|1,0,0]=3 773 B7R1.3 CC1=NN=CC=C1 M131781 [2,0,0,0,0,0|1,0,0]=3 774 B7R1.3 C[N+]1=CC=CC=C1 M302265 [2,0,0,0,0,0|2,0,0]=4 775 B7R1.3 Cc1ccccn1 M141144 [2,0,0,0,0,0|0,0,0]=2 776 B7R1.3 Oc1ccccc1 BWY272999 [2,0,0,0,0,0|2,0,0]=4 777 B7R1.3 Oc1ccccc1 BWY273026 [2,0,0,0,0,0|2,0,0]=4 778 B7R1.3 Oc1ccccc1 P100768 [2,0,0,0,0,0|2,0,0]=4 779 B7R1.3 Oc1ccccc1 P117348 [2,0,0,0,0,0|2,0,0]=4 780 B7R1.3 [CH2-]C1=CC=CC=C1 B465975 [2,0,0,0,0,0|1,0,1]=4 781 B9R0.5 CCOC(=O)C=CC=CC E132577 [0,1,1,0,0,0|2,0,0]=4 782 B9R0.45 CCCCC=CC=CC=O N102611 [0,1,1,0,0,0|1,0,0]=3 783 B9R0.17 CCCC(OC=C)OC=C P478301 [0,1,1,0,0,0|1,0,1]=4 784 B9R1.1 C#CC1=NC=C(C=C1)Br B152260 [1,1,0,0,0,0|0,0,2]=4 785 B9R1.1 C1=C(C=NC(=N1)CO)Br B175796 [1,1,0,0,0,0|2,0,0]=4 786 B9R1.1 C1=C(N=CC(=N1)Cl)CO C177296 [1,1,0,0,0,0|2,0,0]=4 787 B9R1.1 C1=CC(=CC=C1CBr)Br B171105 [1,1,0,0,0,0|2,0,0]=4 788 B9R1.1 C1=CC(=CC=C1CBr)Cl C135867 [1,1,0,0,0,0|2,0,0]=4 789 B9R1.1 C1=CC(=CC=C1CBr)F F120595 [1,1,0,0,0,0|2,0,0]=4 790 B9R1.1 C1=CC(=CC=C1CBr)I I122909 [1,1,0,0,0,0|2,0,0]=4 791 B9R1.1 C1=CC(=CC=C1CCl)Br B113785 [1,1,0,0,0,0|2,0,0]=4 792 B9R1.1 C1=CC(=CC=C1CCl)Cl C106513 [1,1,0,0,0,0|2,0,0]=4 793 B9R1.1 C1=CC(=CC=C1CCl)F F100905 [1,1,0,0,0,0|2,0,0]=4 794 B9R1.1 C1=CC(=CC=C1CN)Br B133133 [1,1,0,0,0,0|2,0,0]=4 795 B9R1.1 C1=CC(=CC=C1CN)Br B136595 [1,1,0,0,0,0|2,0,0]=4 796 B9R1.1 C1=CC(=CC=C1CN)Cl C117222 [1,1,0,0,0,0|2,0,0]=4 797 B9R1.1 C1=CC(=CC=C1CN)Cl C493514 [1,1,0,0,0,0|2,0,0]=4 798 B9R1.1 C1=CC(=CC=C1CN)F F111212 [1,1,0,0,0,0|2,0,0]=4 799 B9R1.1 C1=CC(=CC=C1CN)F F292633 [1,1,0,0,0,0|2,0,0]=4 800 B9R1.1 C1=CC(=CC=C1CN)F F292646 [1,1,0,0,0,0|2,0,0]=4 801 B9R1.1 C1=CC(=CC=C1CN)F F404486 [1,1,0,0,0,0|2,0,0]=4 802 B9R1.1 C1=CC(=CC=C1CN)I I171122 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.1 C1=CC(=CC=C1CN)N A151636 [1,1,0,0,0,0|2,0,0]=4 804 B9R1.1 C1=CC(=CC=C1CN)N A193875 [1,1,0,0,0,0|2,0,0]=4 805 B9R1.1 C1=CC(=CC=C1CN)O A139192 [1,1,0,0,0,0|2,0,0]=4 806 B9R1.1 C1=CC(=CC=C1CN)O A187992 [1,1,0,0,0,0|2,0,0]=4 807 B9R1.1 C1=CC(=CC=C1CO)Br B139372 [1,1,0,0,0,0|2,0,0]=4 808 B9R1.1 C1=CC(=CC=C1CO)Cl C109479 [1,1,0,0,0,0|2,0,0]=4 809 B9R1.1 C1=CC(=CC=C1CO)F F156598 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.1 C1=CC(=CC=C1CO)I I138398 [1,1,0,0,0,0|2,0,0]=4 811 B9R1.1 C1=CC(=CC=C1CO)N A107272 [1,1,0,0,0,0|2,0,0]=4 812 B9R1.1 C1=CC(=CC=C1CO)O H107912 [1,1,0,0,0,0|2,0,0]=4 813 B9R1.1 C1=CC(=CC=C1CS)Br B101799 [1,1,0,0,0,0|2,0,0]=4 814 B9R1.1 C1=CC(=CC=C1CS)Cl C101789 [1,1,0,0,0,0|2,0,0]=4 815 B9R1.1 C1=CC(=CC=C1CS)F F101796 [1,1,0,0,0,0|2,0,0]=4 816 B9R1.1 C1=CC(=NC=C1Br)C#N B107722 [1,1,0,0,0,0|1,0,1]=4 817 B9R1.1 C1=CC(=NC=C1Br)C=O B119147 [1,1,0,0,0,0|1,0,1]=4 818 B9R1.1 C1=CC(=NC=C1Br)CN B182096 [1,1,0,0,0,0|1,0,0]=3 819 B9R1.1 C1=CC(=NC=C1Br)CO B121986 [1,1,0,0,0,0|1,0,0]=3 820 B9R1.1 C1=CC(=NC=C1Br)NN B139270 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.1 C1=CC(=NC=C1Cl)C#N C154079 [1,1,0,0,0,0|1,0,1]=4 822 B9R1.1 C1=CC(=NC=C1Cl)C=O C154077 [1,1,0,0,0,0|1,0,1]=4 823 B9R1.1 C1=CC(=NC=C1Cl)NN C183340 [1,1,0,0,0,0|2,0,0]=4 824 B9R1.1 C1=CC(=NC=C1F)C#N C119652 [1,1,0,0,0,0|1,0,1]=4 825 B9R1.1 C1=CC(=NC=C1F)CN A589490 [1,1,0,0,0,0|1,0,0]=3 826 B9R1.1 C1=CC(=NC=C1F)CO F177498 [1,1,0,0,0,0|1,0,0]=3 827 B9R1.1 C1=CC(=NC=C1N)C#N A123440 [1,1,0,0,0,0|1,0,1]=4 828 B9R1.1 C1=CC(=NC=C1O)C#N H177767 [1,1,0,0,0,0|1,0,1]=4 829 B9R1.1 C1=CC(=NC=C1O)C=O H192663 [1,1,0,0,0,0|1,0,1]=4 830 B9R1.1 CC1=CC=C(C=C1)CBr M109534 [1,1,0,0,0,0|2,0,0]=4 831 B9R1.1 CC1=CC=C(C=C1)CCl A101683 [1,1,0,0,0,0|2,0,0]=4 832 B9R1.1 CC1=CC=C(C=C1)CCl A164460 [1,1,0,0,0,0|2,0,0]=4 833 B9R1.1 CC1=CC=C(C=C1)CN M158669 [1,1,0,0,0,0|2,0,0]=4 834 B9R1.1 CC1=CC=C(C=C1)CO M113648 [1,1,0,0,0,0|2,0,0]=4 835 B9R1.1 CC1=CC=C(C=C1)CS M113646 [1,1,0,0,0,0|2,0,0]=4 836 B9R1.1 CC1=CC=C(C=C1)NC N159024 [1,1,0,0,0,0|2,0,0]=4 837 B9R1.1 CC1=CC=C(C=C1)OC M106728 [1,1,0,0,0,0|2,0,0]=4 838 B9R1.1 CC1=CC=C(C=C1)SC M101848 [1,1,0,0,0,0|2,0,0]=4 839 B9R1.1 CC1=CN=C(C=C1)C#N C132411 [1,1,0,0,0,0|1,0,1]=4 840 B9R1.1 CC1=CN=C(C=C1)C=O M170606 [1,1,0,0,0,0|1,0,1]=4 841 B9R1.1 CC1=CN=C(C=C1)CN M589171 [1,1,0,0,0,0|1,0,0]=3 842 B9R1.1 CC1=CN=C(C=C1)OC M181247 [1,1,0,0,0,0|1,0,0]=3 843 B9R1.1 CC1=CN=C(C=N1)CN A151407 [1,1,0,0,0,0|2,0,0]=4 844 B9R1.1 CC1=NN=C(C=C1)OC M587689 [1,1,0,0,0,0|2,0,0]=4 845 B9R1.1 CCC1=CC=C(C=C1)Br B101890 [1,1,0,0,0,0|1,0,0]=3 846 B9R1.1 CCC1=CC=C(C=C1)Br B141181 [1,1,0,0,0,0|1,0,0]=3 847 B9R1.1 CCC1=CC=C(C=C1)C E123489 [1,1,0,0,0,0|1,0,0]=3 848 B9R1.1 CCC1=CC=C(C=C1)Cl C171229 [1,1,0,0,0,0|1,0,0]=3 849 B9R1.1 CCC1=CC=C(C=C1)I E189089 [1,1,0,0,0,0|1,0,0]=3 850 B9R1.1 CCC1=CC=C(C=C1)N E102230 [1,1,0,0,0,0|1,0,0]=3 851 B9R1.1 CCC1=CC=C(C=C1)O E115497 [1,1,0,0,0,0|1,0,0]=3 852 B9R1.1 CCC1=CC=C(C=C1)S E156190 [1,1,0,0,0,0|1,0,0]=3 853 B9R1.1 CCC1=CN=C(C=C1)C E101695 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.1 CCC1=CN=C(C=C1)N E587963 [1,1,0,0,0,0|2,0,0]=4 855 B9R1.1 CCC1=NC=C(N=C1)C E302421 [1,1,0,0,0,0|1,0,0]=3 856 B9R1.1 CC[N+]1=CC=C(C=C1)C E303436 [1,1,0,0,0,0|2,0,0]=4 857 B9R1.1 CNC1=CC=C(C=C1)Br B304406 [1,1,0,0,0,0|2,0,0]=4 858 B9R1.1 CNC1=CC=C(C=C1)Cl C139458 [1,1,0,0,0,0|2,0,0]=4 859 B9R1.1 CNC1=CC=C(C=C1)F F170454 [1,1,0,0,0,0|2,0,0]=4 860 B9R1.1 CNC1=CC=C(C=C1)N N589686 [1,1,0,0,0,0|2,0,0]=4 861 B9R1.1 CNC1=NC=C(C=N1)Br B183617 [1,1,0,0,0,0|2,0,0]=4 862 B9R1.1 COC1=CC=C(C=C1)Br B108656 [1,1,0,0,0,0|2,0,0]=4 863 B9R1.1 COC1=CC=C(C=C1)Cl C113571 [1,1,0,0,0,0|2,0,0]=4 864 B9R1.1 COC1=CC=C(C=C1)F F123675 [1,1,0,0,0,0|2,0,0]=4 865 B9R1.1 COC1=CC=C(C=C1)I I107035 [1,1,0,0,0,0|2,0,0]=4 866 B9R1.1 COC1=CC=C(C=C1)I L359048 [1,1,0,0,0,0|2,0,0]=4 867 B9R1.1 COC1=CC=C(C=C1)N A106071 [1,1,0,0,0,0|2,0,0]=4 868 B9R1.1 COC1=CC=C(C=C1)N A615348 [1,1,0,0,0,0|2,0,0]=4 869 B9R1.1 COC1=CC=C(C=C1)N P160121 [1,1,0,0,0,0|2,0,0]=4 870 B9R1.1 COC1=CC=C(C=C1)O M104222 [1,1,0,0,0,0|2,0,0]=4 871 B9R1.1 COC1=CC=C(C=C1)S M101780 [1,1,0,0,0,0|2,0,0]=4 872 B9R1.1 COC1=CC=C(O)C=C1 M408201 [1,1,0,0,0,0|2,0,0]=4 873 B9R1.1 COC1=NC=C(C=C1)Br B115758 [1,1,0,0,0,0|1,0,0]=3 874 B9R1.1 COC1=NC=C(C=C1)Cl C120716 [1,1,0,0,0,0|1,0,0]=3 875 B9R1.1 COC1=NC=C(C=C1)F F120714 [1,1,0,0,0,0|1,0,0]=3 876 B9R1.1 COC1=NC=C(C=C1)I I132230 [1,1,0,0,0,0|1,0,0]=3 877 B9R1.1 COC1=NC=C(C=C1)N A151664 [1,1,0,0,0,0|1,0,0]=3 878 B9R1.1 COC1=NC=C(C=C1)N A400674 [1,1,0,0,0,0|1,0,0]=3 879 B9R1.1 COC1=NC=C(C=C1)O H184927 [1,1,0,0,0,0|1,0,0]=3 880 B9R1.1 COC1=NC=C(C=N1)Br B123560 [1,1,0,0,0,0|2,0,0]=4 881 B9R1.1 COC1=NC=C(C=N1)Cl C193117 [1,1,0,0,0,0|2,0,0]=4 882 B9R1.1 COC1=NN=C(C=C1)Br B182084 [1,1,0,0,0,0|2,0,0]=4 883 B9R1.1 COC1=NN=C(C=C1)Cl C154051 [1,1,0,0,0,0|2,0,0]=4 884 B9R1.1 COC1=NN=C(C=C1)I I191532 [1,1,0,0,0,0|2,0,0]=4 885 B9R1.1 COC1=NN=C(C=C1)N A337871 [1,1,0,0,0,0|2,0,0]=4 886 B9R1.1 CSC1=CC=C(C=C1)Br B101844 [1,1,0,0,0,0|2,0,0]=4 887 B9R1.1 CSC1=CC=C(C=C1)Cl C101840 [1,1,0,0,0,0|2,0,0]=4 888 B9R1.1 CSC1=CC=C(C=C1)F F101837 [1,1,0,0,0,0|2,0,0]=4 889 B9R1.1 CSC1=CC=C(C=C1)N M101835 [1,1,0,0,0,0|2,0,0]=4 890 B9R1.1 CSC1=CC=C(C=C1)O M100813 [1,1,0,0,0,0|2,0,0]=4 891 B9R1.1 CSC1=CC=C(C=C1)S M101782 [1,1,0,0,0,0|2,0,0]=4 892 B9R1.1 CSC1=NC=C(C=C1)Br B122969 [1,1,0,0,0,0|1,0,0]=3 893 B9R1.1 CSC1=NC=C(C=N1)Br W131884 [1,1,0,0,0,0|2,0,0]=4 894 B9R1.1 CSC1=NC=C(C=N1)Cl C170048 [1,1,0,0,0,0|2,0,0]=4 895 B9R1.1 CSC1=NC=C(C=N1)F F338628 [1,1,0,0,0,0|2,0,0]=4 896 B9R1.2 C1=C(N=C(C=N1)Cl)CO C586741 [1,1,0,0,0,0|2,0,0]=4 897 B9R1.2 C1=CC(=CC(=C1)Br)CBr B135903 [1,1,0,0,0,0|2,0,0]=4 898 B9R1.2 C1=CC(=CC(=C1)Br)CCl B139457 [1,1,0,0,0,0|2,0,0]=4 899 B9R1.2 C1=CC(=CC(=C1)Br)CN B131936 [1,1,0,0,0,0|2,0,0]=4 900 B9R1.2 C1=CC(=CC(=C1)Br)CN B136310 [1,1,0,0,0,0|2,0,0]=4 901 B9R1.2 C1=CC(=CC(=C1)Br)CO B103188 [1,1,0,0,0,0|2,0,0]=4 902 B9R1.2 C1=CC(=CC(=C1)Cl)CBr C106489 [1,1,0,0,0,0|2,0,0]=4 903 B9R1.2 C1=CC(=CC(=C1)Cl)CCl C189170 [1,1,0,0,0,0|2,0,0]=4 904 B9R1.2 C1=CC(=CC(=C1)Cl)CN C135515 [1,1,0,0,0,0|2,0,0]=4 905 B9R1.2 C1=CC(=CC(=C1)Cl)CO C106488 [1,1,0,0,0,0|2,0,0]=4 906 B9R1.2 C1=CC(=CC(=C1)F)CBr F107112 [1,1,0,0,0,0|2,0,0]=4 907 B9R1.2 C1=CC(=CC(=C1)F)CCl F123352 [1,1,0,0,0,0|2,0,0]=4 908 B9R1.2 C1=CC(=CC(=C1)F)CN F107964 [1,1,0,0,0,0|2,0,0]=4 909 B9R1.2 C1=CC(=CC(=C1)F)CO F156601 [1,1,0,0,0,0|2,0,0]=4 910 B9R1.2 C1=CC(=CC(=C1)I)CBr I133459 [1,1,0,0,0,0|2,0,0]=4 911 B9R1.2 C1=CC(=CC(=C1)I)CN I113819 [1,1,0,0,0,0|2,0,0]=4 912 B9R1.2 C1=CC(=CC(=C1)I)CN I468184 [1,1,0,0,0,0|2,0,0]=4 913 B9R1.2 C1=CC(=CC(=C1)I)CO I157442 [1,1,0,0,0,0|2,0,0]=4 914 B9R1.2 C1=CC(=CC(=C1)N)CN A151635 [1,1,0,0,0,0|2,0,0]=4 915 B9R1.2 C1=CC(=CC(=C1)N)CO A151125 [1,1,0,0,0,0|2,0,0]=4 916 B9R1.2 C1=CC(=CC(=C1)O)CN H407384 [1,1,0,0,0,0|2,0,0]=4 917 B9R1.2 C1=CC(=CC(=C1)O)CO H137304 [1,1,0,0,0,0|2,0,0]=4 918 B9R1.2 C1=CC(=CC(=C1)O)CO H501150 [1,1,0,0,0,0|2,0,0]=4 919 B9R1.2 C1=CC(=NC(=C1)Br)C#N W132621 [1,1,0,0,0,0|1,0,1]=4 920 B9R1.2 C1=CC(=NC(=C1)Br)C=O B115762 [1,1,0,0,0,0|1,0,1]=4 921 B9R1.2 C1=CC(=NC(=C1)Br)CBr B186803 [1,1,0,0,0,0|1,0,0]=3 922 B9R1.2 C1=CC(=NC(=C1)Br)CN B191781 [1,1,0,0,0,0|1,0,0]=3 923 B9R1.2 C1=CC(=NC(=C1)Br)CN B195815 [1,1,0,0,0,0|1,0,0]=3 924 B9R1.2 C1=CC(=NC(=C1)Br)CO B115778 [1,1,0,0,0,0|1,0,0]=3 925 B9R1.2 C1=CC(=NC(=C1)Br)NN B152452 [1,1,0,0,0,0|2,0,0]=4 926 B9R1.2 C1=CC(=NC(=C1)Cl)C#N W136246 [1,1,0,0,0,0|1,0,1]=4 927 B9R1.2 C1=CC(=NC(=C1)Cl)C=O C154078 [1,1,0,0,0,0|1,0,1]=4 928 B9R1.2 C1=CC(=NC(=C1)Cl)CO C183811 [1,1,0,0,0,0|1,0,0]=3 929 B9R1.2 C1=CC(=NC(=C1)Cl)NN C153939 [1,1,0,0,0,0|2,0,0]=4 930 B9R1.2 C1=CC(=NC(=C1)F)C#N F138786 [1,1,0,0,0,0|1,0,1]=4 931 B9R1.2 C1=CC(=NC(=C1)F)C=O F182684 [1,1,0,0,0,0|1,0,1]=4 932 B9R1.2 C1=CC(=NC(=C1)N)C#N A588907 [1,1,0,0,0,0|1,0,1]=4 933 B9R1.2 C1=CC(=NC(=C1)N)CO A120737 [1,1,0,0,0,0|1,0,0]=3 934 B9R1.2 C1=CN=C(C=C1Br)C#N B136977 [1,1,0,0,0,0|1,0,1]=4 935 B9R1.2 C1=CN=C(C=C1Br)CN B177735 [1,1,0,0,0,0|1,0,0]=3 936 B9R1.2 C1=CN=C(C=C1Br)NN B586156 [1,1,0,0,0,0|2,0,0]=4 937 B9R1.2 C1=CN=C(C=C1Cl)C#N C120793 [1,1,0,0,0,0|1,0,1]=4 938 B9R1.2 C1=CN=C(C=C1Cl)C=O C176987 [1,1,0,0,0,0|1,0,1]=4 939 B9R1.2 C1=CN=C(C=C1Cl)CCl C189999 [1,1,0,0,0,0|1,0,0]=3 940 B9R1.2 C1=CN=C(C=C1Cl)CN C175147 [1,1,0,0,0,0|1,0,0]=3 941 B9R1.2 C1=CN=C(C=C1F)C#N F283598 [1,1,0,0,0,0|1,0,1]=4 942 B9R1.2 CC1=CC(=CC=C1)CBr B405679 [1,1,0,0,0,0|2,0,0]=4 943 B9R1.2 CC1=CC(=CC=C1)CCl M101677 [1,1,0,0,0,0|2,0,0]=4 944 B9R1.2 CC1=CC(=CC=C1)CN M158668 [1,1,0,0,0,0|2,0,0]=4 945 B9R1.2 CC1=CC(=CC=C1)CO M157904 [1,1,0,0,0,0|2,0,0]=4 946 B9R1.2 CC1=CC(=CC=C1)CS M588442 [1,1,0,0,0,0|2,0,0]=4 947 B9R1.2 CC1=CC(=CC=C1)NC M107962 [1,1,0,0,0,0|2,0,0]=4 948 B9R1.2 CC1=CC(=CC=C1)OC M158111 [1,1,0,0,0,0|2,0,0]=4 949 B9R1.2 CC1=CC(=CC=C1)SC M351262 [1,1,0,0,0,0|2,0,0]=4 950 B9R1.2 CC1=CC(=NC=C1)C#N C132269 [1,1,0,0,0,0|1,0,1]=4 951 B9R1.2 CC1=CC(=NC=C1)C=O M124675 [1,1,0,0,0,0|1,0,1]=4 952 B9R1.2 CC1=CC(=NC=C1)CN M586928 [1,1,0,0,0,0|1,0,0]=3 953 B9R1.2 CC1=CC(=NC=C1)CN M588861 [1,1,0,0,0,0|1,0,0]=3 954 B9R1.2 CC1=CC(=NC=C1)NN H589250 [1,1,0,0,0,0|2,0,0]=4 955 B9R1.2 CC1=CC(=NC=C1)OC M122668 [1,1,0,0,0,0|1,0,0]=3 956 B9R1.2 CC1=NC(=CC=C1)C#N C107723 [1,1,0,0,0,0|1,0,1]=4 957 B9R1.2 CC1=NC(=CC=C1)C=O M101568 [1,1,0,0,0,0|1,0,1]=4 958 B9R1.2 CC1=NC(=CC=C1)CBr B589873 [1,1,0,0,0,0|1,0,0]=3 959 B9R1.2 CC1=NC(=CC=C1)CCl C405541 [1,1,0,0,0,0|1,0,0]=3 960 B9R1.2 CC1=NC(=CC=C1)CN M194459 [1,1,0,0,0,0|1,0,0]=3 961 B9R1.2 CC1=NC(=CC=C1)CO M115780 [1,1,0,0,0,0|1,0,0]=3 962 B9R1.2 CC1=NC(=CC=C1)OC M108062 [1,1,0,0,0,0|1,0,0]=3 963 B9R1.2 CC1=NC(=NC=C1)SC M124713 [1,1,0,0,0,0|2,0,0]=4 964 B9R1.2 CCC1=CC(=CC=C1)Br B101889 [1,1,0,0,0,0|1,0,0]=3 965 B9R1.2 CCC1=CC(=CC=C1)Cl C589677 [1,1,0,0,0,0|1,0,0]=3 966 B9R1.2 CCC1=CC(=CC=C1)I E587883 [1,1,0,0,0,0|1,0,0]=3 967 B9R1.2 CCC1=CC(=CC=C1)N E101873 [1,1,0,0,0,0|1,0,0]=3 968 B9R1.2 CCC1=CC(=CC=C1)O E156226 [1,1,0,0,0,0|1,0,0]=3 969 B9R1.2 CCC1=CC(=NC=C1)N A123353 [1,1,0,0,0,0|2,0,0]=4 970 B9R1.2 CCC1=CC=CC(=C1)C E113367 [1,1,0,0,0,0|1,0,0]=3 971 B9R1.2 CCC1=NC(=NC=C1)N E586542 [1,1,0,0,0,0|1,0,0]=3 972 B9R1.2 CC[N+]1=CC=CC(=C1)C E121235 [1,1,0,0,0,0|2,0,0]=4 973 B9R1.2 CC[N+]1=CC=CC(=C1)O E472644 [1,1,0,0,0,0|2,0,0]=4 974 B9R1.2 CNC1=CC(=CC=C1)Br B194483 [1,1,0,0,0,0|2,0,0]=4 975 B9R1.2 CNC1=CC(=CC=C1)Cl C153906 [1,1,0,0,0,0|2,0,0]=4 976 B9R1.2 CNC1=CC(=CC=C1)F F168315 [1,1,0,0,0,0|2,0,0]=4 977 B9R1.2 CNC1=CC(=CC=C1)O M587311 [1,1,0,0,0,0|2,0,0]=4 978 B9R1.2 CNC1=CC(=NC=N1)Cl C194437 [1,1,0,0,0,0|2,0,0]=4 979 B9R1.2 CNC1=NC(=CC=C1)Cl C195623 [1,1,0,0,0,0|1,0,0]=3 980 B9R1.2 COC1=CC(=CC=C1)Br B100846 [1,1,0,0,0,0|2,0,0]=4 981 B9R1.2 COC1=CC(=CC=C1)Cl C106486 [1,1,0,0,0,0|2,0,0]=4 982 B9R1.2 COC1=CC(=CC=C1)F F120587 [1,1,0,0,0,0|2,0,0]=4 983 B9R1.2 COC1=CC(=CC=C1)I I123674 [1,1,0,0,0,0|2,0,0]=4 984 B9R1.2 COC1=CC(=CC=C1)S M101779 [1,1,0,0,0,0|2,0,0]=4 985 B9R1.2 COC1=CC(=NC=N1)Cl C120232 [1,1,0,0,0,0|2,0,0]=4 986 B9R1.2 COC1=CC=CC(=C1)N A107482 [1,1,0,0,0,0|2,0,0]=4 987 B9R1.2 COC1=CC=CC(=C1)O M109432 [1,1,0,0,0,0|2,0,0]=4 988 B9R1.2 COC1=CC=CC(=C1)[CH2-] M300737 [1,1,0,0,0,0|2,0,0]=4 989 B9R1.2 COC1=CC=CC(=N1)N A119397 [1,1,0,0,0,0|1,0,0]=3 990 B9R1.2 COC1=NC(=CC=C1)Br B115753 [1,1,0,0,0,0|1,0,0]=3 991 B9R1.2 COC1=NC(=CC=C1)Cl C115751 [1,1,0,0,0,0|1,0,0]=3 992 B9R1.2 COC1=NC(=CC=C1)F F179764 [1,1,0,0,0,0|1,0,0]=3 993 B9R1.2 COC1=NC(=CC=C1)I I168070 [1,1,0,0,0,0|1,0,0]=3 994 B9R1.2 COC1=NC(=NC=C1)Cl C138524 [1,1,0,0,0,0|2,0,0]=4 995 B9R1.2 COC1=NC=CC(=C1)Br B178692 [1,1,0,0,0,0|1,0,0]=3 996 B9R1.2 COC1=NC=CC(=C1)Cl C186239 [1,1,0,0,0,0|1,0,0]=3 997 B9R1.2 COC1=NC=CC(=C1)N M119976 [1,1,0,0,0,0|1,0,0]=3 998 B9R1.2 COC1=NC=CC(=N1)N M176143 [1,1,0,0,0,0|2,0,0]=4 999 B9R1.2 COC1=NC=NC(=C1)N A333072 [1,1,0,0,0,0|2,0,0]=4 1000 B9R1.2 CSC1=CC(=CC=C1)Br B101842 [1,1,0,0,0,0|2,0,0]=4 1001 B9R1.2 CSC1=CC(=CC=C1)Cl C101839 [1,1,0,0,0,0|2,0,0]=4 1002 B9R1.2 CSC1=CC(=NC=N1)Cl C136932 [1,1,0,0,0,0|2,0,0]=4 1003 B9R1.2 CSC1=CC=CC(=C1)F F156685 [1,1,0,0,0,0|2,0,0]=4 1004 B9R1.2 CSC1=CC=CC(=C1)N M101834 [1,1,0,0,0,0|2,0,0]=4 1005 B9R1.2 CSC1=NC=CC(=N1)Cl C123212 [1,1,0,0,0,0|2,0,0]=4 1006 B9R1.2 CSC1=NC=CC(=N1)N W135362 [1,1,0,0,0,0|2,0,0]=4 1007 B9R1.2 CSC1=NC=CC(=O)N1 M139019 [1,1,0,0,0,0|2,0,0]=4 1008 B9R1.6 B(C1=CC=CC=N1)(O)O P123314 [1,1,0,0,0,0|2,0,0]=4 1009 B9R1.6 C1=CC=C(C=C1)C(Br)Br D300412 [1,1,0,0,0,0|2,0,0]=4 1010 B9R1.6 C1=CC=C(C=C1)C(F)F D404169 [1,1,0,0,0,0|2,0,0]=4 1011 B9R1.6 C1=CC=NC(=C1)C(=N)N A130010 [1,1,0,0,0,0|1,0,1]=4 1012 B9R1.6 C1=CC=NC(=C1)C(=O)Cl P133422 [1,1,0,0,0,0|1,0,1]=4 1013 B9R1.6 C1=CC=NC(=C1)C(=O)N P138238 [1,1,0,0,0,0|1,0,1]=4 1014 B9R1.6 C1=CC=NC(=C1)C(=O)O D118689 [1,1,0,0,0,0|1,0,1]=4 1015 B9R1.6 C1=CC=NC(=C1)C(=O)O P101920 [1,1,0,0,0,0|1,0,1]=4 1016 B9R1.6 C1=CC=NC(=C1)C(=O)O P160049 [1,1,0,0,0,0|1,0,1]=4 1017 B9R1.6 C1=CC=NC(=C1)C(=O)[O-] C101910 [1,1,0,0,0,0|1,0,1]=4 1018 B9R1.6 C1=CC=NC(=C1)C(=O)[O-] C421694 [1,1,0,0,0,0|1,0,1]=4 1019 B9R1.6 C1=CC=NC(=C1)C(F)F D166109 [1,1,0,0,0,0|1,0,0]=3 1020 B9R1.6 C1=CC=NC(=C1)S(=O)[O-] S404833 [1,1,0,0,0,0|2,0,0]=4 1021 B9R1.6 C1=CC=NC(=C1)[N+](=O)[O-] N167434 [1,1,0,0,0,0|2,0,0]=4 1022 B9R1.6 CC(=C)C1=CC=CC=C1 M104900 [1,1,0,0,0,0|1,0,1]=4 1023 B9R1.6 CC(=C)C1=CC=CC=C1 M104901 [1,1,0,0,0,0|1,0,1]=4 1024 B9R1.6 CC(=C)C1=CC=CC=C1 P347730 [1,1,0,0,0,0|1,0,1]=4 1025 B9R1.6 CC(=C)C1=CC=CC=C1 P491419 [1,1,0,0,0,0|1,0,1]=4 1026 B9R1.6 CC(=O)C1=CC=CC=C1 A103666 [1,1,0,0,0,0|1,0,1]=4 1027 B9R1.6 CC(=O)C1=CC=CC=C1 A103667 [1,1,0,0,0,0|1,0,1]=4 1028 B9R1.6 CC(=O)C1=CC=CC=C1 A103669 [1,1,0,0,0,0|1,0,1]=4 1029 B9R1.6 CC(=O)C1=CC=CC=C1 A427211 [1,1,0,0,0,0|1,0,1]=4 1030 B9R1.6 CC(=O)C1=CC=CC=C1 A471960 [1,1,0,0,0,0|1,0,1]=4 1031 B9R1.6 CC(=O)C1=CC=CC=C1 A474131 [1,1,0,0,0,0|1,0,1]=4 1032 B9R1.6 CC(=O)C1=CC=CC=C1 A474138 [1,1,0,0,0,0|1,0,1]=4 1033 B9R1.6 CC(=O)C1=CC=CC=N1 A106232 [1,1,0,0,0,0|0,0,1]=3 1034 B9R1.6 CC(=O)C1=CC=CC=N1 A106233 [1,1,0,0,0,0|0,0,1]=3 1035 B9R1.6 CC(=O)C1=NC=CC=N1 P176709 [1,1,0,0,0,0|1,0,1]=4 1036 B9R1.6 CC(=O)C1=NC=CN=C1 A100996 [1,1,0,0,0,0|1,0,1]=4 1037 B9R1.6 CC(C)C1=CC=CC=C1 I101049 [1,1,0,0,0,0|1,0,0]=3 1038 B9R1.6 CC(C)C1=CC=CC=C1 I101050 [1,1,0,0,0,0|1,0,0]=3 1039 B9R1.6 CC(C)C1=CC=CC=C1 I101052 [1,1,0,0,0,0|1,0,0]=3 1040 B9R1.6 CC(C)C1=CC=CC=N1 I177046 [1,1,0,0,0,0|0,0,0]=2 1041 B9R1.6 CC(C)C1=CC=NC=C1 I136834 [1,1,0,0,0,0|2,0,0]=4 1042 B9R1.6 CC(C1=CC=CC=C1)Br B104540 [1,1,0,0,0,0|1,0,0]=3 1043 B9R1.6 CC(C1=CC=CC=C1)Cl C107586 [1,1,0,0,0,0|1,0,0]=3 1044 B9R1.6 CC(C1=CC=CC=C1)N M105678 [1,1,0,0,0,0|1,0,0]=3 1045 B9R1.6 CC(C1=CC=CC=C1)N M105679 [1,1,0,0,0,0|1,0,0]=3 1046 B9R1.6 CC(C1=CC=CC=C1)N M106714 [1,1,0,0,0,0|1,0,0]=3 1047 B9R1.6 CC(C1=CC=CC=C1)N M141280 [1,1,0,0,0,0|1,0,0]=3 1048 B9R1.6 CC(C1=CC=CC=C1)N R432669 [1,1,0,0,0,0|1,0,0]=3 1049 B9R1.6 CC(C1=CC=CC=C1)N R432670 [1,1,0,0,0,0|1,0,0]=3 1050 B9R1.6 CC(C1=CC=CC=C1)N R432682 [1,1,0,0,0,0|1,0,0]=3 1051 B9R1.6 CC(C1=CC=CC=C1)N S135224 [1,1,0,0,0,0|1,0,0]=3 1052 B9R1.6 CC(C1=CC=CC=C1)N S432505 [1,1,0,0,0,0|1,0,0]=3 1053 B9R1.6 CC(C1=CC=CC=C1)O P100878 [1,1,0,0,0,0|1,0,0]=3 1054 B9R1.6 CC(C1=CC=CC=C1)O P103660 [1,1,0,0,0,0|1,0,0]=3 1055 B9R1.6 CC(C1=CC=CC=C1)O P113820 [1,1,0,0,0,0|1,0,0]=3 1056 B9R1.6 CC(C1=CC=CC=C1)O P165285 [1,1,0,0,0,0|1,0,0]=3 1057 B9R1.6 CC(C1=CC=CC=N1)N P589080 [1,1,0,0,0,0|0,0,0]=2 1058 B9R1.6 CC(C1=CC=CC=N1)O P191765 [1,1,0,0,0,0|0,0,0]=2 1059 B9R1.6 CC(C1=CC=CC=N1)O R404547 [1,1,0,0,0,0|0,0,0]=2 1060 B9R1.6 CC(C1=CC=CC=N1)O S161029 [1,1,0,0,0,0|0,0,0]=2 1061 B9R1.6 CC(C1=CC=NC=C1)N A467309 [1,1,0,0,0,0|2,0,0]=4 1062 B9R1.6 CC(C1=CC=NC=C1)O I170921 [1,1,0,0,0,0|2,0,0]=4 1063 B9R1.6 CC(C1=CC=NC=C1)O R192493 [1,1,0,0,0,0|2,0,0]=4 1064 B9R1.6 CC(C1=CN=CC=C1)N P193948 [1,1,0,0,0,0|2,0,0]=4 1065 B9R1.6 CN(C)C1=CC=CC=C1 D100060 [1,1,0,0,0,0|2,0,0]=4 1066 B9R1.6 CN(C)C1=CC=CC=C1 D100061 [1,1,0,0,0,0|2,0,0]=4 1067 B9R1.6 CN(C)C1=CC=CC=C1 D100063 [1,1,0,0,0,0|2,0,0]=4 1068 B9R1.6 CN(C)C1=CC=CC=N1 D154133 [1,1,0,0,0,0|1,0,0]=3 1069 B9R1.6 CN(C1=CC=CC=C1)N M298692 [1,1,0,0,0,0|2,0,0]=4 1070 B9R1.6 CP(C)C1=CC=CC=C1 C118698 [1,1,0,0,0,0|2,0,0]=4 1071 B9R1.6 CP(C)C1=CC=CC=C1 D115603 [1,1,0,0,0,0|2,0,0]=4 1072 B9R1.6 CS(=O)C1=CC=CC=C1 M158079 [1,1,0,0,0,0|2,0,0]=4 1073 B9R1.6 CS(=O)C1=CC=CC=C1 M464276 [1,1,0,0,0,0|2,0,0]=4 1074 B9R1.6 C[Si](=O)C1=CC=CC=C1 P331251 [1,1,0,0,0,0|1,1,0]=4 1075 B9R1.6 C[Si](C)C1=CC=CC=C1 D111809 [1,1,0,0,0,0|1,1,0]=4 1076 B9R1.6 C[Si](C)C1=CC=CC=N1 D331179 [1,1,0,0,0,0|0,1,0]=3 1077 B9R1.15 C1=CC(=C(N=C1)C#N)Br B119398 [1,1,0,0,0,0|1,0,1]=4 1078 B9R1.15 C1=CC(=C(N=C1)C#N)Cl C122677 [1,1,0,0,0,0|1,0,1]=4 1079 B9R1.15 C1=CC(=C(N=C1)C#N)F F178583 [1,1,0,0,0,0|1,0,1]=4 1080 B9R1.15 C1=CC(=C(N=C1)C#N)O C139454 [1,1,0,0,0,0|1,0,1]=4 1081 B9R1.15 C1=CC(=C(N=C1)C=O)Br B482551 [1,1,0,0,0,0|1,0,1]=4 1082 B9R1.15 C1=CC(=C(N=C1)C=O)Cl C182663 [1,1,0,0,0,0|1,0,1]=4 1083 B9R1.15 C1=CC(=C(N=C1)C=O)F F121803 [1,1,0,0,0,0|1,0,1]=4 1084 B9R1.15 C1=CC(=C(N=C1)C=O)O H175252 [1,1,0,0,0,0|1,0,1]=4 1085 B9R1.15 C1=CC(=C(N=C1)CCl)Br B180455 [1,1,0,0,0,0|1,0,0]=3 1086 B9R1.15 C1=CC(=C(N=C1)CO)Br B184967 [1,1,0,0,0,0|1,0,0]=3 1087 B9R1.15 C1=CC(=C(N=C1)CO)F F176083 [1,1,0,0,0,0|1,0,0]=3 1088 B9R1.15 C1=CC(=C(N=C1)NN)Cl C182994 [1,1,0,0,0,0|2,0,0]=4 1089 B9R1.15 C1=CC=C(C(=C1)CBr)Br B124758 [1,1,0,0,0,0|2,0,0]=4 1090 B9R1.15 C1=CC=C(C(=C1)CBr)Cl C135217 [1,1,0,0,0,0|2,0,0]=4 1091 B9R1.15 C1=CC=C(C(=C1)CBr)F F107111 [1,1,0,0,0,0|2,0,0]=4 1092 B9R1.15 C1=CC=C(C(=C1)CBr)I I101707 [1,1,0,0,0,0|2,0,0]=4 1093 B9R1.15 C1=CC=C(C(=C1)CBr)I I131028 [1,1,0,0,0,0|2,0,0]=4 1094 B9R1.15 C1=CC=C(C(=C1)CCl)Cl C136424 [1,1,0,0,0,0|2,0,0]=4 1095 B9R1.15 C1=CC=C(C(=C1)CCl)F F104448 [1,1,0,0,0,0|2,0,0]=4 1096 B9R1.15 C1=CC=C(C(=C1)CCl)I I472524 [1,1,0,0,0,0|2,0,0]=4 1097 B9R1.15 C1=CC=C(C(=C1)CN)Br B136382 [1,1,0,0,0,0|2,0,0]=4 1098 B9R1.15 C1=CC=C(C(=C1)CN)Br B184269 [1,1,0,0,0,0|2,0,0]=4 1099 B9R1.15 C1=CC=C(C(=C1)CN)Cl C100661 [1,1,0,0,0,0|2,0,0]=4 1100 B9R1.15 C1=CC=C(C(=C1)CN)Cl C298505 [1,1,0,0,0,0|2,0,0]=4 1101 B9R1.15 C1=CC=C(C(=C1)CN)F F122768 [1,1,0,0,0,0|2,0,0]=4 1102 B9R1.15 C1=CC=C(C(=C1)CN)O A195905 [1,1,0,0,0,0|2,0,0]=4 1103 B9R1.15 C1=CC=C(C(=C1)CO)Br B135325 [1,1,0,0,0,0|2,0,0]=4 1104 B9R1.15 C1=CC=C(C(=C1)CO)Cl C101747 [1,1,0,0,0,0|2,0,0]=4 1105 B9R1.15 C1=CC=C(C(=C1)CO)F F156600 [1,1,0,0,0,0|2,0,0]=4 1106 B9R1.15 C1=CC=C(C(=C1)CO)I I157441 [1,1,0,0,0,0|2,0,0]=4 1107 B9R1.15 C1=CC=C(C(=C1)CO)N A151122 [1,1,0,0,0,0|2,0,0]=4 1108 B9R1.15 C1=CC=C(C(=C1)CO)O H106789 [1,1,0,0,0,0|2,0,0]=4 1109 B9R1.15 C1=CC=C(C(=C1)CO)O H426756 [1,1,0,0,0,0|2,0,0]=4 1110 B9R1.15 C1=CC=C(C(=C1)CS)Br B101794 [1,1,0,0,0,0|2,0,0]=4 1111 B9R1.15 C1=CC=C(C(=C1)CS)Cl C101788 [1,1,0,0,0,0|2,0,0]=4 1112 B9R1.15 CC1=C(N=CC=C1)C#N C108042 [1,1,0,0,0,0|1,0,1]=4 1113 B9R1.15 CC1=C(N=CC=C1)C=O M120655 [1,1,0,0,0,0|1,0,1]=4 1114 B9R1.15 CC1=C(N=CC=C1)CN A482619 [1,1,0,0,0,0|1,0,0]=3 1115 B9R1.15 CC1=CC=CC=C1CBr M139409 [1,1,0,0,0,0|2,0,0]=4 1116 B9R1.15 CC1=CC=CC=C1CCl M101671 [1,1,0,0,0,0|2,0,0]=4 1117 B9R1.15 CC1=CC=CC=C1CN M158667 [1,1,0,0,0,0|2,0,0]=4 1118 B9R1.15 CC1=CC=CC=C1CO M157901 [1,1,0,0,0,0|2,0,0]=4 1119 B9R1.15 CC1=CC=CC=C1CS M300495 [1,1,0,0,0,0|2,0,0]=4 1120 B9R1.15 CC1=CC=CC=C1NC N159021 [1,1,0,0,0,0|2,0,0]=4 1121 B9R1.15 CC1=CC=CC=C1OC M158113 [1,1,0,0,0,0|2,0,0]=4 1122 B9R1.15 CC1=NC=CN=C1CO M174600 [1,1,0,0,0,0|2,0,0]=4 1123 B9R1.15 CC1=NC=CN=C1OC M102551 [1,1,0,0,0,0|2,0,0]=4 1124 B9R1.15 CC1=NC=CN=C1SC M102553 [1,1,0,0,0,0|2,0,0]=4 1125 B9R1.15 CCC1=CC=CC=C1Br B138432 [1,1,0,0,0,0|1,0,0]=3 1126 B9R1.15 CCC1=CC=CC=C1C E140581 [1,1,0,0,0,0|1,0,0]=3 1127 B9R1.15 CCC1=CC=CC=C1I E189052 [1,1,0,0,0,0|1,0,0]=3 1128 B9R1.15 CCC1=CC=CC=C1N E106226 [1,1,0,0,0,0|1,0,0]=3 1129 B9R1.15 CCC1=CC=CC=C1O E156225 [1,1,0,0,0,0|1,0,0]=3 1130 B9R1.15 CCC1=CC=CC=C1S E101792 [1,1,0,0,0,0|1,0,0]=3 1131 B9R1.15 CCC1=NC=CN=C1C E105685 [1,1,0,0,0,0|1,0,0]=3 1132 B9R1.15 CCC1=NC=NC=C1F E173725 [1,1,0,0,0,0|1,0,0]=3 1133 B9R1.15 CC[N+]1=CC=CC=C1C E303437 [1,1,0,0,0,0|2,0,0]=4 1134 B9R1.15 CNC1=C(C=CC=N1)N N589280 [1,1,0,0,0,0|1,0,0]=3 1135 B9R1.15 CNC1=CC=CC=C1Br B186004 [1,1,0,0,0,0|2,0,0]=4 1136 B9R1.15 CNC1=CC=CC=C1Cl C153908 [1,1,0,0,0,0|2,0,0]=4 1137 B9R1.15 CNC1=CC=CC=C1F F132815 [1,1,0,0,0,0|2,0,0]=4 1138 B9R1.15 CNC1=CC=CC=C1N I134172 [1,1,0,0,0,0|2,0,0]=4 1139 B9R1.15 CNC1=CC=CC=C1N M106013 [1,1,0,0,0,0|2,0,0]=4 1140 B9R1.15 CNC1=CC=CC=C1O M194184 [1,1,0,0,0,0|2,0,0]=4 1141 B9R1.15 COC1=C(C=CC=N1)Br B120788 [1,1,0,0,0,0|1,0,0]=3 1142 B9R1.15 COC1=C(C=CC=N1)Cl C153781 [1,1,0,0,0,0|1,0,0]=3 1143 B9R1.15 COC1=C(C=CC=N1)F F195529 [1,1,0,0,0,0|1,0,0]=3 1144 B9R1.15 COC1=C(C=CC=N1)I l102600 [1,1,0,0,0,0|1,0,0]=3 1145 B9R1.15 COC1=C(C=CC=N1)N M102591 [1,1,0,0,0,0|1,0,0]=3 1146 B9R1.15 COC1=C(C=CC=N1)O M587025 [1,1,0,0,0,0|1,0,0]=3 1147 B9R1.15 COC1=CC=CC=C1Br B109257 [1,1,0,0,0,0|2,0,0]=4 1148 B9R1.15 COC1=CC=CC=C1Cl C110652 [1,1,0,0,0,0|2,0,0]=4 1149 B9R1.15 COC1=CC=CC=C1F F120586 [1,1,0,0,0,0|2,0,0]=4 1150 B9R1.15 COC1=CC=CC=C1I I101929 [1,1,0,0,0,0|2,0,0]=4 1151 B9R1.15 COC1=CC=CC=C1N A103995 [1,1,0,0,0,0|2,0,0]=4 1152 B9R1.15 COC1=CC=CC=C1N A103997 [1,1,0,0,0,0|2,0,0]=4 1153 B9R1.15 COC1=CC=CC=C1N A141230 [1,1,0,0,0,0|2,0,0]=4 1154 B9R1.15 COC1=CC=CC=C1N O160024 [1,1,0,0,0,0|2,0,0]=4 1155 B9R1.15 COC1=CC=CC=C1O G112735 [1,1,0,0,0,0|2,0,0]=4 1156 B9R1.15 COC1=CC=CC=C1O G426764 [1,1,0,0,0,0|2,0,0]=4 1157 B9R1.15 COC1=CC=CC=C1S M101778 [1,1,0,0,0,0|2,0,0]=4 1158 B9R1.15 COC1=NC=CN=C1Cl C193237 [1,1,0,0,0,0|2,0,0]=4 1159 B9R1.15 COC1=NC=CN=C1N M589216 [1,1,0,0,0,0|2,0,0]=4 1160 B9R1.15 CSC1=CC=CC=C1Br B101843 [1,1,0,0,0,0|2,0,0]=4 1161 B9R1.15 CSC1=CC=CC=C1Cl C101838 [1,1,0,0,0,0|2,0,0]=4 1162 B9R1.15 CSC1=CC=CC=C1F F101836 [1,1,0,0,0,0|2,0,0]=4 1163 B9R1.15 CSC1=CC=CC=C1N M158418 [1,1,0,0,0,0|2,0,0]=4 1164 B9R1.15 CSC1=CC=CC=C1O M101847 [1,1,0,0,0,0|2,0,0]=4 1165 B9R1.7 C1=C(C=NN1CCO)N A188563 [0,1,0,0,1,0|2,0,0]=4 1166 B9R1.7 CCCC1=NN=C(O1)N P341058 [0,1,0,0,1,0|2,0,0]=4 1167 B9R1.7 CCCN1C=C(C=N1)Cl C586583 [0,1,0,0,1,0|1,0,0]=3 1168 B9R1.7 CCCN1C=C[N+](=C1)C M101510 [0,1,0,0,1,0|2,0,0]=4 1169 B9R1.7 CCCN1C=C[N+](=C1)C M281603 [0,1,0,0,1,0|2,0,0]=4 1170 B9R1.7 CCCN1C=C[N+](=C1)C M303056 [0,1,0,0,1,0|2,0,0]=4 1171 B9R1.7 CCCN1C=C[N+](=C1)C M303176 [0,1,0,0,1,0|2,0,0]=4 1172 B9R1.7 CCCN1C=NC(=N1)N P171095 [0,1,0,0,1,0|2,0,0]=4 1173 B9R1.11 CCC(=O)C1=CC=CO1 P339593 [0,1,0,0,1,0|1,0,1]=4 1174 B9R1.11 CCC(=O)C1=CC=CS1 P160666 [0,1,0,0,1,0|1,0,1]=4 1175 B9R1.11 CCC(=O)C1=NC=CS1 P160318 [0,1,0,0,1,0|1,0,1]=4 1176 B9R1.12 C1=CN(C=C1)CCC#N C170334 [0,1,0,0,1,0|1,0,1]=4 1177 B9R1.12 C1=CN(C=C1)CCCBr B152723 [0,1,0,0,1,0|1,0,0]=3 1178 B9R1.12 C1=CN(C=C1)CCCO H157253 [0,1,0,0,1,0|1,0,0]=3 1179 B9R1.12 C1=CN(C=N1)CCCN A151397 [0,1,0,0,1,0|2,0,0]=4 1180 B9R1.12 C1=CN(C=N1)CCCN A299081 [0,1,0,0,1,0|2,0,0]=4 1181 B9R1.12 CCCCC1=CC=CO1 B152372 [0,1,0,0,1,0|1,0,0]=3 1182 B9R1.12 CCCCC1=CC=CS1 N189024 [0,1,0,0,1,0|1,0,0]=3 1183 B9R1.12 CCCCC1=CSC=C1 B100752 [0,1,0,0,1,0|1,0,0]=3 1184 B9R1.12 CCCCC1=NC=CN1 B152375 [0,1,0,0,1,0|1,0,0]=3 1185 B9R1.12 CCCCN1C=CN=C1 B152373 [0,1,0,0,1,0|2,0,0]=4 1186 B9R1.12 CSSCC1=CC=CO1 F103101 [0,1,0,0,1,0|2,0,0]=4 1187 B9R1.13 CC(C)CC1=NC=CS1 I157522 [0,1,0,0,1,0|1,0,0]=3 1188 B9R1.33 C1=C(N(N=C1)CCO)N A151516 [0,1,0,0,1,0|2,0,0]=4 1189 B11R1.1 C1=CC(=CC=C1CCCN)Cl C191754 [0,2,0,0,0,0|1,0,0]=3 1190 B11R1.1 C1=CC(=CC=C1CCCO)Br B135402 [0,2,0,0,0,0|1,0,0]=3 1191 B11R1.1 C1=CC(=CC=C1CCCO)Cl C405534 [0,2,0,0,0,0|1,0,0]=3 1192 B11R1.1 C1=CC(=CC=C1CCCO)O W132591 [0,2,0,0,0,0|1,0,0]=3 1193 B11R1.1 C1=CC(=CC=C1OCCBr)Cl B152802 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.1 C1=CC(=CC=C1OCCBr)F F136245 [0,2,0,0,0,0|2,0,0]=4 1195 B11R1.1 C1=CC(=CC=C1OCCO)Br B140261 [0,2,0,0,0,0|2,0,0]=4 1196 B11R1.1 C1=CC(=CC=C1OCCO)Cl C140392 [0,2,0,0,0,0|2,0,0]=4 1197 B11R1.1 CC1=CC=C(C=C1)OCCO E140276 [0,2,0,0,0,0|2,0,0]=4 1198 B11R1.1 CCCCC1=CC=C(C=C1)Br B115516 [0,2,0,0,0,0|1,0,0]=3 1199 B11R1.1 CCCCC1=CC=C(C=C1)Cl B167540 [0,2,0,0,0,0|1,0,0]=3 1200 B11R1.1 CCCCC1=CC=C(C=C1)I B124312 [0,2,0,0,0,0|1,0,0]=3 1201 B11R1.1 CCCCC1=CC=C(C=C1)N B100731 [0,2,0,0,0,0|1,0,0]=3 1202 B11R1.1 CCCCC1=CC=C(C=C1)O B152848 [0,2,0,0,0,0|1,0,0]=3 1203 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120508 [0,2,0,0,0,0|2,0,0]=4 1204 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120511 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120512 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B343853 [0,2,0,0,0,0|2,0,0]=4 1207 B11R1.1 CCCC[N+]1=CC=C(C=C1)C W196192 [0,2,0,0,0,0|2,0,0]=4 1208 B11R1.1 CCCOC1=CC=C(C=C1)Br B138795 [0,2,0,0,0,0|1,0,0]=3 1209 B11R1.1 CCCOC1=CC=C(C=C1)N P420032 [0,2,0,0,0,0|1,0,0]=3 1210 B11R1.1 CCCOC1=CC=C(C=C1)O P132532 [0,2,0,0,0,0|1,0,0]=3 1211 B11R1.1 CCOCC1=CC=C(C=C1)O E194029 [0,2,0,0,0,0|1,0,0]=3 1212 B11R1.1 COCCC1=CC=C(C=C1)O M136398 [0,2,0,0,0,0|1,0,0]=3 1213 B11R1.20 C1=CC(=NC=C1Br)CC(=O)O B168241 [0,2,0,0,0,0|1,0,1]=4 1214 B11R1.20 C1=CC(=NC=C1N)OC(F)F D588703 [0,2,0,0,0,0|2,0,0]=4 1215 B11R1.20 CC(=O)CC1=CC=C(C=C1)Br B133524 [0,2,0,0,0,0|1,0,1]=4 1216 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl C136193 [0,2,0,0,0,0|1,0,1]=4 1217 B11R1.20 CC(=O)CC1=CC=C(C=C1)F F123996 [0,2,0,0,0,0|1,0,1]=4 1218 B11R1.20 CC(=O)NC1=NC=C(C=C1)Br A151676 [0,2,0,0,0,0|1,0,1]=4 1219 B11R1.20 CC(=O)NC1=NC=C(C=C1)I A405615 [0,2,0,0,0,0|1,0,1]=4 1220 B11R1.20 CC(C)CC1=CC=C(C=C1)Br B163036 [0,2,0,0,0,0|1,0,0]=3 1221 B11R1.20 CC(C)NC1=NN=C(C=C1)Cl C349940 [0,2,0,0,0,0|2,0,0]=4 1222 B11R1.20 CC(C)OC1=CC=C(C=C1)N I157723 [0,2,0,0,0,0|2,0,0]=4 1223 B11R1.20 CC(C)OC1=NC=C(C=C1)Br B187286 [0,2,0,0,0,0|1,0,0]=3 1224 B11R1.20 CC(C)OC1=NC=C(C=N1)Br B586638 [0,2,0,0,0,0|2,0,0]=4 1225 B11R1.20 CN(C)CC1=CC=C(C=C1)N A185751 [0,2,0,0,0,0|2,0,0]=4 1226 B11R1.22 C1=CC(=CC=C1C(CN)O)O O101521 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.22 C1=CC(=CC=C1C(CO)N)Br A587986 [0,2,0,0,0,0|2,0,0]=4 1228 B11R1.22 CC1=CN=C(C=C1)C(=O)OC M192593 [0,2,0,0,0,0|1,0,1]=4 1229 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br B137954 [0,2,0,0,0,0|1,0,1]=4 1230 B11R1.22 CCC(=O)C1=CC=C(C=C1)C M102232 [0,2,0,0,0,0|1,0,1]=4 1231 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl C109480 [0,2,0,0,0,0|1,0,1]=4 1232 B11R1.22 CCC(=O)C1=CC=C(C=C1)F F156638 [0,2,0,0,0,0|1,0,1]=4 1233 B11R1.22 CCC(=O)C1=CC=C(C=C1)N A419382 [0,2,0,0,0,0|1,0,1]=4 1234 B11R1.22 CCC(=O)C1=CC=C(C=C1)O H107590 [0,2,0,0,0,0|1,0,1]=4 1235 B11R1.22 CCC(C)C1=CC=C(C=C1)Br B136925 [0,2,0,0,0,0|1,0,0]=3 1236 B11R1.22 CCC(C)C1=CC=C(C=C1)N S161429 [0,2,0,0,0,0|1,0,0]=3 1237 B11R1.22 CCC(C)C1=CC=C(C=C1)O S161081 [0,2,0,0,0,0|1,0,0]=3 1238 B11R1.22 CCC(C1=CC=C(C=C1)Cl)N C489594 [0,2,0,0,0,0|1,0,0]=3 1239 B11R1.22 COC(=O)C1=NC=C(C=C1)Br M124673 [0,2,0,0,0,0|1,0,1]=4 1240 B11R1.22 COC(=O)C1=NC=C(C=C1)Cl M181170 [0,2,0,0,0,0|1,0,1]=4 1241 B11R1.22 COC(=O)C1=NC=C(C=C1)F M171909 [0,2,0,0,0,0|1,0,1]=4 1242 B11R1.22 COC(=O)C1=NC=C(C=C1)N M177143 [0,2,0,0,0,0|1,0,1]=4 1243 B11R1.22 COC(=O)C1=NC=C(C=C1)O M176070 [0,2,0,0,0,0|1,0,1]=4 1244 B11R1.22 NCC(O)C1=CC=C(O)C=C1 O408184 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.81 C1=CC(=C(C=C1Cl)Cl)CCBr D165846 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.81 C1=CC(=C(C=C1Cl)Cl)CCN D154340 [0,2,0,0,0,0|2,0,0]=4 1247 B11R1.81 C1=CC(=C(C=C1Cl)Cl)CCO D134031 [0,2,0,0,0,0|2,0,0]=4 1248 B11R1.81 CCOC1=C(C=C(C=C1)N)Cl C170766 [0,2,0,0,0,0|2,0,0]=4 1249 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Cl D178117 [0,2,0,0,0,0|2,0,0]=4 1250 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Cl D404190 [0,2,0,0,0,0|2,0,0]=4 1251 B11R1.83 C1=CC(=CC=C1CCBr)C#N B194753 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.83 C1=CC(=CC=C1CCN)C#N A167799 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.83 C1=CC(=CC=C1CCO)C#N H134819 [0,2,0,0,0,0|2,0,0]=4 1254 B11R1.83 CCC1=CC=C(C=C1)OCC E156094 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.83 CCC1=CN=C(C=C1)CCO E102922 [0,2,0,0,0,0|1,0,0]=3 1256 B11R1.83 CCCC1=CC=C(C=C1)C#C N115542 [0,2,0,0,0,0|1,0,0]=3 1257 B11R1.83 CCCC1=CC=C(C=C1)C=O P135756 [0,2,0,0,0,0|1,0,0]=3 1258 B11R1.83 CCCC1=CC=C(C=C1)OC M586236 [0,2,0,0,0,0|1,0,0]=3 1259 B11R1.83 CCOC1=CC=C(C=C1)C#C E156344 [0,2,0,0,0,0|2,0,0]=4 1260 B11R1.83 CCOC1=CC=C(C=C1)C#N E156327 [0,2,0,0,0,0|2,0,0]=4 1261 B11R1.83 CCOC1=CC=C(C=C1)C=C E477029 [0,2,0,0,0,0|2,0,0]=4 1262 B11R1.83 CCOC1=CC=C(C=C1)C=O E137923 [0,2,0,0,0,0|2,0,0]=4 1263 B11R1.83 CCOC1=CC=C(C=C1)CCl C194480 [0,2,0,0,0,0|2,0,0]=4 1264 B11R1.83 CCOC1=CC=C(C=C1)CO E156108 [0,2,0,0,0,0|2,0,0]=4 1265 B11R1.83 CNCC1=CC=C(C=C1)C#N M183867 [0,2,0,0,0,0|2,0,0]=4 1266 B11R1.83 CNCC1=CC=C(C=C1)OC M121878 [0,2,0,0,0,0|2,0,0]=4 1267 B11R1.83 CNCC1=CC=C(C=C1)OC M187530 [0,2,0,0,0,0|2,0,0]=4 1268 B11R1.83 COC1=CC=C(C=C1)CCBr M353698 [0,2,0,0,0,0|2,0,0]=4 1269 B11R1.83 COC1=CC=C(C=C1)CCN M106422 [0,2,0,0,0,0|2,0,0]=4 1270 B11R1.83 COC1=CC=C(C=C1)CCO M124605 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.83 COC1=CC=C(C=C1)CCO M493169 [0,2,0,0,0,0|2,0,0]=4 1272 B11R1.83 COCC1=CC=C(C=C1)OC M158116 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.192 C1=CC(=C(C=C1CCN)Cl)Cl D154344 [0,2,0,0,0,0|2,0,0]=4 1274 B11R1.192 C1=CC(=C(C=C1CCN)O)O A303863 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.192 C1=CC(=C(C=C1CCN)O)O A303864 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.192 C1=CC(=C(C=C1CCN)O)O D103111 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.192 C1=CC(=C(C=C1CCN)O)O D121757 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.192 C1=CC(=C(C=C1CCN)O)O H350369 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.192 C1=CC(=C(C=C1CCO)Cl)Cl D134939 [0,2,0,0,0,0|2,0,0]=4 1280 B11R1.192 C1=CC(=C(C=C1CCO)O)O H107675 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.192 C1=CC(=C(C=C1CCO)O)O H306005 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.192 C1=CC(=C(C=C1CCO)O)O H420486 [0,2,0,0,0,0|2,0,0]=4 1283 B11R1.192 CCCC1=CC(=C(C=C1)O)O P588420 [0,2,0,0,0,0|1,0,0]=3 1284 B11R1.192 CCOC1=CC(=C(C=C1)N)N E478624 [0,2,0,0,0,0|2,0,0]=4 1285 B11R1.192 CCOC1=NC=C(C(=O)N1)F F170997 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.192 NCCC1=CC(=C(O)C=C1)O D408026 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.13 CCOC1=C(C(=CC=C1)F)F D124108 [0,2,0,0,0,0|2,0,0]=4 1288 B11R1.17 C1=CC=C(C(=C1)CCC#N)Cl C194792 [0,2,0,0,0,0|1,0,1]=4 1289 B11R1.17 C1=CC=C(C(=C1)CCCO)Br B193732 [0,2,0,0,0,0|1,0,0]=3 1290 B11R1.17 C1=CC=C(C(=C1)O)OCCO H473338 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.17 CC1=CC=CC=C1OCCN M169151 [0,2,0,0,0,0|2,0,0]=4 1292 B11R1.17 CCCCC1=CC=CC=C1N B151822 [0,2,0,0,0,0|1,0,0]=3 1293 B11R1.41 CCOC1=CC=CC=C1C#N E101409 [0,2,0,0,0,0|2,0,0]=4 1294 B11R1.41 CCOC1=CC=CC=C1C=O E123026 [0,2,0,0,0,0|2,0,0]=4 1295 B11R1.41 CCOC1=CC=CC=C1CN E134140 [0,2,0,0,0,0|2,0,0]=4 1296 B11R1.41 CCOC1=CC=CC=C1OC E354173 [0,2,0,0,0,0|2,0,0]=4 1297 B11R1.41 CNCC1=CC=CC=C1OC M469543 [0,2,0,0,0,0|2,0,0]=4 1298 B11R1.41 COC1=CC=CC=C1CCN M132548 [0,2,0,0,0,0|2,0,0]=4 1299 B11R1.41 COC1=CC=CC=C1CCO M157916 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.86 CC(=O)CC1=CC=CC=C1Br B132331 [0,2,0,0,0,0|1,0,1]=4 1301 B11R1.86 CC(=O)CC1=CC=CC=C1F W135424 [0,2,0,0,0,0|1,0,1]=4 1302 B11R1.86 CC(=O)NC1=C(C=CC=N1)O N169499 [0,2,0,0,0,0|1,0,1]=4 1303 B11R1.86 CC(C)OC1=C(C=CC=N1)I I186504 [0,2,0,0,0,0|1,0,0]=3 1304 B11R1.86 CC(C)OC1=CC=CC=C1Br B135885 [0,2,0,0,0,0|2,0,0]=4 1305 B11R1.86 CC(C)OC1=CC=CC=C1O I119954 [0,2,0,0,0,0|2,0,0]=4 1306 B11R1.86 CC1=C(N=CC=C1)NC(=O)C A186388 [0,2,0,0,0,0|1,0,1]=4 1307 B11R1.86 CC1=NC=CN=C1CC(C)C I157645 [0,2,0,0,0,0|1,0,0]=3 1308 B11R1.86 CN(C)CC1=C(C=CC=N1)O D168639 [0,2,0,0,0,0|1,0,0]=3 1309 B11R1.86 CN(C)CC1=CC=CC=C1O D155339 [0,2,0,0,0,0|2,0,0]=4 1310 B11R1.182 C1=CC(=C(C=C1N)CCO)N H305004 [0,2,0,0,0,0|2,0,0]=4 1311 B11R1.182 CCNC1=C(C=CC(=C1)O)C E156228 [0,2,0,0,0,0|2,0,0]=4 1312 B11R1.182 CCOC1=C(C=CC(=C1)C)O B301186 [0,2,0,0,0,0|2,0,0]=4 1313 B11R1.222 C1=CC=C(C(=C1)C(CO)O)Cl S138159 [0,2,0,0,0,0|2,0,0]=4 1314 B11R1.222 CC1=C(N=CC=C1)C(=O)OC M135026 [0,2,0,0,0,0|1,0,1]=4 1315 B11R1.222 CCC(=O)C1=CC=CC=C1C M182612 [0,2,0,0,0,0|1,0,1]=4 1316 B11R1.222 CCC(=O)C1=CC=CC=C1Cl C194312 [0,2,0,0,0,0|1,0,1]=4 1317 B11R1.222 CCC(=O)C1=CC=CC=C1F F108013 [0,2,0,0,0,0|1,0,1]=4 1318 B11R1.222 CCC(=O)C1=CC=CC=C1O H156886 [0,2,0,0,0,0|1,0,1]=4 1319 B11R1.222 CCC(C)C1=CC=CC=C1O S161080 [0,2,0,0,0,0|1,0,0]=3 1320 B11R1.222 COC(=O)C1=C(C=CC=N1)Br M185065 [0,2,0,0,0,0|1,0,1]=4 1321 B11R1.222 COC(=O)C1=C(C=CC=N1)F M187270 [0,2,0,0,0,0|1,0,1]=4 1322 B11R1.222 COC(=O)C1=C(C=CC=N1)O M185645 [0,2,0,0,0,0|1,0,1]=4 1323 B11R1.605 C1=CC(=C(C(=C1)Cl)CCN)Cl D154341 [0,2,0,0,0,0|2,0,0]=4 1324 B11R1.605 C1=CC(=C(C(=C1)Cl)CCO)Cl D155746 [0,2,0,0,0,0|2,0,0]=4 1325 B11R1.605 COCC1=C(C=CC=C1Cl)Cl D405576 [0,2,0,0,0,0|2,0,0]=4 1326 B11R1.23 C1=CC(=CC(=C1)Br)C(CO)N A587851 [0,2,0,0,0,0|2,0,0]=4 1327 B11R1.23 C1=CC(=CC(=C1)O)C(CN)O R133855 [0,2,0,0,0,0|2,0,0]=4 1328 B11R1.23 CC1=CC(=NC=C1)C(=O)OC M190656 [0,2,0,0,0,0|1,0,1]=4 1329 B11R1.23 CC1=NC(=CC=C1)C(=O)OC M124763 [0,2,0,0,0,0|1,0,1]=4 1330 B11R1.23 CCC(=O)C1=CC(=CC=C1)Br B138434 [0,2,0,0,0,0|1,0,1]=4 1331 B11R1.23 CCC(=O)C1=CC(=CC=C1)Cl C136265 [0,2,0,0,0,0|1,0,1]=4 1332 B11R1.23 CCC(=O)C1=CC(=CC=C1)F F138865 [0,2,0,0,0,0|1,0,1]=4 1333 B11R1.23 CCC(=O)C1=CC(=CC=C1)O H190518 [0,2,0,0,0,0|1,0,1]=4 1334 B11R1.23 CNC(=O)C1=NC=CC(=C1)Cl C124049 [0,2,0,0,0,0|1,0,1]=4 1335 B11R1.23 COC(=O)C1=NC(=CC=C1)Br M120708 [0,2,0,0,0,0|1,0,1]=4 1336 B11R1.23 COC(=O)C1=NC(=CC=C1)Cl M158730 [0,2,0,0,0,0|1,0,1]=4 1337 B11R1.23 COC(=O)C1=NC(=CC=C1)F M170444 [0,2,0,0,0,0|1,0,1]=4 1338 B11R1.23 COC(=O)C1=NC(=CC=C1)I I348831 [0,2,0,0,0,0|1,0,1]=4 1339 B11R1.23 COC(=O)C1=NC(=CC=C1)N M157820 [0,2,0,0,0,0|1,0,1]=4 1340 B11R1.23 COC(=O)C1=NC=CC(=C1)Br M176043 [0,2,0,0,0,0|1,0,1]=4 1341 B11R1.23 COC(=O)C1=NC=CC(=C1)Cl C107904 [0,2,0,0,0,0|1,0,1]=4 1342 B11R1.23 COC(=O)C1=NC=CC(=C1)F M177985 [0,2,0,0,0,0|1,0,1]=4 1343 B11R1.23 COC(=O)C1=NC=CC(=C1)N M157824 [0,2,0,0,0,0|1,0,1]=4 1344 B11R1.24 C1=CC(=CC(=C1)Cl)CCC=O C167090 [0,2,0,0,0,0|1,0,1]=4 1345 B11R1.24 C1=CC(=CC(=C1)F)CCCBr B587429 [0,2,0,0,0,0|1,0,0]=3 1346 B11R1.24 CC1=CC(=CC=C1)OCCO E156106 [0,2,0,0,0,0|2,0,0]=4 1347 B11R1.24 CCCC[N+]1=CC=CC(=C1)C B120506 [0,2,0,0,0,0|2,0,0]=4 1348 B11R1.24 CCCC[N+]1=CC=CC(=C1)C B120507 [0,2,0,0,0,0|2,0,0]=4 1349 B11R1.24 CCNCC1=CC(=CC=C1)F N187982 [0,2,0,0,0,0|1,0,0]=3 1350 B11R1.34 CCCC1=CC(=CC(=C1)F)F D155056 [0,2,0,0,0,0|1,0,0]=3 1351 B11R1.34 CCCC1=CC(=O)NC(=S)N1 P106338 [0,2,0,0,0,0|1,0,1]=4 1352 B11R1.34 CCCC1=CC(=O)NC(=S)N1 P106339 [0,2,0,0,0,0|1,0,1]=4 1353 B11R1.34 CCCC1=CC(=O)NC(=S)N1 P408382 [0,2,0,0,0,0|1,0,1]=4 1354 B11R1.34 CCNC1=CC(=CC(=C1)C)C E299469 [0,2,0,0,0,0|2,0,0]=4 1355 B11R1.157 C1=CC(=NC(=C1)Br)CC(=O)O B586356 [0,2,0,0,0,0|1,0,1]=4 1356 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl C154068 [0,2,0,0,0,0|1,0,1]=4 1357 B11R1.157 CC(=O)CC1=CC(=CC=C1)F F191541 [0,2,0,0,0,0|1,0,1]=4 1358 B11R1.157 CC(=O)NC1=CC=CC(=N1)N A151791 [0,2,0,0,0,0|1,0,1]=4 1359 B11R1.157 CC(C)OC1=CC(=CC=C1)Br B152801 [0,2,0,0,0,0|2,0,0]=4 1360 B11R1.157 CC(C)OC1=NC=CC(=C1)Br B491328 [0,2,0,0,0,0|1,0,0]=3 1361 B11R1.157 CC1=CC(=NC=C1)NC(=O)C M124103 [0,2,0,0,0,0|1,0,1]=4 1362 B11R1.157 CC1=NC(=CC=C1)NC(=O)C N138955 [0,2,0,0,0,0|1,0,1]=4 1363 B11R1.157 CN(C)CC1=CC(=CC=C1)Br B184742 [0,2,0,0,0,0|2,0,0]=4 1364 B11R1.189 CCOC1=CC=CC(=C1)C=O E135710 [0,2,0,0,0,0|2,0,0]=4 1365 B11R1.189 CNCC1=CC(=CC=C1)OC M170257 [0,2,0,0,0,0|2,0,0]=4 1366 B11R1.189 COC1=CC=CC(=C1)CCBr M354174 [0,2,0,0,0,0|2,0,0]=4 1367 B11R1.189 COC1=CC=CC(=C1)CCN M123416 [0,2,0,0,0,0|2,0,0]=4 1368 B11R1.189 COC1=CC=CC(=C1)CCO M136341 [0,2,0,0,0,0|2,0,0]=4 1369 B11R1.7 CC(C)(CCl)C1=CC=CC=C1 C107610 [0,2,0,0,0,0|2,0,0]=4 1370 B11R1.7 CC(C)(CO)C1=CC=CC=C1 M294317 [0,2,0,0,0,0|2,0,0]=4 1371 B11R1.7 CCC(C)(C)C1=CC=CC=C1 A102508 [0,2,0,0,0,0|1,0,0]=3 1372 B11R1.7 CCC(C)(C1=CC=CC=C1)O P474236 [0,2,0,0,0,0|1,0,0]=3 1373 B11R1.7 CCS(=O)(=O)C1=CC=CC=C1 E156274 [0,2,0,0,0,0|2,0,0]=4 1374 B11R1.12 C1=CC=C(C=C1)C(CO)CO P160752 [0,2,0,0,0,0|2,0,0]=4 1375 B11R1.12 CCC(C#N)C1=CC=CC=C1 P139257 [0,2,0,0,0,0|1,0,0]=3 1376 B11R1.12 CCC(CC)C1=CC=CC=N1 P136764 [0,2,0,0,0,0|0,0,0]=2 1377 B11R1.12 CCN(CC)C1=CC=CC=C1 D111034 [0,2,0,0,0,0|2,0,0]=4 1378 B11R1.12 CCN(CC)C1=CC=CC=C1 D111035 [0,2,0,0,0,0|2,0,0]=4 1379 B11R1.12 CCN(CC)C1=CC=CC=C1 N138157 [0,2,0,0,0,0|2,0,0]=4 1380 B11R1.12 CCP(CC)C1=CC=CC=C1 D154321 [0,2,0,0,0,0|2,0,0]=4 1381 B11R1.12 CCP(CC)C1=CC=CC=C1 D196395 [0,2,0,0,0,0|2,0,0]=4 1382 B11R1.12 COC(C1=CC=CC=C1)OC B107016 [0,2,0,0,0,0|2,0,0]=4 1383 B11R1.12 COC(CO)C1=CC=CC=C1 M351712 [0,2,0,0,0,0|2,0,0]=4 1384 B11R1.16 C1=CC=C(C=C1)C(=O)CCCl C154064 [0,2,0,0,0,0|1,0,1]=4 1385 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C123100 [0,2,0,0,0,0|1,0,0]=3 1386 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C123101 [0,2,0,0,0,0|1,0,0]=3 1387 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C153387 [0,2,0,0,0,0|1,0,0]=3 1388 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101338 [0,2,0,0,0,0|1,0,0]=3 1389 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101343 [0,2,0,0,0,0|1,0,0]=3 1390 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101349 [0,2,0,0,0,0|1,0,0]=3 1391 B11R1.16 C=CCC(C1=CC=CC=C1)O P160315 [0,2,0,0,0,0|1,0,1]=4 1392 B11R1.16 CC(CC=O)C1=CC=CC=C1 P468811 [0,2,0,0,0,0|1,0,1]=4 1393 B11R1.16 CC(CCO)C1=CC=CC=C1 P169190 [0,2,0,0,0,0|1,0,0]=3 1394 B11R1.16 CC(CCO)C1=CC=CC=C1 P638679 [0,2,0,0,0,0|1,0,0]=3 1395 B11R1.16 CC(CNC)C1=CC=CC=C1 P342591 [0,2,0,0,0,0|1,0,0]=3 1396 B11R1.16 CCCC(=O)C1=CC=CC=C1 B100860 [0,2,0,0,0,0|1,0,0]=3 1397 B11R1.16 CCCC(=O)C1=CC=CC=N1 B588269 [0,2,0,0,0,0|0,0,0]=2 1398 B11R1.16 CCCC(C1=CC=CC=C1)O P160157 [0,2,0,0,0,0|1,0,0]=3 1399 B11R1.16 CCCC(C1=CC=CC=C1)O R468963 [0,2,0,0,0,0|1,0,0]=3 1400 B11R1.16 CCCC(C1=CC=CC=C1)O S468962 [0,2,0,0,0,0|1,0,0]=3 1401 B11R1.16 CCOC(=N)C1=CC=CC=C1 E170842 [0,2,0,0,0,0|1,0,1]=4 1402 B11R1.16 CCOC(=O)C1=CC=CC=C1 E103424 [0,2,0,0,0,0|1,0,1]=4 1403 B11R1.16 CCOC(=O)C1=CC=CC=C1 E103425 [0,2,0,0,0,0|1,0,1]=4 1404 B11R1.16 CCOC(=O)C1=CC=CC=C1 E103426 [0,2,0,0,0,0|1,0,1]=4 1405 B11R1.16 CCOC(=O)C1=CC=CC=N1 E133202 [0,2,0,0,0,0|0,0,1]=3 1406 B11R1.16 CCOC(=O)C1=NC=CC=N1 E184499 [0,2,0,0,0,0|1,0,1]=4 1407 B11R1.16 CCOC(=O)C1=NC=NC=C1 E156273 [0,2,0,0,0,0|1,0,1]=4 1408 B11R1.16 CCO[P+](=O)C1=CC=CC=C1 E133085 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.16 CN(CCO)C1=CC=CC=C1 M140172 [0,2,0,0,0,0|2,0,0]=4 1410 B11R1.16 CNCC(C1=CC=CC=C1)O M351446 [0,2,0,0,0,0|1,0,0]=3 1411 B11R1.16 COCC(C1=CC=CC=C1)N R185788 [0,2,0,0,0,0|1,0,0]=3 1412 B11R1.36 CC(C(=O)C1=CC=CC=C1)Cl C154066 [0,2,0,0,0,0|1,0,1]=4 1413 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 I134082 [0,2,0,0,0,0|1,0,1]=4 1414 B11R1.36 CC(C)C(=O)C1=CC=CC=N1 I185463 [0,2,0,0,0,0|0,0,1]=3 1415 B11R1.36 CC(C1=CC=CC=C1)N(C)C R160852 [0,2,0,0,0,0|2,0,0]=4 1416 B11R1.36 CC(C1=CC=CC=C1)N(C)C S161322 [0,2,0,0,0,0|2,0,0]=4 1417 B11R1.28 C#CCOCC1=CC=CC=C1 P589024 [0,2,0,0,0,0|1,0,1]=4 1418 B11R1.28 C1=CC=C(C=C1)CCCCBr B140194 [0,2,0,0,0,0|1,0,0]=3 1419 B11R1.28 C1=CC=C(C=C1)CCCCCl P404858 [0,2,0,0,0,0|1,0,0]=3 1420 B11R1.28 C1=CC=C(C=C1)CCCCN B292880 [0,2,0,0,0,0|1,0,0]=3 1421 B11R1.28 C1=CC=C(C=C1)CCCCN P160136 [0,2,0,0,0,0|1,0,0]=3 1422 B11R1.28 C1=CC=C(C=C1)CCCCN P160137 [0,2,0,0,0,0|1,0,0]=3 1423 B11R1.28 C1=CC=C(C=C1)CCCCN P493282 [0,2,0,0,0,0|1,0,0]=3 1424 B11R1.28 C1=CC=C(C=C1)CCCCO P138687 [0,2,0,0,0,0|1,0,0]=3 1425 B11R1.28 C1=CC=C(C=C1)CCN=C=O P160767 [0,2,0,0,0,0|1,0,1]=4 1426 B11R1.28 C1=CC=C(C=C1)CCN=C=S P102544 [0,2,0,0,0,0|1,0,1]=4 1427 B11R1.28 C1=CC=C(C=C1)CCNC=O I168819 [0,2,0,0,0,0|1,0,1]=4 1428 B11R1.28 C1=CC=C(C=C1)CCOC=O F302132 [0,2,0,0,0,0|1,0,1]=4 1429 B11R1.28 C1=CC=C(C=C1)CNCCN B124211 [0,2,0,0,0,0|1,0,0]=3 1430 B11R1.28 C1=CC=C(C=C1)CNCCO B111181 [0,2,0,0,0,0|1,0,0]=3 1431 B11R1.28 C1=CC=C(C=C1)COCC=O B136421 [0,2,0,0,0,0|1,0,1]=4 1432 B11R1.28 C1=CC=C(C=C1)COCCBr B107737 [0,2,0,0,0,0|1,0,0]=3 1433 B11R1.28 C1=CC=C(C=C1)COCCCl B132425 [0,2,0,0,0,0|1,0,0]=3 1434 B11R1.28 C1=CC=C(C=C1)COCCN B193115 [0,2,0,0,0,0|1,0,0]=3 1435 B11R1.28 C1=CC=C(C=C1)COCCO B111396 [0,2,0,0,0,0|1,0,0]=3 1436 B11R1.28 C1=CC=C(C=C1)CSCCO B140387 [0,2,0,0,0,0|1,0,0]=3 1437 B11R1.28 C1=CC=C(C=C1)NCCC#N A151772 [0,2,0,0,0,0|1,0,1]=4 1438 B11R1.28 C1=CC=C(C=C1)NCCCO A151778 [0,2,0,0,0,0|1,0,0]=3 1439 B11R1.28 C1=CC=C(C=C1)OCCCBr P160566 [0,2,0,0,0,0|1,0,0]=3 1440 B11R1.28 C1=CC=C(C=C1)OCCCN P353595 [0,2,0,0,0,0|1,0,0]=3 1441 B11R1.28 C1=CC=C(C=C1)OCCCO P160296 [0,2,0,0,0,0|1,0,0]=3 1442 B11R1.28 C1=CC=NC(=C1)SSCCN P302155 [0,2,0,0,0,0|1,0,0]=3 1443 B11R1.28 C1=CC=NC(=C1)SSCCO P404961 [0,2,0,0,0,0|1,0,0]=3 1444 B11R1.28 C1=CN=CC=C1CCCCO P193755 [0,2,0,0,0,0|2,0,0]=4 1445 B11R1.28 C=CCNCC1=CC=CC=C1 N158987 [0,2,0,0,0,0|1,0,1]=4 1446 B11R1.28 C=CCOCC1=CC=CC=C1 A151095 [0,2,0,0,0,0|1,0,1]=4 1447 B11R1.28 CCCC#CC1=CC=CC=C1 P404844 [0,2,0,0,0,0|1,0,0]=3 1448 B11R1.28 CCCCCC1=CC=CC=C1 A151374 [0,2,0,0,0,0|1,0,0]=3 1449 B11R1.28 CCCCCC1=CC=CC=N1 A132572 [0,2,0,0,0,0|0,0,0]=2 1450 B11R1.28 CCCCCC1=CC=NC=C1 A151146 [0,2,0,0,0,0|2,0,0]=4 1451 B11R1.28 CCCCCC1=NC=CN=C1 P345021 [0,2,0,0,0,0|1,0,0]=3 1452 B11R1.28 CCCCNC1=CC=CC=C1 B140175 [0,2,0,0,0,0|1,0,0]=3 1453 B11R1.28 CCCCNC1=CC=CC=C1 N590954 [0,2,0,0,0,0|1,0,0]=3 1454 B11R1.28 CCCCOC1=CC=CC=C1 B153006 [0,2,0,0,0,0|1,0,0]=3 1455 B11R1.28 CCCNCC1=CC=CC=C1 N191934 [0,2,0,0,0,0|1,0,0]=3 1456 B11R1.28 CCOC=NC1=CC=CC=C1 E156427 [0,2,0,0,0,0|1,0,1]=4 1457 B11R1.28 CNCCOC1=CC=CC=C1 N169984 [0,2,0,0,0,0|1,0,0]=3 1458 B11R1.28 OCCSCc1ccccc1 H109405 [0,2,0,0,0,0|1,0,0]=3 1459 B11R1.40 C1=CC=C(C=C1)CC(CO)N P100530 [0,2,0,0,0,0|1,0,0]=3 1460 B11R1.40 C1=CC=C(C=C1)CC(CO)N P109244 [0,2,0,0,0,0|1,0,0]=3 1461 B11R1.40 C1=CC=C(C=C1)CC(CO)N S160981 [0,2,0,0,0,0|1,0,0]=3 1462 B11R1.40 CC(CO)OC1=CC=CC=C1 P160292 [0,2,0,0,0,0|2,0,0]=4 1463 B11R1.40 CCC(=O)CC1=CC=CC=C1 P160130 [0,2,0,0,0,0|1,0,0]=3 1464 B11R1.40 CCC(=O)NC1=CC=CC=C1 N136678 [0,2,0,0,0,0|1,0,1]=4 1465 B11R1.40 CCC(=O)OC1=CC=CC=C1 P304243 [0,2,0,0,0,0|1,0,1]=4 1466 B11R1.40 CCC(CC1=CC=CC=C1)N P344719 [0,2,0,0,0,0|1,0,0]=3 1467 B11R1.40 CCC(CC1=CC=CC=C1)O E352402 [0,2,0,0,0,0|1,0,0]=3 1468 B11R1.40 COC(=O)CC1=CC=CC=C1 M106997 [0,2,0,0,0,0|1,0,1]=4 1469 B11R1.40 COC(=O)CC1=CC=CC=N1 M131920 [0,2,0,0,0,0|0,0,1]=3 1470 B11R1.40 COC(=O)CC1=NC=CN=C1 M193037 [0,2,0,0,0,0|1,0,1]=4 1471 B11R1.91 B(CCC1=CC=CC=C1)(O)O P119631 [0,2,0,0,0,0|2,0,0]=4 1472 B11R1.91 C1=CC=C(C=C1)CCC(=O)Cl P101406 [0,2,0,0,0,0|1,0,1]=4 1473 B11R1.91 C1=CC=C(C=C1)CCC(=O)N P160460 [0,2,0,0,0,0|1,0,1]=4 1474 B11R1.91 C1=CC=C(C=C1)CCC(=O)O P109276 [0,2,0,0,0,0|1,0,1]=4 1475 B11R1.91 C1=CC=C(C=C1)CCC(=O)O P109277 [0,2,0,0,0,0|1,0,1]=4 1476 B11R1.91 C1=CC=C(C=C1)CCC(=O)O P424323 [0,2,0,0,0,0|1,0,1]=4 1477 B11R1.91 C1=CC=NC(=C1)CCC(=O)O P167476 [0,2,0,0,0,0|0,0,1]=3 1478 B11R1.91 CC(=C)COC1=CC=CC=C1 M420042 [0,2,0,0,0,0|1,0,1]=4 1479 B11R1.91 CC(=O)CCC1=CC=CC=C1 P106914 [0,2,0,0,0,0|1,0,0]=3 1480 B11R1.91 CC(=O)COC1=CC=CC=C1 P160134 [0,2,0,0,0,0|1,0,1]=4 1481 B11R1.91 CC(=O)NCC1=CC=CC=C1 N159297 [0,2,0,0,0,0|1,0,1]=4 1482 B11R1.91 CC(=O)OCC1=CC=CC=C1 B109251 [0,2,0,0,0,0|1,0,1]=4 1483 B11R1.91 CC(=O)OCC1=CC=CC=C1 B109253 [0,2,0,0,0,0|1,0,1]=4 1484 B11R1.91 CC(C)NCC1=CC=CC=C1 B100437 [0,2,0,0,0,0|1,0,0]=3 1485 B11R1.91 CC(C)NCC1=CN=CC=C1 N168305 [0,2,0,0,0,0|2,0,0]=4 1486 B11R1.91 CC(CCC1=CC=CC=C1)N M168739 [0,2,0,0,0,0|1,0,0]=3 1487 B11R1.91 CC(CCC1=CC=CC=C1)O I168710 [0,2,0,0,0,0|1,0,0]=3 1488 B11R1.91 CC(CCC1=CC=CC=C1)O I170111 [0,2,0,0,0,0|1,0,0]=3 1489 B11R1.91 CC(CCC1=CC=CC=C1)O P160159 [0,2,0,0,0,0|1,0,0]=3 1490 B11R1.91 CC(COC1=CC=CC=C1)O B299831 [0,2,0,0,0,0|1,0,0]=3 1491 B11R1.91 CC(COC1=CC=CC=C1)O P135297 [0,2,0,0,0,0|1,0,0]=3 1492 B11R1.91 CN(C)CCC1=CC=CC=C1 N302096 [0,2,0,0,0,0|1,0,0]=3 1493 B11R1.509 C1=CC=NC(=C1)CP(=O)(O)O P399533 [0,2,0,0,0,0|2,0,0]=4 1494 B11R1.509 CC(C)(C)OC1=CC=CC=C1 B304332 [0,2,0,0,0,0|2,0,0]=4 1495 B11R1.509 CC(C)(C)OC1=CC=CC=N1 T195236 [0,2,0,0,0,0|1,0,0]=3 1496 B11R1.509 CC(C)(CC1=CC=CC=C1)O M113177 [0,2,0,0,0,0|1,0,0]=3 1497 B11R1.509 CC(C)(CC1=CC=CC=C1)O M115321 [0,2,0,0,0,0|1,0,0]=3 1498 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 B103720 [0,2,0,0,0,0|2,0,0]=4 1499 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 B103732 [0,2,0,0,0,0|2,0,0]=4 1500 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 B104501 [0,2,0,0,0,0|2,0,0]=4 1501 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 B104502 [0,2,0,0,0,0|2,0,0]=4 1502 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 B104503 [0,2,0,0,0,0|2,0,0]=4 1503 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 B138050 [0,2,0,0,0,0|2,0,0]=4 1504 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 B152297 [0,2,0,0,0,0|2,0,0]=4 1505 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 B152299 [0,2,0,0,0,0|2,0,0]=4 1506 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 N589160 [0,2,0,0,0,0|2,0,0]=4 1507 B11R1.509 C[Si](C)(C)CC1=CC=CC=C1 B152734 [0,2,0,0,0,0|1,1,0]=4 1508 B11R1.509 C[Si](C)(CC1=CC=CC=C1)Cl B152690 [0,2,0,0,0,0|1,1,0]=4 1509 B9R2.50 C1CC2=CC=CC=C21 B107638 [1,0,0,1,0,0|1,0,0]=3 1510 B9R2.2 C1CC1C2=CC=NN2 C586079 [0,0,0,1,1,0|1,0,1]=4 1511 B11R2.34 C1C(O1)C2=CC=C(C=C2)F I131966 [0,1,0,1,0,0|2,0,0]=4 1512 B11R2.34 C1CC1C2=CC=C(C=C2)Br B189729 [0,1,0,1,0,0|1,0,0]=3 1513 B11R2.34 C1CC1C2=CN=C(C=C2)Br B189780 [0,1,0,1,0,0|2,0,0]=4 1514 B11R2.34 C1CC1C2=CN=C(C=C2)Cl C586231 [0,1,0,1,0,0|2,0,0]=4 1515 B11R2.36 C1C2=C(CN1)C=C(C=C2)Br B178228 [0,1,0,1,0,0|2,0,0]=4 1516 B11R2.36 C1C2=C(CN1)C=C(C=C2)Br B480318 [0,1,0,1,0,0|2,0,0]=4 1517 B11R2.36 C1C2=C(CO1)C=C(C=C2)N D489691 [0,1,0,1,0,0|2,0,0]=4 1518 B11R2.36 C1CC2=C(C1)C=C(C=C2)N A151769 [0,1,0,1,0,0|1,0,0]=3 1519 B11R2.36 C1CC2=C(C1)C=C(C=C2)O H157229 [0,1,0,1,0,0|1,0,0]=3 1520 B11R2.36 C1CC2=C(C1)N=C(C=C2)Cl C586503 [0,1,0,1,0,0|0,0,0]=2 1521 B11R2.36 C1CNC2=C1C=C(C=C2)Br B124815 [0,1,0,1,0,0|2,0,0]=4 1522 B11R2.36 C1CNC2=C1C=C(C=C2)F F124808 [0,1,0,1,0,0|2,0,0]=4 1523 B11R2.36 C1CNC2=C1C=CC(=C2)Cl D303889 [0,1,0,1,0,0|2,0,0]=4 1524 B11R2.36 C1CNC2=C1C=CC(=C2)F F303147 [0,1,0,1,0,0|2,0,0]=4 1525 B11R2.36 C1COC2=C1C=C(C=C2)Br B152996 [0,1,0,1,0,0|2,0,0]=4 1526 B11R2.10 C1C(=O)CC2=CC=CC=C21 I111208 [0,1,0,1,0,0|1,0,1]=4 1527 B11R2.10 C1C(CC2=CC=CC=C21)O H157338 [0,1,0,1,0,0|1,0,0]=3 1528 B11R2.10 C1C2=C(NC1=O)N=CC=C2 H176810 [0,1,0,1,0,0|1,0,1]=4 1529 B11R2.10 CC1=CC2=C(N1)C=CC=N2 M304502 [0,1,0,1,0,0|0,0,2]=4 1530 B11R2.10 CC1=CC2=C(N1)N=CC=C2 M175848 [0,1,0,1,0,0|1,0,1]=4 1531 B11R2.10 CC1=NC2=C(O1)C=CC=N2 M187240 [0,1,0,1,0,0|1,0,1]=4 1532 B11R2.10 CC1CC2=CC=CC=C2N1 M103558 [0,1,0,1,0,0|1,0,0]=3 1533 B11R2.10 CC1CC2=CC=CC=C2O1 D137493 [0,1,0,1,0,0|1,0,0]=3 1534 B11R2.20 C1C=CCC2=CC=CC=C21 D155281 [0,1,0,1,0,0|1,0,1]=4 1535 B11R2.20 C1CC2=C(C=CC=N2)OC1 D186135 [0,1,0,1,0,0|0,0,0]=2 1536 B11R2.20 C1CC2=CC=CC=C2C=C1 D155011 [0,1,0,1,0,0|1,0,1]=4 1537 B11R2.20 C1CC2=CC=CC=C2NC1 T107484 [0,1,0,1,0,0|1,0,0]=3 1538 B11R2.20 C1CCC2=C(C1)C=CC=N2 T108003 [0,1,0,1,0,0|0,0,0]=2 1539 B11R2.20 C1CCC2=C(C1)C=CN=C2 T162590 [0,1,0,1,0,0|2,0,0]=4 1540 B11R2.20 C1CCC2=CC=CC=C2C1 T100976 [0,1,0,1,0,0|1,0,0]=3 1541 B11R2.20 C1CCC2=CC=CC=C2C1 T100978 [0,1,0,1,0,0|1,0,0]=3 1542 B11R2.20 C1CCC2=CC=CC=C2C1 T100979 [0,1,0,1,0,0|1,0,0]=3 1543 B11R2.20 C1CCC2=CC=CC=C2C1 T100981 [0,1,0,1,0,0|1,0,0]=3 1544 B11R2.20 C1CCC2=CC=CC=C2C1 T119673 [0,1,0,1,0,0|1,0,0]=3 1545 B11R2.20 C1CCC2=NC=CN=C2C1 T161676 [0,1,0,1,0,0|1,0,0]=3 1546 B11R2.20 C1CN=CC2=CC=CC=C21 D169557 [0,1,0,1,0,0|1,0,1]=4 1547 B11R2.20 C1CNC2=CC=CC=C2N1 T138703 [0,1,0,1,0,0|2,0,0]=4 1548 B11R2.20 C1CNCC2=C1C=CC=N2 T176221 [0,1,0,1,0,0|0,0,0]=2 1549 B11R2.20 C1CNCC2=CC=CC=C21 T139420 [0,1,0,1,0,0|1,0,0]=3 1550 B11R2.20 C1COC2=C(N1)C=CC=N2 D179428 [0,1,0,1,0,0|1,0,0]=3 1551 B11R2.20 C1COC2=C(O1)C=CC=N2 D166866 [0,1,0,1,0,0|1,0,0]=3 1552 B11R2.20 C1COC2=CC=CC=C2N1 H304033 [0,1,0,1,0,0|2,0,0]=4 1553 B11R2.20 C1COC2=CC=CC=C2O1 B103171 [0,1,0,1,0,0|2,0,0]=4 1554 B11R2.20 C1COCC2=CC=CC=C21 I122961 [0,1,0,1,0,0|1,0,0]=3 1555 B11R2.106 C1C2=C(CN1)C(=CC=C2)F F188297 [0,1,0,1,0,0|2,0,0]=4 1556 B11R2.106 C1CC2=C(C1)C(=CC=C2)N A169551 [0,1,0,1,0,0|1,0,0]=3 1557 B11R2.106 C1CC2=C(C1)C(=CC=C2)O I191362 [0,1,0,1,0,0|1,0,0]=3 1558 B11R2.106 C1CNC2=C1C(=CC=C2)Br B590407 [0,1,0,1,0,0|2,0,0]=4 1559 B11R2.106 C1COC2=C1C=CC=C2Br B191973 [0,1,0,1,0,0|2,0,0]=4 1560 B11R2.106 C1COC2=CC=CC(=C21)N D194182 [0,1,0,1,0,0|2,0,0]=4 1561 B11R2.35 C1CC1C2=CC(=CN=C2)N C586976 [0,1,0,1,0,0|2,0,0]=4 1562 B11R2.1 C1C2=C(C=CC=N2)C(=O)N1 D589008 [0,1,0,1,0,0|1,0,1]=4 1563 B11R2.1 C1CC(=O)C2=CC=CC=C21 I106436 [0,1,0,1,0,0|1,0,1]=4 1564 B11R2.1 C1CC(=O)C2=CC=CC=C21 I426156 [0,1,0,1,0,0|1,0,1]=4 1565 B11R2.1 C1CC2=C(C1O)C=CC=N2 D586296 [0,1,0,1,0,0|0,0,0]=2 1566 B11R2.1 C1CC2=CC=CC=C2C1N A114505 [0,1,0,1,0,0|1,0,0]=3 1567 B11R2.1 C1CC2=CC=CC=C2C1N D186125 [0,1,0,1,0,0|1,0,0]=3 1568 B11R2.1 C1CC2=CC=CC=C2C1N S192732 [0,1,0,1,0,0|1,0,0]=3 1569 B11R2.1 C1CC2=CC=CC=C2C1N S469445 [0,1,0,1,0,0|1,0,0]=3 1570 B11R2.1 C1CC2=CC=CC=C2C1O H157335 [0,1,0,1,0,0|1,0,0]=3 1571 B11R2.1 C1CC2=CC=CC=C2C1O H419517 [0,1,0,1,0,0|1,0,0]=3 1572 B11R2.1 C1CC2=CC=CC=C2C1O H592262 [0,1,0,1,0,0|1,0,0]=3 1573 B11R2.1 CC1CCC2=CC=CC=C12 M304586 [0,1,0,1,0,0|1,0,0]=3 1574 B11R2.1 CC1CCC2=NC=CN=C12 M111400 [0,1,0,1,0,0|1,0,0]=3 1575 B11R2.1 CC1CNC2=CC=CC=C12 M589123 [0,1,0,1,0,0|1,0,0]=3 1576 B11R2.4 C1C(C1N)C2=CC=CC=C2 R132818 [0,1,0,1,0,0|1,0,0]=3 1577 B11R2.4 C1C(C1N)C2=CC=CC=C2 T275460 [0,1,0,1,0,0|1,0,0]=3 1578 B11R2.4 C1C(C1N)C2=CC=CC=C2 T422413 [0,1,0,1,0,0|1,0,0]=3 1579 B11R2.40 C1CC1(C2=CC=CC=C2)N P589058 [0,1,0,1,0,0|1,0,0]=3 1580 B11R2.238 C1C(N1)CC2=CC=CC=C2 S304496 [0,1,0,1,0,0|1,0,0]=3 1581 B11R2.238 C1C(O1)CC2=CC=CC=C2 E472459 [0,1,0,1,0,0|1,0,0]=3 1582 B11R2.238 C1CC1SC2=CC=CC=C2 C101828 [0,1,0,1,0,0|1,0,0]=3 1583 B7R1.1 C1=C(N=CS1)CCl C137365 [1,0,0,0,1,0|2,0,0]=4 1584 B7R1.1 C1=CN(N=C1)CO H189712 [1,0,0,0,1,0|2,0,0]=4 1585 B7R1.1 C1=CN=C(N1)CN A168767 [1,0,0,0,1,0|2,0,0]=4 1586 B7R1.1 C1=COC(=C1)CN F111778 [1,0,0,0,1,0|2,0,0]=4 1587 B7R1.1 C1=COC(=C1)CN F493732 [1,0,0,0,1,0|2,0,0]=4 1588 B7R1.1 C1=COC(=C1)CO F110603 [1,0,0,0,1,0|2,0,0]=4 1589 B7R1.1 C1=COC(=C1)CO F110604 [1,0,0,0,1,0|2,0,0]=4 1590 B7R1.1 C1=COC(=C1)CS F102900 [1,0,0,0,1,0|2,0,0]=4 1591 B7R1.1 C1=COC=C1CO F122642 [1,0,0,0,1,0|2,0,0]=4 1592 B7R1.1 C1=CSC(=C1)CN T107120 [1,0,0,0,1,0|2,0,0]=4 1593 B7R1.1 C1=CSC(=C1)CO T162809 [1,0,0,0,1,0|2,0,0]=4 1594 B7R1.1 C1=CSC(=C1)CS T134394 [1,0,0,0,1,0|2,0,0]=4 1595 B7R1.1 C1=CSC(=N1)CO H157271 [1,0,0,0,1,0|2,0,0]=4 1596 B7R1.1 C1=CSC=C1CBr B192902 [1,0,0,0,1,0|2,0,0]=4 1597 B7R1.1 C1=CSC=C1CN T123094 [1,0,0,0,1,0|2,0,0]=4 1598 B7R1.1 C1=CSC=C1CN T189819 [1,0,0,0,1,0|2,0,0]=4 1599 B7R1.1 C1=CSC=C1CO T115329 [1,0,0,0,1,0|2,0,0]=4 1600 B7R1.1 CCC1=CC=CN1 E156214 [1,0,0,0,1,0|0,0,1]=3 1601 B7R1.1 CCC1=CC=CO1 E102538 [1,0,0,0,1,0|1,0,0]=3 1602 B7R1.1 CCC1=CC=CO1 E141264 [1,0,0,0,1,0|1,0,0]=3 1603 B7R1.1 CCC1=CC=CS1 E101589 [1,0,0,0,1,0|1,0,0]=3 1604 B7R1.1 CCC1=CC=C[CH-]1 D166828 [1,0,0,0,1,0|0,0,1]=3 1605 B7R1.1 CCC1=CN=CN1 E156331 [1,0,0,0,1,0|1,0,1]=4 1606 B7R1.1 CCC1=CNN=C1 E167848 [1,0,0,0,1,0|2,0,0]=4 1607 B7R1.1 CCC1=CSC=C1 E156073 [1,0,0,0,1,0|1,0,0]=3 1608 B7R1.1 CCC1=NC=CN1 E137989 [1,0,0,0,1,0|1,0,0]=3 1609 B7R1.1 CCC1=[C-]CC=C1 B294778 [1,0,0,0,1,0|0,0,2]=4 1610 B7R1.1 CCN1C=CC=C1 E156213 [1,0,0,0,1,0|1,0,0]=3 1611 B7R1.1 CCN1C=CC=N1 E156393 [1,0,0,0,1,0|1,0,0]=3 1612 B7R1.1 CCN1C=CN=C1 E139207 [1,0,0,0,1,0|2,0,0]=4 1613 B7R1.1 CCN1C=NC=N1 E587605 [1,0,0,0,1,0|2,0,0]=4 1614 B7R1.1 COC1=CC=CO1 M158540 [1,0,0,0,1,0|2,0,0]=4 1615 B7R1.1 COC1=CC=CS1 M103170 [1,0,0,0,1,0|2,0,0]=4 1616 B7R1.1 COC1=CSC=C1 M103169 [1,0,0,0,1,0|2,0,0]=4 1617 B7R1.1 COC1=NC=CS1 M158486 [1,0,0,0,1,0|2,0,0]=4 1618 B7R1.1 CSC1=CC=CS1 M123048 [1,0,0,0,1,0|2,0,0]=4 1619 B7R1.1 CSC1=NC=CS1 M158485 [1,0,0,0,1,0|2,0,0]=4