0 B8R0.1 CC=CC(=O)OCC=C A168419 [0,0,0,0,0,0|1,0,2]=3 1 B8R0.1 CCC#CC(=O)OCC E189158 [0,0,0,0,0,0|1,0,3]=4 2 B8R0.1 CCCC(=O)OCCC P100043 [0,0,0,0,0,0|1,0,2]=3 3 B8R0.1 CCCC(=O)OCCC P100044 [0,0,0,0,0,0|1,0,2]=3 4 B8R0.1 CCCCC(=O)C=CC O160046 [0,0,0,0,0,0|0,0,0]=0 5 B8R0.1 CCCCC(=O)CCC O160045 [0,0,0,0,0,0|0,0,2]=2 6 B8R0.1 CCCCC(=O)OCC E105293 [0,0,0,0,0,0|1,0,1]=2 7 B8R0.1 CCCCC(=O)OCC E105294 [0,0,0,0,0,0|1,0,1]=2 8 B8R0.1 CCCCC(=O)OCC E118465 [0,0,0,0,0,0|1,0,1]=2 9 B8R0.1 CCCCC(CCC)O O159906 [0,0,0,0,0,0|0,0,4]=4 10 B8R0.1 CCCOC(=O)CC#N P160480 [0,0,0,0,0,0|2,0,2]=4 11 B8R0.1 CCOC(=O)CCC=C E156151 [0,0,0,0,0,0|1,0,3]=4 12 B8R0.1 CCOC(=O)CCCBr E106908 [0,0,0,0,0,0|2,0,1]=3 13 B8R0.1 CCOC(=O)CCCBr E639064 [0,0,0,0,0,0|2,0,1]=3 14 B8R0.1 CCOC(=O)CCCCl E135072 [0,0,0,0,0,0|2,0,1]=3 15 B8R0.1 CCOC(=O)CCCCl E493598 [0,0,0,0,0,0|2,0,1]=3 16 B8R0.1 CCOC(=O)CCCN E122453 [0,0,0,0,0,0|2,0,1]=3 17 B8R0.1 CCOC(=O)CCC[CH2-] E465916 [0,0,0,0,0,0|1,0,2]=3 18 B8R0.1 CCOC(=O)CCSC E107629 [0,0,0,0,0,0|2,0,1]=3 19 B8R0.1 CCOCC(=O)OCC E195171 [0,0,0,0,0,0|2,0,1]=3 20 B7R0.1 CCC=CC=CC=O H102914 [1,0,0,0,0,0|1,0,2]=4 21 B7R0.1 CCC=CCCC=O C154040 [1,0,0,0,0,0|1,0,2]=4 22 B7R0.1 CCC=CCCCO C153484 [1,0,0,0,0,0|1,0,1]=3 23 B7R0.1 CCCC=CCCC C153585 [1,0,0,0,0,0|0,0,3]=4 24 B7R0.1 CCCC=CCCC T161815 [1,0,0,0,0,0|0,0,3]=4 25 B7R0.1 CCCCC=CC=O T161484 [1,0,0,0,0,0|1,0,0]=2 26 B7R0.1 CCCCC=CCC C153584 [1,0,0,0,0,0|0,0,1]=2 27 B7R0.1 CCCCC=CCC T161817 [1,0,0,0,0,0|0,0,1]=2 28 B7R0.1 CCCCC=CCO T161435 [1,0,0,0,0,0|1,0,1]=3 29 B7R0.1 CCCCCC=CC C153583 [1,0,0,0,0,0|0,0,1]=2 30 B7R0.1 CCCCCC=CC O159996 [1,0,0,0,0,0|0,0,1]=2 31 B7R0.1 CCCCCC=CC T161814 [1,0,0,0,0,0|0,0,1]=2 32 B7R0.1 CCCCCCC=C O108659 [1,0,0,0,0,0|0,0,3]=4 33 B7R0.1 CCCCCCC=C O108660 [1,0,0,0,0,0|0,0,3]=4 34 B7R0.1 CCCCCCC=O H105934 [1,0,0,0,0,0|1,0,2]=4 35 B7R0.1 CCCCCCC=O H105935 [1,0,0,0,0,0|1,0,2]=4 36 B7R0.1 CCCCCCCC O100577 [1,0,0,0,0,0|0,0,3]=4 37 B7R0.1 CCCCCCCC O100578 [1,0,0,0,0,0|0,0,3]=4 38 B7R0.1 CCCCCCCC O100580 [1,0,0,0,0,0|0,0,3]=4 39 B7R0.1 CCCCCCCC O100581 [1,0,0,0,0,0|0,0,3]=4 40 B7R0.1 CCCCCCCC O119714 [1,0,0,0,0,0|0,0,3]=4 41 B7R0.1 CCCCCCNC N341547 [1,0,0,0,0,0|1,0,2]=4 42 B7R0.1 CCCCCCOC H157292 [1,0,0,0,0,0|1,0,2]=4 43 B7R0.1 CCCCCOC=O A151451 [1,0,0,0,0,0|2,0,1]=4 44 B7R0.1 CCCCOCC=C A151096 [1,0,0,0,0,0|1,0,2]=4 45 B7R0.3 C(CC(=O)NN)CO B301222 [1,0,0,0,0,0|3,0,0]=4 46 B7R0.3 C=CC(=O)NCCO N159040 [1,0,0,0,0,0|2,0,0]=3 47 B7R0.3 C=CC(=O)OCC#C P472190 [1,0,0,0,0,0|1,0,2]=4 48 B7R0.3 C=CC(=O)OCCCl C477272 [1,0,0,0,0,0|2,0,0]=3 49 B7R0.3 C=CC(=O)OCCO H104535 [1,0,0,0,0,0|2,0,0]=3 50 B7R0.3 C=CCOC(=O)C=C A151727 [1,0,0,0,0,0|1,0,2]=4 51 B7R0.3 CCC(=O)NCCO N158966 [1,0,0,0,0,0|2,0,1]=4 52 B7R0.3 CCCCC(=C)CC E156236 [1,0,0,0,0,0|1,0,1]=3 53 B7R0.3 CCCCC(=O)CC H103766 [1,0,0,0,0,0|0,0,1]=2 54 B7R0.3 CCCCC(=O)NN P135113 [1,0,0,0,0,0|2,0,0]=3 55 B7R0.3 CCCCC(=O)OC M108213 [1,0,0,0,0,0|1,0,0]=2 56 B7R0.3 CCCCC(=O)OC M108214 [1,0,0,0,0,0|1,0,0]=2 57 B7R0.3 CCCCC(C)CC M113650 [1,0,0,0,0,0|1,0,2]=4 58 B7R0.3 CCCCC(C=C)O H589251 [1,0,0,0,0,0|0,0,2]=3 59 B7R0.3 CCCCC(CC)Br B152441 [1,0,0,0,0,0|1,0,2]=4 60 B7R0.3 CCCCC(CC)O H156872 [1,0,0,0,0,0|0,0,3]=4 61 B7R0.3 CCCNC(=O)C=C N404954 [1,0,0,0,0,0|1,0,0]=2 62 B7R0.3 CCCOC(=O)CC P111531 [1,0,0,0,0,0|1,0,1]=3 63 B7R0.3 CCCOC(=O)CC P111532 [1,0,0,0,0,0|1,0,1]=3 64 B7R0.3 COC(=O)CCC#N M135512 [1,0,0,0,0,0|2,0,1]=4 65 B7R0.3 COC(=O)CCC#N M293045 [1,0,0,0,0,0|2,0,1]=4 66 B7R0.3 COC(=O)CCC=C M338666 [1,0,0,0,0,0|1,0,2]=4 67 B7R0.3 COC(=O)CCCBr M158832 [1,0,0,0,0,0|2,0,0]=3 68 B7R0.3 COC(=O)CCCBr M492178 [1,0,0,0,0,0|2,0,0]=3 69 B7R0.3 COC(=O)CCCCl C108118 [1,0,0,0,0,0|2,0,0]=3 70 B7R0.3 COC(=O)CCCI M167258 [1,0,0,0,0,0|2,0,0]=3 71 B7R0.3 COC(=O)CCCN M124081 [1,0,0,0,0,0|2,0,0]=3 72 B7R0.3 COC(=O)CCSC M302466 [1,0,0,0,0,0|2,0,0]=3 73 B7R0.3 COCCC(=O)OC M134953 [1,0,0,0,0,0|2,0,0]=3 74 B7R0.7 CC=CC(=O)OC=C V162948 [1,0,0,0,0,0|1,0,2]=4 75 B7R0.7 CCCC(=O)CCC H103840 [1,0,0,0,0,0|0,0,2]=3 76 B7R0.7 CCCC(=O)CCC H103841 [1,0,0,0,0,0|0,0,2]=3 77 B7R0.7 CCCC(=O)OC=C V162944 [1,0,0,0,0,0|1,0,1]=3 78 B7R0.7 CCCC(=O)OCC E101116 [1,0,0,0,0,0|1,0,1]=3 79 B7R0.7 CCCC(=O)OCC E101117 [1,0,0,0,0,0|1,0,1]=3 80 B7R0.7 CCCC(=O)OCC E101119 [1,0,0,0,0,0|1,0,1]=3 81 B7R0.7 CCCC(=O)OCCl C153957 [1,0,0,0,0,0|2,0,1]=4 82 B7R0.7 CCNC(=O)NCC D108032 [1,0,0,0,0,0|2,0,1]=4 83 B7R0.7 CCOC(=O)C#CC E106247 [1,0,0,0,0,0|1,0,2]=4 84 B7R0.7 CCOC(=O)C=CC E156252 [1,0,0,0,0,0|1,0,0]=2 85 B7R0.7 CCOC(=O)C=C[O-] E176875 [1,0,0,0,0,0|2,0,0]=3 86 B7R0.7 CCOC(=O)C=[N+]=[N-] E100922 [1,0,0,0,0,0|3,0,0]=4 87 B7R0.7 CCOC(=O)CC=C E587504 [1,0,0,0,0,0|1,0,2]=4 88 B7R0.7 CCOC(=O)CCBr E106956 [1,0,0,0,0,0|2,0,1]=4 89 B7R0.7 CCOC(=O)CCCl E100652 [1,0,0,0,0,0|2,0,1]=4 90 B7R0.7 CCOC(=O)CCI E185756 [1,0,0,0,0,0|2,0,1]=4 91 B7R0.7 CCOC(=O)CCN A100434 [1,0,0,0,0,0|2,0,1]=4 92 B7R0.7 CCOC(=O)CCO E185621 [1,0,0,0,0,0|2,0,1]=4 93 B7R0.7 CCOC(=O)CCS E119585 [1,0,0,0,0,0|2,0,1]=4 94 B7R0.7 CCOC(=O)CC[CH2-] E465885 [1,0,0,0,0,0|1,0,2]=4 95 B7R0.7 CCOC(=O)CNC E115901 [1,0,0,0,0,0|2,0,1]=4 96 B7R0.7 CCOC(=O)COC E136304 [1,0,0,0,0,0|2,0,1]=4 97 B7R0.7 CCOC(=O)CSC E156475 [1,0,0,0,0,0|2,0,1]=4 98 B7R0.7 CCOC(=O)OCC D103040 [1,0,0,0,0,0|2,0,1]=4 99 B9R0.4 CCCOC(=O)CC(=O)C P160059 [0,1,0,0,0,0|1,0,1]=3 100 B9R0.4 CCCOC(=O)CC(C)C D303979 [0,1,0,0,0,0|1,0,2]=4 101 B9R0.5 CCC=CCC(=O)OCC E117700 [0,1,0,0,0,0|1,0,2]=4 102 B9R0.5 CCCC=CC(=O)OCC E117526 [0,1,0,0,0,0|1,0,2]=4 103 B9R0.5 CCCCCC(=O)CCC N158991 [0,1,0,0,0,0|0,0,2]=3 104 B9R0.5 CCCCCC(=O)OC=C V162949 [0,1,0,0,0,0|1,0,1]=3 105 B9R0.5 CCCCCC(=O)OCC E103497 [0,1,0,0,0,0|1,0,1]=3 106 B9R0.5 CCCCCC(=O)OCC E103498 [0,1,0,0,0,0|1,0,1]=3 107 B9R0.5 CCCCCC(=O)OCC E103499 [0,1,0,0,0,0|1,0,1]=3 108 B9R0.5 CCCCOC(=O)C=CC B152883 [0,1,0,0,0,0|0,0,0]=1 109 B9R0.5 CCCCOC(=O)C=CC B293404 [0,1,0,0,0,0|0,0,0]=1 110 B9R0.5 CCCCOC(=O)CC#N B133488 [0,1,0,0,0,0|1,0,2]=4 111 B9R0.5 CCCCOC(=O)CCC B103463 [0,1,0,0,0,0|0,0,2]=3 112 B9R0.5 CCCCOC(=O)CCC B103464 [0,1,0,0,0,0|0,0,2]=3 113 B9R0.5 CCCCOC(=O)CCS B340486 [0,1,0,0,0,0|1,0,2]=4 114 B9R0.5 CCOC(=O)CCCCBr E156150 [0,1,0,0,0,0|1,0,1]=3 115 B9R0.5 CCOC(=O)CCCCN E183506 [0,1,0,0,0,0|1,0,1]=3 116 B9R0.5 CCOC(=O)COCCCl E305168 [0,1,0,0,0,0|2,0,1]=4 117 B9R0.5 CCOCCC(=O)OCC E108066 [0,1,0,0,0,0|1,0,1]=3 118 B9R0.8 CCCCC(C(=O)OC)Br M111380 [0,1,0,0,0,0|2,0,1]=4 119 B9R0.8 CCCCC(C(=O)OC)N D134849 [0,1,0,0,0,0|2,0,1]=4 120 B9R0.8 CCCOC(=O)C(C)CC P160535 [0,1,0,0,0,0|1,0,2]=4 121 B9R0.18 C(CC(=O)CCCCl)CCl D193277 [0,1,0,0,0,0|1,0,2]=4 122 B9R0.18 CCCCC(=O)CCCC N102321 [0,1,0,0,0,0|0,0,2]=3 123 B9R0.18 CCCCS(=O)CCCC D155298 [0,1,0,0,0,0|1,0,2]=4 124 B9R0.18 CCCC[Sn](=O)CCCC D112984 [0,1,0,0,0,0|1,0,2]=4 125 B9R0.18 CCCOC(=O)OCCC D107452 [0,1,0,0,0,0|1,0,2]=4 126 B9R0.34 CCC(=O)CC(=O)OCC E122416 [0,1,0,0,0,0|1,0,2]=4 127 B9R0.34 CCC(C)CC(=O)OCC E117866 [0,1,0,0,0,0|1,0,1]=3 128 B9R0.34 CCC(C)OC(=O)C=CC S161086 [0,1,0,0,0,0|1,0,0]=2 129 B9R0.34 CCCC(=O)OC(C)CC S161087 [0,1,0,0,0,0|1,0,2]=4 130 B9R0.34 CCOC(=O)CC(CCl)O C108078 [0,1,0,0,0,0|2,0,1]=4 131 B9R0.34 CCOC(=O)CC(CCl)O C108079 [0,1,0,0,0,0|2,0,1]=4 132 B9R0.35 CCCC(C(=O)CCC)O H101582 [0,1,0,0,0,0|0,0,2]=3 133 B9R0.35 CCCC(C(=O)OCC)Br E139089 [0,1,0,0,0,0|1,0,1]=3 134 B9R0.35 CCCC(C(=O)OCC)N L135831 [0,1,0,0,0,0|1,0,1]=3 135 B9R0.35 CCCC(C)C(=O)OCC E110162 [0,1,0,0,0,0|1,0,1]=3 136 B9R0.48 CC=CC(=O)OCC(C)C I157503 [0,1,0,0,0,0|1,0,0]=2 137 B9R0.48 CCCC(=O)OCC(C)C I157497 [0,1,0,0,0,0|1,0,2]=4 138 B9R0.48 CCOC(=O)CCC(=O)C E117674 [0,1,0,0,0,0|1,0,2]=4 139 B9R0.48 CCOC(=O)CCC(C)C E169064 [0,1,0,0,0,0|1,0,1]=3 140 B9R1.12 CCCCC1=CC=CO1 B152372 [0,0,0,1,0,0|0,0,2]=3 141 B9R1.12 CCCCC1=CC=CS1 N189024 [0,0,0,1,0,0|0,1,1]=3 142 B9R1.12 CCCCC1=CSC=C1 B100752 [0,0,0,1,0,0|2,0,0]=3 143 B9R1.12 CCCCC1=NC=CN1 B152375 [0,0,0,1,0,0|2,0,1]=4 144 B9R1.12 CCCCN1C=CN=C1 B152373 [0,0,0,1,0,0|3,0,0]=4 145 B9R1.15 C1CCC(=O)C(C1)C#N O589158 [0,0,0,1,0,0|1,0,2]=4 146 B9R1.15 COC1CCCCC1=O M158813 [0,0,0,1,0,0|1,0,1]=3 147 B9R1.22 CCC1C(=O)NC(=O)N1 E156340 [0,0,0,1,0,0|3,0,0]=4 148 B9R1.27 CCC1=C(CNC1=O)C E135294 [0,0,0,1,0,0|1,0,2]=4 149 B9R1.48 C1CCC(=O)CC(=O)C1 W134267 [0,0,0,1,0,0|1,0,1]=3 150 B9R1.48 C1CCC(=O)OC(=O)C1 O588008 [0,0,0,1,0,0|2,0,0]=3 151 B9R1.49 CN1CCCC(=O)CC1 M587966 [0,0,0,1,0,0|1,0,2]=4 152 B9R1.50 C1CCCC(=O)CCC1 C106984 [0,0,0,1,0,0|0,0,2]=3 153 B9R1.50 C1CCCNC(=O)CC1 O159930 [0,0,0,1,0,0|1,0,1]=3 154 B9R1.69 C1CC(=O)NC(=O)C1Br B589701 [0,0,0,1,0,0|3,0,0]=4 155 B9R1.69 C1CC(=O)NC(=O)C1N A175882 [0,0,0,1,0,0|3,0,0]=4 156 B9R1.69 C1CC(=O)NC(=O)C1N A303287 [0,0,0,1,0,0|3,0,0]=4 157 B9R1.69 C1CC(=O)NC(=O)C1N A588312 [0,0,0,1,0,0|3,0,0]=4 158 B9R1.69 C1CC(=O)NC(=O)C1N S588414 [0,0,0,1,0,0|3,0,0]=4 159 B9R1.69 CC1CCC(=O)CC1C D154364 [0,0,0,1,0,0|0,0,2]=3 160 B9R1.69 CC1CNC(=O)NC1=O D304423 [0,0,0,1,0,0|3,0,0]=4 161 B9R1.69 CC1CNC(=O)NC1=O D425573 [0,0,0,1,0,0|3,0,0]=4 162 B9R1.73 CCOC(=O)C1CCC1 E124243 [0,0,0,1,0,0|1,0,1]=3 163 B9R1.73 CCOC(=O)C1CNC1 E176414 [0,0,0,1,0,0|2,0,1]=4 164 B9R1.75 CCOC(=O)CC1CC1 E176712 [0,0,0,1,0,0|1,0,1]=3 165 B6R0.6 C=CCCCCBr B122541 [2,0,0,0,0,0|1,0,1]=4 166 B6R0.6 C=CCCCCCl C115790 [2,0,0,0,0,0|1,0,1]=4 167 B6R0.6 C=CCCCCO H113637 [2,0,0,0,0,0|1,0,1]=4 168 B6R0.6 CC=CC=CCO I167855 [2,0,0,0,0,0|1,0,1]=4 169 B6R0.6 CC=CC=CCO T470463 [2,0,0,0,0,0|1,0,1]=4 170 B6R0.6 CC=CCCCO H300983 [2,0,0,0,0,0|1,0,0]=3 171 B6R0.6 CCC=CCCO C426965 [2,0,0,0,0,0|1,0,1]=4 172 B6R0.6 CCC=CCCO H112690 [2,0,0,0,0,0|1,0,1]=4 173 B6R0.6 CCC=CCCO L106205 [2,0,0,0,0,0|1,0,1]=4 174 B6R0.6 CCCC=CC=O H107633 [2,0,0,0,0,0|1,0,0]=3 175 B6R0.6 CCCC=CC=O T425385 [2,0,0,0,0,0|1,0,0]=3 176 B6R0.6 CCCC=CCO C153482 [2,0,0,0,0,0|1,0,1]=4 177 B6R0.6 CCCC=CCO H102077 [2,0,0,0,0,0|1,0,1]=4 178 B6R0.6 CCCCCC=C H110653 [2,0,0,0,0,0|0,0,1]=3 179 B6R0.6 CCCCCC=C H110654 [2,0,0,0,0,0|0,0,1]=3 180 B6R0.6 CCCCCC=C H110655 [2,0,0,0,0,0|0,0,1]=3 181 B6R0.6 CCCCCC=O C109199 [2,0,0,0,0,0|1,0,1]=4 182 B6R0.6 CCCCCC=O C109200 [2,0,0,0,0,0|1,0,1]=4 183 B6R0.6 CCCCCCC H108102 [2,0,0,0,0,0|0,0,2]=4 184 B6R0.6 CCCCCCC H108103 [2,0,0,0,0,0|0,0,2]=4 185 B6R0.6 CCCCCCC H108105 [2,0,0,0,0,0|0,0,2]=4 186 B6R0.6 CCCCCCC H108108 [2,0,0,0,0,0|0,0,2]=4 187 B6R0.6 CCCCCCC H108111 [2,0,0,0,0,0|0,0,2]=4 188 B6R0.6 CCCCCCC H108112 [2,0,0,0,0,0|0,0,2]=4 189 B6R0.6 CCCCCCC H118382 [2,0,0,0,0,0|0,0,2]=4 190 B6R0.6 CCCCCCC H119701 [2,0,0,0,0,0|0,0,2]=4 191 B6R0.6 CCCCCNC M124210 [2,0,0,0,0,0|1,0,1]=4 192 B6R0.6 CCCCCSC A151354 [2,0,0,0,0,0|1,0,1]=4 193 B6R0.6 CCCCNCC N158928 [2,0,0,0,0,0|1,0,1]=4 194 B6R0.6 CCCCOC=C B123186 [2,0,0,0,0,0|1,0,0]=3 195 B6R0.6 CCCCOC=C B123187 [2,0,0,0,0,0|1,0,0]=3 196 B6R0.6 CCCCOC=O B109260 [2,0,0,0,0,0|2,0,0]=4 197 B6R0.6 CCCCOC=O B109261 [2,0,0,0,0,0|2,0,0]=4 198 B6R0.6 CCCCSCC B152507 [2,0,0,0,0,0|1,0,1]=4 199 B6R0.6 CCCSCC=C A135608 [2,0,0,0,0,0|1,0,1]=4 200 B6R0.1 C=CC(=O)NCO M108949 [2,0,0,0,0,0|2,0,0]=4 201 B6R0.1 C=CC(=O)NCO N492407 [2,0,0,0,0,0|2,0,0]=4 202 B6R0.1 CC=CC(=O)OC M109486 [2,0,0,0,0,0|1,0,0]=3 203 B6R0.1 CCC(=O)C=CC E404567 [2,0,0,0,0,0|0,0,0]=2 204 B6R0.1 CCC(=O)C=CC H111425 [2,0,0,0,0,0|0,0,0]=2 205 B6R0.1 CCC(=O)OC=C V162937 [2,0,0,0,0,0|1,0,1]=4 206 B6R0.1 CCC(=O)OCC E103457 [2,0,0,0,0,0|1,0,1]=4 207 B6R0.1 CCC(=O)OCC E103458 [2,0,0,0,0,0|1,0,1]=4 208 B6R0.1 CCC(=O)OCC E103459 [2,0,0,0,0,0|1,0,1]=4 209 B6R0.1 CCC(=O)OCC E103460 [2,0,0,0,0,0|1,0,1]=4 210 B6R0.1 CCC(=O)OCC E278958 [2,0,0,0,0,0|1,0,1]=4 211 B6R0.1 CCC(=O)SCC S133123 [2,0,0,0,0,0|1,0,1]=4 212 B6R0.1 CCCC(=O)CC H106710 [2,0,0,0,0,0|0,0,1]=3 213 B6R0.1 CCCC(=O)NN B183968 [2,0,0,0,0,0|2,0,0]=4 214 B6R0.1 CCCC(=O)OC M100038 [2,0,0,0,0,0|1,0,0]=3 215 B6R0.1 CCCC(=O)OC M100039 [2,0,0,0,0,0|1,0,0]=3 216 B6R0.1 CCCC(=O)OC M100040 [2,0,0,0,0,0|1,0,0]=3 217 B6R0.1 CCCC(=O)SC M102997 [2,0,0,0,0,0|1,0,0]=3 218 B6R0.1 CCCC(C=C)O H157268 [2,0,0,0,0,0|0,0,2]=4 219 B6R0.1 CCNC(=O)C=C N136947 [2,0,0,0,0,0|1,0,0]=3 220 B6R0.1 CCOC(=O)C=C E112943 [2,0,0,0,0,0|1,0,0]=3 221 B6R0.1 CCOC(=O)C=C E112944 [2,0,0,0,0,0|1,0,0]=3 222 B6R0.1 CCOC(=O)C=C E112945 [2,0,0,0,0,0|1,0,0]=3 223 B6R0.1 CCOC(=O)C=C E465763 [2,0,0,0,0,0|1,0,0]=3 224 B6R0.1 CCOC(=O)C=O E106246 [2,0,0,0,0,0|2,0,0]=4 225 B6R0.1 CCOC(=O)OC E110111 [2,0,0,0,0,0|2,0,0]=4 226 B6R0.1 CCOC(=O)OC E433135 [2,0,0,0,0,0|2,0,0]=4 227 B6R0.1 COC(=O)C=CI E589680 [2,0,0,0,0,0|2,0,0]=4 228 B6R0.1 COC(=O)CCBr M158830 [2,0,0,0,0,0|2,0,0]=4 229 B6R0.1 COC(=O)CCN A104532 [2,0,0,0,0,0|2,0,0]=4 230 B6R0.1 COC(=O)CCO D304149 [2,0,0,0,0,0|2,0,0]=4 231 B6R0.1 COC(=O)CCS M107600 [2,0,0,0,0,0|2,0,0]=4 232 B6R0.1 COC(=O)CSC M120419 [2,0,0,0,0,0|2,0,0]=4 233 B6R0.1 COCC(=O)OC M106398 [2,0,0,0,0,0|2,0,0]=4 234 B6R0.4 C(CC(=O)Cl)CBr B102197 [2,0,0,0,0,0|2,0,0]=4 235 B6R0.4 C(CC(=O)Cl)CCl C109449 [2,0,0,0,0,0|2,0,0]=4 236 B6R0.4 C(CC(=O)N)CCl C168978 [2,0,0,0,0,0|2,0,0]=4 237 B6R0.4 C(CC(=O)O)CBr B106907 [2,0,0,0,0,0|2,0,0]=4 238 B6R0.4 C(CC(=O)O)CCl C134513 [2,0,0,0,0,0|2,0,0]=4 239 B6R0.4 C(CC(=O)O)CN A104200 [2,0,0,0,0,0|2,0,0]=4 240 B6R0.4 C(CC(=O)O)CN A293557 [2,0,0,0,0,0|2,0,0]=4 241 B6R0.4 C(CC(=O)O)CN A424756 [2,0,0,0,0,0|2,0,0]=4 242 B6R0.4 C(CC(=O)O)CN A468499 [2,0,0,0,0,0|2,0,0]=4 243 B6R0.4 C(CC(=O)O)CN A472038 [2,0,0,0,0,0|2,0,0]=4 244 B6R0.4 C(CC(=O)O)CN G276591 [2,0,0,0,0,0|2,0,0]=4 245 B6R0.4 CC(=O)CCC=C H113634 [2,0,0,0,0,0|0,0,2]=4 246 B6R0.4 CC(=O)CCCBr B345087 [2,0,0,0,0,0|1,0,0]=3 247 B6R0.4 CC(=O)CCCCl C108070 [2,0,0,0,0,0|1,0,0]=3 248 B6R0.4 CC(=O)CCSC M135087 [2,0,0,0,0,0|1,0,0]=3 249 B6R0.4 CC(=O)NCCN A117219 [2,0,0,0,0,0|2,0,0]=4 250 B6R0.4 CC(=O)NCCO A112970 [2,0,0,0,0,0|2,0,0]=4 251 B6R0.4 CC(=O)NCCO A112971 [2,0,0,0,0,0|2,0,0]=4 252 B6R0.4 CC(=O)NCCS N347842 [2,0,0,0,0,0|2,0,0]=4 253 B6R0.4 CC(=O)OCCBr B102635 [2,0,0,0,0,0|2,0,0]=4 254 B6R0.4 CC(=O)OCCCl A140396 [2,0,0,0,0,0|2,0,0]=4 255 B6R0.4 CC(=O)OCCN A588049 [2,0,0,0,0,0|2,0,0]=4 256 B6R0.4 CC(=O)OCCO H156959 [2,0,0,0,0,0|2,0,0]=4 257 B6R0.4 CC(=O)SCCN T340735 [2,0,0,0,0,0|2,0,0]=4 258 B6R0.4 CCCCC(=N)N D305243 [2,0,0,0,0,0|2,0,0]=4 259 B6R0.4 CCCCC(=O)Br V162931 [2,0,0,0,0,0|1,0,0]=3 260 B6R0.4 CCCCC(=O)C H105743 [2,0,0,0,0,0|0,0,0]=2 261 B6R0.4 CCCCC(=O)C H105744 [2,0,0,0,0,0|0,0,0]=2 262 B6R0.4 CCCCC(=O)C H111491 [2,0,0,0,0,0|0,0,0]=2 263 B6R0.4 CCCCC(=O)C H141140 [2,0,0,0,0,0|0,0,0]=2 264 B6R0.4 CCCCC(=O)Cl V107241 [2,0,0,0,0,0|1,0,0]=3 265 B6R0.4 CCCCC(=O)N V162967 [2,0,0,0,0,0|1,0,0]=3 266 B6R0.4 CCCCC(=O)O V108269 [2,0,0,0,0,0|1,0,0]=3 267 B6R0.4 CCCCC(=O)O V108270 [2,0,0,0,0,0|1,0,0]=3 268 B6R0.4 CCCCC(=O)O V108271 [2,0,0,0,0,0|1,0,0]=3 269 B6R0.4 CCCCC(=O)O V108272 [2,0,0,0,0,0|1,0,0]=3 270 B6R0.4 CCCCC(=O)O V302252 [2,0,0,0,0,0|1,0,0]=3 271 B6R0.4 CCCCC(=O)[O-] S194180 [2,0,0,0,0,0|1,0,0]=3 272 B6R0.4 CCCCC(C)C M158516 [2,0,0,0,0,0|1,0,1]=4 273 B6R0.4 CCCCC(C)Cl C153661 [2,0,0,0,0,0|1,0,1]=4 274 B6R0.4 CCCCC(C)N B301374 [2,0,0,0,0,0|1,0,1]=4 275 B6R0.4 CCCCC(C)O H105565 [2,0,0,0,0,0|0,0,2]=4 276 B6R0.4 CCCCC(C)O I170762 [2,0,0,0,0,0|0,0,2]=4 277 B6R0.4 CCCCC(C)O R588494 [2,0,0,0,0,0|0,0,2]=4 278 B6R0.4 CCCCN(C)C D108036 [2,0,0,0,0,0|2,0,0]=4 279 B6R0.4 CCCC[N+](=O)[O-] N300420 [2,0,0,0,0,0|2,0,0]=4 280 B6R0.4 CCCC[Sn](=O)O M107696 [2,0,0,0,0,0|2,0,0]=4 281 B6R0.4 CCCNC(=O)N P589707 [2,0,0,0,0,0|2,0,0]=4 282 B6R0.4 CCCOC(=O)C P103882 [2,0,0,0,0,0|1,0,0]=3 283 B6R0.4 CCCOC(=O)C P103883 [2,0,0,0,0,0|1,0,0]=3 284 B6R0.4 CCCOC(=O)N P194271 [2,0,0,0,0,0|2,0,0]=4 285 B6R0.4 CCCSC(=O)C S161333 [2,0,0,0,0,0|1,0,0]=3 286 B6R0.4 CCNCC(=O)O N159193 [2,0,0,0,0,0|2,0,0]=4 287 B6R0.4 CCOCC(=O)Cl E293992 [2,0,0,0,0,0|2,0,0]=4 288 B6R0.4 CCOCC(=O)O E156174 [2,0,0,0,0,0|2,0,0]=4 289 B6R0.4 CCSCC(=O)O E300419 [2,0,0,0,0,0|2,0,0]=4 290 B6R0.4 CNCCC(=O)O M183299 [2,0,0,0,0,0|2,0,0]=4 291 B6R0.4 COCCC(=O)O M169065 [2,0,0,0,0,0|2,0,0]=4 292 B6R0.4 CSCCC(=O)Cl M158416 [2,0,0,0,0,0|2,0,0]=4 293 B6R0.4 CSCCC(=O)O M158072 [2,0,0,0,0,0|2,0,0]=4 294 B8R0.4 CCC=CCCCCO C153379 [1,1,0,0,0,0|0,0,1]=3 295 B8R0.4 CCCCC=CCCO C153378 [1,1,0,0,0,0|0,0,1]=3 296 B8R0.4 CCCCCC=CC=O O105936 [1,1,0,0,0,0|1,0,0]=3 297 B8R0.4 CCCCCC=CC=O O303154 [1,1,0,0,0,0|1,0,0]=3 298 B8R0.4 CCCCCC=CCO T161811 [1,1,0,0,0,0|0,0,1]=3 299 B8R0.6 CCCC=CC(=O)OC M134288 [1,1,0,0,0,0|1,0,1]=4 300 B8R0.6 CCCCCC(=O)C=C O160047 [1,1,0,0,0,0|0,0,2]=4 301 B8R0.6 CCCCCC(=O)CC O106928 [1,1,0,0,0,0|0,0,2]=4 302 B8R0.6 CCCCCC(=O)CC O106929 [1,1,0,0,0,0|0,0,2]=4 303 B8R0.6 CCCCCC(=O)OC M112312 [1,1,0,0,0,0|1,0,1]=4 304 B8R0.6 CCCCCC(=O)OC M112313 [1,1,0,0,0,0|1,0,1]=4 305 B8R0.6 CCCCCC(=O)OC M112314 [1,1,0,0,0,0|1,0,1]=4 306 B8R0.6 CCCCNC(=O)C=C N405436 [1,1,0,0,0,0|1,0,1]=4 307 B8R0.6 CCCCOC(=O)C=C B100034 [1,1,0,0,0,0|1,0,1]=4 308 B8R0.6 CCCCOC(=O)C=C B100035 [1,1,0,0,0,0|1,0,1]=4 309 B8R0.6 CCCCOC(=O)C=C B100036 [1,1,0,0,0,0|1,0,1]=4 310 B8R0.6 CCCCOC(=O)C=C B100037 [1,1,0,0,0,0|1,0,1]=4 311 B8R0.6 CCCCOC(=O)CC B152863 [1,1,0,0,0,0|1,0,1]=4 312 B8R0.7 CCCCC=CC(=O)C O100829 [1,1,0,0,0,0|0,0,0]=2 313 B8R0.7 CCCCC=CC(=O)O H305279 [1,1,0,0,0,0|1,0,0]=3 314 B8R0.7 CCCCCCC(=O)C O111186 [1,1,0,0,0,0|0,0,2]=4 315 B8R0.7 CCCCCCC(=O)C O111187 [1,1,0,0,0,0|0,0,2]=4 316 B8R0.7 CCCCCOC(=O)C A103450 [1,1,0,0,0,0|1,0,1]=4 317 B8R0.7 CCCCCOC(=O)C A103451 [1,1,0,0,0,0|1,0,1]=4 318 B8R0.7 CCCCCOC(=O)C A103452 [1,1,0,0,0,0|1,0,1]=4 319 B8R0.3 CC(COC)C(=O)OC M157985 [1,1,0,0,0,0|2,0,0]=4 320 B8R0.3 CCCC(C(=O)NO)N B300173 [1,1,0,0,0,0|2,0,0]=4 321 B8R0.3 CCCC(C)C(=O)OC B300583 [1,1,0,0,0,0|1,0,0]=3 322 B8R0.3 COC(=O)C(CCBr)Br M588617 [1,1,0,0,0,0|2,0,0]=4 323 B8R0.8 CC(=C)C(=O)OCCBr B589157 [1,1,0,0,0,0|2,0,0]=4 324 B8R0.8 CC(=C)C(=O)OCCCl M140401 [1,1,0,0,0,0|2,0,0]=4 325 B8R0.8 CC(=C)C(=O)OCCN A168938 [1,1,0,0,0,0|2,0,0]=4 326 B8R0.8 CC(=C)C(=O)OCCO H103044 [1,1,0,0,0,0|2,0,0]=4 327 B8R0.8 CC(=C)C(=O)OCCO H140643 [1,1,0,0,0,0|2,0,0]=4 328 B8R0.8 CC(=C)C(=O)OCCO H140644 [1,1,0,0,0,0|2,0,0]=4 329 B8R0.8 CC(=C)C(=O)OCCO H303891 [1,1,0,0,0,0|2,0,0]=4 330 B8R0.8 CC(=C)C(=O)OCCO H434293 [1,1,0,0,0,0|2,0,0]=4 331 B8R0.8 CCCCC(=O)C(=O)C H106591 [1,1,0,0,0,0|0,0,0]=2 332 B8R0.8 CCCCC(=O)C(=O)[O-] K471800 [1,1,0,0,0,0|1,0,0]=3 333 B8R0.8 CCCCC(=O)C(C)C M158862 [1,1,0,0,0,0|0,0,1]=3 334 B8R0.8 CCCOC(=O)C(=C)C N338922 [1,1,0,0,0,0|1,0,0]=3 335 B8R0.8 CCCOC(=O)C(C)C P133971 [1,1,0,0,0,0|1,0,1]=4 336 B8R0.8 CCCOC(=O)C(C)O P160122 [1,1,0,0,0,0|1,0,1]=4 337 B8R0.8 CN(C)C(=O)CCOC M404748 [1,1,0,0,0,0|2,0,0]=4 338 B8R0.9 CC(=O)CCC(=O)OC M157990 [1,1,0,0,0,0|1,0,1]=4 339 B8R0.9 CC(=O)CCC(=O)OC N196982 [1,1,0,0,0,0|1,0,1]=4 340 B8R0.9 CC(C)CCC(=O)OC M464241 [1,1,0,0,0,0|1,0,0]=3 341 B8R0.9 CC(C)COC(=O)C=C I111441 [1,1,0,0,0,0|1,0,0]=3 342 B8R0.9 CC(COC(=O)C=C)O H100855 [1,1,0,0,0,0|1,0,0]=3 343 B8R0.9 CCC(=O)OCC(C)C I157498 [1,1,0,0,0,0|1,0,1]=4 344 B8R0.9 CN(C)CCC(=O)OC M170066 [1,1,0,0,0,0|2,0,0]=4 345 B8R0.11 CCCC=C(CC)C=O E156033 [1,1,0,0,0,0|0,0,2]=4 346 B8R0.11 CCCCC(CC)C=O E156034 [1,1,0,0,0,0|0,0,2]=4 347 B8R0.19 CCC(=O)CC(=O)CC H102410 [1,1,0,0,0,0|0,0,2]=4 348 B8R0.19 CCC(=O)CC(=O)OC M109572 [1,1,0,0,0,0|1,0,1]=4 349 B8R0.19 CCC(C)CC(=O)CC M158857 [1,1,0,0,0,0|0,0,1]=3 350 B8R0.19 CCC(CC(=O)OC)O M465384 [1,1,0,0,0,0|1,0,0]=3 351 B8R0.5 CCCC(=O)CC(C)C M158863 [1,1,0,0,0,0|0,0,2]=4 352 B8R0.5 CCCC(=O)OC(C)C I157502 [1,1,0,0,0,0|1,0,1]=4 353 B8R0.5 CCOC(=O)C=C(C)C E156154 [1,1,0,0,0,0|1,0,0]=3 354 B8R0.5 CCOC(=O)C=C(C)N E101139 [1,1,0,0,0,0|1,0,0]=3 355 B8R0.5 CCOC(=O)C=C(C)N E136853 [1,1,0,0,0,0|1,0,0]=3 356 B8R0.5 CCOC(=O)CC(=O)C E103937 [1,1,0,0,0,0|1,0,1]=4 357 B8R0.5 CCOC(=O)CC(=O)C E103939 [1,1,0,0,0,0|1,0,1]=4 358 B8R0.5 CCOC(=O)CC(=O)C E474098 [1,1,0,0,0,0|1,0,1]=4 359 B8R0.5 CCOC(=O)CC(C)C E108583 [1,1,0,0,0,0|1,0,1]=4 360 B8R0.5 CCOC(=O)CC(C)C E108585 [1,1,0,0,0,0|1,0,1]=4 361 B8R0.5 CCOC(=O)CC(C)N E170814 [1,1,0,0,0,0|1,0,1]=4 362 B8R0.5 CCOC(=O)CC(C)O E101452 [1,1,0,0,0,0|1,0,1]=4 363 B8R0.5 CCOC(=O)CC(C)O E118391 [1,1,0,0,0,0|1,0,1]=4 364 B8R0.5 CCOC(=O)CC(C)O E156467 [1,1,0,0,0,0|1,0,1]=4 365 B8R0.5 CCO\C(=C\C(=O)C)\[O-] A354450 [1,1,0,0,0,0|1,0,1]=4 366 B10R0.6 CC(=O)CC(=O)OCCOC M109789 [0,2,0,0,0,0|1,0,1]=4 367 B10R0.6 CCCCCC(=O)OC(C)C I340872 [0,2,0,0,0,0|1,0,1]=4 368 B10R0.6 CCCCOC(=O)CC(=O)C B152871 [0,2,0,0,0,0|0,0,1]=3 369 B10R0.6 CCCCOC(=O)CC(C)C B152732 [0,2,0,0,0,0|0,0,2]=4 370 B10R0.18 CCCCC(=O)CC(=O)OC M158508 [0,2,0,0,0,0|0,0,1]=3 371 B10R0.32 CCOC(=O)C(CC(C)C)N L100533 [0,2,0,0,0,0|1,0,1]=4 372 B10R0.32 CCOC(=O)C(CC(C)C)O E156251 [0,2,0,0,0,0|1,0,1]=4 373 B10R0.96 CC(C)COC(=O)CC(=O)C I107308 [0,2,0,0,0,0|1,0,1]=4 374 B10R0.1 CCCCCCC(=O)CCC D154230 [0,2,0,0,0,0|0,0,2]=4 375 B10R0.1 CCCCCCC(=O)OCC E100047 [0,2,0,0,0,0|1,0,1]=4 376 B10R0.1 CCCCCCC(=O)OCC E305454 [0,2,0,0,0,0|1,0,1]=4 377 B10R0.1 CCCCCOC(=O)CCC A111359 [0,2,0,0,0,0|0,0,2]=4 378 B10R0.1 CCOC(=O)CCCCC=C E341720 [0,2,0,0,0,0|1,0,1]=4 379 B10R0.1 CCOC(=O)CCCCC=O E588544 [0,2,0,0,0,0|1,0,1]=4 380 B10R0.1 CCOC(=O)CCCCCBr E156144 [0,2,0,0,0,0|1,0,1]=4 381 B10R0.1 CCOC(=O)CCCCCN E193000 [0,2,0,0,0,0|1,0,1]=4 382 B10R0.1 CCOC(=O)CCCCCO E156101 [0,2,0,0,0,0|1,0,1]=4 383 B10R0.1 CCOCCCC(=O)OCC E341712 [0,2,0,0,0,0|1,0,1]=4 384 B10R0.2 CCCC(=O)CC(=O)OCC E107545 [0,2,0,0,0,0|1,0,1]=4 385 B10R0.2 CCCC(CC(=O)OCC)O E117524 [0,2,0,0,0,0|1,0,1]=4 386 B10R0.3 CCCC(=O)OCCC(C)C I108580 [0,2,0,0,0,0|0,0,2]=4 387 B10R0.3 CCCC(=O)OCCC(C)C I108581 [0,2,0,0,0,0|0,0,2]=4 388 B10R0.3 CCOC(=O)CCCC(=O)C E138206 [0,2,0,0,0,0|1,0,1]=4 389 B10R0.19 CCCCC(C(=O)OCC)Br E117976 [0,2,0,0,0,0|1,0,1]=4 390 B10R0.19 CCOC(=O)C(CCSC)N S169307 [0,2,0,0,0,0|1,0,1]=4 391 B10R0.83 CCCCOC(=O)C(=C)C#N B304309 [0,2,0,0,0,0|1,0,1]=4 392 B10R0.83 CCCCOC(=O)C(C)CC N303009 [0,2,0,0,0,0|0,0,2]=4 393 B10R0.91 CCCCC(=O)OCCCC B112311 [0,2,0,0,0,0|0,0,2]=4 394 B10R0.91 CCCCC(=O)OCCCC B115773 [0,2,0,0,0,0|0,0,2]=4 395 B10R0.91 CCCCCC(=O)C=CC=O O274680 [0,2,0,0,0,0|0,0,1]=3 396 B10R0.91 CCCCCC(=O)OCC=C A109767 [0,2,0,0,0,0|0,0,2]=4 397 B10R0.91 CCCCCC(=O)OCCC P136440 [0,2,0,0,0,0|0,0,2]=4 398 B10R0.57 CC=C(C)C(=O)OCC(C)C I157560 [0,2,0,0,0,0|1,0,0]=3 399 B10R0.78 CCCCC(=O)OCC(C)C I302149 [0,2,0,0,0,0|0,0,2]=4 400 B10R0.78 CCCOC(=O)CCC(=O)C P404929 [0,2,0,0,0,0|1,0,1]=4 401 B10R0.109 CCOC(=O)CCC(C)(F)F E578725 [0,2,0,0,0,0|1,0,1]=4 402 B8R1.2 C#CC1=CCCCC1 E156239 [1,0,0,1,0,0|0,0,2]=4 403 B8R1.2 C1CC(CC=C1)CO C131788 [1,0,0,1,0,0|1,0,1]=4 404 B8R1.2 C1CCC(=CC1)C#N C153472 [1,0,0,1,0,0|1,0,1]=4 405 B8R1.2 C1CCC(=CC1)C=O C468613 [1,0,0,1,0,0|1,0,0]=3 406 B8R1.8 CCCC1=CC=CO1 P160277 [1,0,0,1,0,0|1,0,1]=4 407 B8R1.8 CCCC1=CC=CS1 P167542 [1,0,0,1,0,0|1,0,1]=4 408 B8R1.22 C1CCC(=O)C=CC1 C138031 [1,0,0,1,0,0|1,0,0]=3 409 B8R1.49 C1CCC=CC=CC1 C153570 [1,0,0,1,0,0|0,0,1]=3 410 B8R1.49 C1CCC=CC=CC1 C333998 [1,0,0,1,0,0|0,0,1]=3 411 B8R1.49 C1CCCC=CCC1 C100852 [1,0,0,1,0,0|0,0,1]=3 412 B8R1.49 C1CCCC=CCC1 C118535 [1,0,0,1,0,0|0,0,1]=3 413 B8R1.49 C1CCCC=CCC1 C129192 [1,0,0,1,0,0|0,0,1]=3 414 B8R1.49 C1CCCC=CCC1 C189232 [1,0,0,1,0,0|0,0,1]=3 415 B8R1.49 C1CCCC=CCC1 C294026 [1,0,0,1,0,0|0,0,1]=3 416 B8R1.1 CCC1CCC(=O)O1 C111339 [1,0,0,1,0,0|1,0,1]=4 417 B8R1.3 C1C(=O)C=CC(O1)O H192951 [1,0,0,1,0,0|2,0,0]=4 418 B8R1.3 C1CC(=O)CCC1N A194532 [1,0,0,1,0,0|1,0,1]=4 419 B8R1.3 C1CC(=O)CCC1O H190648 [1,0,0,1,0,0|1,0,1]=4 420 B8R1.3 C1CC(=O)NCC1O H191838 [1,0,0,1,0,0|2,0,0]=4 421 B8R1.3 CC1CCC(=O)CC1 M106719 [1,0,0,1,0,0|0,0,1]=3 422 B8R1.3 CC1CCC(=O)CC1 M113653 [1,0,0,1,0,0|0,0,1]=3 423 B8R1.3 CN1CCC(=O)CC1 N138232 [1,0,0,1,0,0|1,0,1]=4 424 B8R1.38 C1CC(C1)C(=O)NN C348580 [1,0,0,1,0,0|2,0,0]=4 425 B8R1.38 COC(=O)C1CNC1 A132584 [1,0,0,1,0,0|2,0,0]=4 426 B8R1.50 CC1=C(C(=O)CC1)Br B472647 [1,0,0,1,0,0|1,0,1]=4 427 B8R1.50 CC1=C(C(=O)CC1)O H139285 [1,0,0,1,0,0|1,0,1]=4 428 B8R1.50 CC1CCC(=O)C1=O M109224 [1,0,0,1,0,0|1,0,0]=3 429 B8R1.50 CC1CCC(=O)N1C D467310 [1,0,0,1,0,0|1,0,0]=3 430 B8R1.50 CN1C(CCC1=O)O H351403 [1,0,0,1,0,0|2,0,0]=4 431 B8R1.4 C1CC(=CC(=O)C1)N A136183 [1,0,0,1,0,0|1,0,0]=3 432 B8R1.4 C1CC(=O)CC(=O)C1 C106972 [1,0,0,1,0,0|1,0,1]=4 433 B8R1.4 C1CC(=O)NC(=O)C1 G156850 [1,0,0,1,0,0|2,0,0]=4 434 B8R1.4 C1CC(=O)OC(=O)C1 G111073 [1,0,0,1,0,0|2,0,0]=4 435 B8R1.4 C1CC(=O)OC(=O)C1 G111074 [1,0,0,1,0,0|2,0,0]=4 436 B8R1.4 CC1=CC(=O)CCC1 M104499 [1,0,0,1,0,0|0,0,0]=2 437 B8R1.4 CC1=CC(CCC1)O M168575 [1,0,0,1,0,0|0,0,2]=4 438 B8R1.4 CC1CCCC(=O)C1 M117710 [1,0,0,1,0,0|0,0,2]=4 439 B8R1.4 CC1CCCC(=O)C1 R472235 [1,0,0,1,0,0|0,0,2]=4 440 B8R1.4 CC1CCCC(=O)O1 D155361 [1,0,0,1,0,0|1,0,1]=4 441 B8R1.18 CC1CC(=O)OC1=O M102626 [1,0,0,1,0,0|2,0,0]=4 442 B8R1.37 CCOC(=O)C1CC1 E156138 [1,0,0,1,0,0|1,0,1]=4 443 B10R1.16 CCCCN1C=C[N+](=C1)C B101514 [0,1,0,1,0,0|2,0,0]=4 444 B10R1.16 CCCCN1C=C[N+](=C1)C B101517 [0,1,0,1,0,0|2,0,0]=4 445 B10R1.16 CCCCN1C=C[N+](=C1)C B102303 [0,1,0,1,0,0|2,0,0]=4 446 B10R1.16 CCCCN1C=C[N+](=C1)C B102304 [0,1,0,1,0,0|2,0,0]=4 447 B10R1.16 CCCCN1C=C[N+](=C1)C B102306 [0,1,0,1,0,0|2,0,0]=4 448 B10R1.16 CCCCN1C=C[N+](=C1)C B107644 [0,1,0,1,0,0|2,0,0]=4 449 B10R1.16 CCCCN1C=C[N+](=C1)C B107645 [0,1,0,1,0,0|2,0,0]=4 450 B10R1.16 CCCCN1C=C[N+](=C1)C B107646 [0,1,0,1,0,0|2,0,0]=4 451 B10R1.16 CCCCN1C=C[N+](=C1)C B110177 [0,1,0,1,0,0|2,0,0]=4 452 B10R1.16 CCCCN1C=C[N+](=C1)C B111364 [0,1,0,1,0,0|2,0,0]=4 453 B10R1.16 CCCCN1C=C[N+](=C1)C B121216 [0,1,0,1,0,0|2,0,0]=4 454 B10R1.16 CCCCN1C=C[N+](=C1)C B121227 [0,1,0,1,0,0|2,0,0]=4 455 B10R1.16 CCCCN1C=C[N+](=C1)C B138798 [0,1,0,1,0,0|2,0,0]=4 456 B10R1.16 CCCCN1C=C[N+](=C1)C B152281 [0,1,0,1,0,0|2,0,0]=4 457 B10R1.16 CCCCN1C=C[N+](=C1)C B169261 [0,1,0,1,0,0|2,0,0]=4 458 B10R1.16 CCCCN1C=C[N+](=C1)C B303897 [0,1,0,1,0,0|2,0,0]=4 459 B10R1.16 CCCCN1C=C[N+](=C1)C B304821 [0,1,0,1,0,0|2,0,0]=4 460 B10R1.16 CCCCN1C=C[N+](=C1)C B305181 [0,1,0,1,0,0|2,0,0]=4 461 B10R1.16 CCCCN1C=C[N+](=C1)C B305187 [0,1,0,1,0,0|2,0,0]=4 462 B10R1.16 CCCCN1C=C[N+](=C1)C B359327 [0,1,0,1,0,0|2,0,0]=4 463 B10R1.16 CCCCN1C=C[N+](=C1)C B359361 [0,1,0,1,0,0|2,0,0]=4 464 B10R1.16 CCCCN1C=C[N+](=C1)C B359377 [0,1,0,1,0,0|2,0,0]=4 465 B10R1.61 CC(=O)C1CCCCC1=O A151668 [0,1,0,1,0,0|0,0,1]=3 466 B10R1.130 CCCC1C(=O)NC(=O)N1 P160274 [0,1,0,1,0,0|2,0,0]=4 467 B10R1.130 CCOC1C(=CC(=O)O1)Br B588744 [0,1,0,1,0,0|2,0,0]=4 468 B10R1.10 CCCC1CCCC(=O)O1 O117516 [0,1,0,1,0,0|0,0,2]=4 469 B10R1.11 CCOC(=O)C1CCCN1 S161203 [0,1,0,1,0,0|1,0,1]=4 470 B10R1.19 C=CN1CCCCCC1=O N159777 [0,1,0,1,0,0|1,0,1]=4 471 B10R1.19 C=CN1CCCCCC1=O N299077 [0,1,0,1,0,0|1,0,1]=4 472 B10R1.21 CCCCCC1=CC=CO1 P103007 [0,1,0,1,0,0|0,0,2]=4 473 B10R1.21 CCCCCC1=CC=CS1 P160668 [0,1,0,1,0,0|0,1,1]=4 474 B10R1.29 CCCCC1=C(SC=C1)Br B152941 [0,1,0,1,0,0|2,0,0]=4 475 B10R1.29 CCCCN1CCCC1=O B124554 [0,1,0,1,0,0|0,0,2]=4 476 B10R1.78 C1CCCC(=O)NCCC1 O159932 [0,1,0,1,0,0|0,0,2]=4 477 B10R1.15 COC(=O)C1=CCCCC1 M168102 [0,1,0,1,0,0|2,0,0]=4 478 B10R1.34 CCC1C(=C(C(=O)O1)O)C E120045 [0,1,0,1,0,0|1,0,0]=3 479 B10R1.4 C=CCC1CCCCC1=O A151742 [0,1,0,1,0,0|0,0,2]=4 480 B10R1.4 CCCC1CCCCC1=O P160132 [0,1,0,1,0,0|0,0,2]=4 481 B10R1.17 CCCCC1=CC=CC=C1 B100020 [0,1,0,1,0,0|1,0,1]=4 482 B10R1.17 CCCCC1=CC=CC=C1 B100021 [0,1,0,1,0,0|1,0,1]=4 483 B10R1.17 CCCCC1=CC=CC=C1 B128171 [0,1,0,1,0,0|1,0,1]=4 484 B10R1.17 CCCCC1=CN=CC=C1 B115782 [0,1,0,1,0,0|1,0,1]=4 485 B10R1.187 CCCN1C(=O)C=CC1=O I168649 [0,1,0,1,0,0|1,0,1]=4 486 B10R1.475 CCC1(CC(=O)NC1=O)C E135302 [0,1,0,1,0,0|2,0,0]=4 487 B10R1.212 CCOC(=O)C(C1CC1)Br E172503 [0,1,0,1,0,0|1,0,1]=4 488 B10R1.401 CCOC(=O)C1(CCC1)Br E169805 [0,1,0,1,0,0|1,0,1]=4 489 B10R1.63 CC1(CCC(=O)CC1=O)C D154370 [0,1,0,1,0,0|1,0,1]=4 490 B10R1.63 CC1(CCC(=O)OC1=O)C D154430 [0,1,0,1,0,0|2,0,0]=4 491 B10R2.7 C1CCC2=C(C1)C=CN2 T167082 [0,0,0,2,0,0|1,0,1]=4 492 B10R2.7 C1CCC2=C(C1)C=NN2 T168817 [0,0,0,2,0,0|2,0,0]=4 493 B10R2.42 C1CC2C1C(=O)OC2=O O176508 [0,0,0,2,0,0|2,0,0]=4