0 B7R0.4 CC(C)CCNC=O 104304 [0,0,0,0,0,0|1,0,0]=1 1 B7R0.4 CC(C)CCON=O 046832 [0,0,0,0,0,0|1,0,0]=1 2 B7R0.4 CC(C)CNCCN 104760 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.4 CC(C)OCCCN 520884 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.4 CCCCCC(C)O 235688 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.4 CCNCCN(C)C 402341 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.4 CN(C)CCCC#N 217818 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.4 CN(C)CCCCN 019580 [0,0,0,0,0,0|3,0,1]=4 8 B7R0.4 CNCCCN(C)C 065099 [0,0,0,0,0,0|4,0,0]=4 9 B7R0.4 CNCCNC(C)C 024580 [0,0,0,0,0,0|4,0,0]=4 10 B7R0.4 COCCNC(C)C 013931 [0,0,0,0,0,0|4,0,0]=4 11 B6R0.4 C=CCCC(C)=O 358446 [1,0,0,0,0,0|2,0,1]=4 12 B6R0.4 C=COCC(C)C 103137 [1,0,0,0,0,0|1,0,0]=2 13 B6R0.4 CC(Br)CCCBr 001096 [1,0,0,0,0,0|2,0,1]=4 14 B6R0.4 CC(C)CN=C=O 044447 [1,0,0,0,0,0|1,0,1]=3 15 B6R0.4 CC(C)CN=C=S 008985 [1,0,0,0,0,0|1,1,1]=4 16 B6R0.4 CC(C)CON=O 099090 [1,0,0,0,0,0|1,0,0]=2 17 B6R0.4 CC(C)NCCO 069257 [1,0,0,0,0,0|1,0,2]=4 18 B6R0.4 CC(C)OCCO 150900 [1,0,0,0,0,0|1,0,2]=4 19 B6R0.4 CC(O)CCCO 386330 [1,0,0,0,0,0|1,0,2]=4 20 B6R0.4 CCCCC(C)N 214315 [1,0,0,0,0,0|2,0,1]=4 21 B6R0.4 CCCCN(C)C 115800 [1,0,0,0,0,0|2,0,1]=4 22 B6R0.4 CCCC[C@@H](C)O 036116 [1,0,0,0,0,0|2,0,1]=4 23 B6R0.4 CN(C)CCC#N 044322 [1,0,0,0,0,0|2,0,1]=4 24 B6R0.4 CN(C)CCCBr 079586 [1,0,0,0,0,0|2,0,1]=4 25 B6R0.4 CN(C)CCCCl 240358 [1,0,0,0,0,0|2,0,1]=4 26 B6R0.4 CN(C)CCCN 094726 [1,0,0,0,0,0|2,0,1]=4 27 B6R0.4 CN(C)CCCO 242665 [1,0,0,0,0,0|1,0,2]=4 28 B6R0.4 CN(C)\C=C\C=O 044782 [1,0,0,0,0,0|1,0,2]=4 29 B6R0.4 CNCCC(C)C 321590 [1,0,0,0,0,0|1,0,1]=3 30 B6R0.4 CNCCN(C)C 236768 [1,0,0,0,0,0|2,0,1]=4 31 B6R0.4 O=CCCC(=O)O 103323 [1,0,0,0,0,0|2,0,1]=4 32 B6R0.6 C#CCCCCC 144400 [1,0,0,0,0,0|2,0,1]=4 33 B6R0.6 C=CCCCCBr 002415 [1,0,0,0,0,0|3,0,0]=4 34 B6R0.6 C=CCCCCBr 013446 [1,0,0,0,0,0|3,0,0]=4 35 B6R0.6 C=CCCCCCl 024635 [1,0,0,0,0,0|3,0,0]=4 36 B6R0.6 C=CCCCCI 103321 [1,0,0,0,0,0|3,0,0]=4 37 B6R0.6 C=CCCCCO 078461 [1,0,0,0,0,0|3,0,0]=4 38 B6R0.6 C=COCCCC 106580 [1,0,0,0,0,0|1,0,0]=2 39 B6R0.6 CCCCCC#N 002444 [1,0,0,0,0,0|2,0,1]=4 40 B6R0.6 CCCCCC=O 094968 [1,0,0,0,0,0|1,0,0]=2 41 B6R0.6 CCCCCCBr 098897 [1,0,0,0,0,0|2,0,1]=4 42 B6R0.6 CCCCCCC 044743 [1,0,0,0,0,0|2,0,1]=4 43 B6R0.6 CCCCCCC 099896 [1,0,0,0,0,0|2,0,1]=4 44 B6R0.6 CCCCCCC 107019 [1,0,0,0,0,0|2,0,1]=4 45 B6R0.6 CCCCCCC 995188 [1,0,0,0,0,0|2,0,1]=4 46 B6R0.6 CCCCCCN 094631 [1,0,0,0,0,0|2,0,1]=4 47 B6R0.6 CCCCCCO 349294 [1,0,0,0,0,0|1,0,2]=4 48 B6R0.6 CCCCCCS 145400 [1,0,0,0,0,0|1,1,1]=4 49 B6R0.6 CCCCCNC 056875 [1,0,0,0,0,0|3,0,0]=4 50 B6R0.6 CCCCN=C=O 102722 [1,0,0,0,0,0|1,0,1]=3 51 B6R0.6 CCCCN=C=S 008752 [1,0,0,0,0,0|1,1,1]=4 52 B6R0.6 CCCCNC=O 103559 [1,0,0,0,0,0|1,0,0]=2 53 B6R0.6 CCCCNCC 097790 [1,0,0,0,0,0|2,0,1]=4 54 B6R0.6 CCC\C=C\C=O 098868 [1,0,0,0,0,0|1,0,1]=3 55 B6R0.6 CCOCCCN 097753 [1,0,0,0,0,0|2,0,1]=4 56 B6R0.6 CCOCOCC 094651 [1,0,0,0,0,0|2,0,1]=4 57 B6R0.6 COCCN=C=O 044433 [1,0,0,0,0,0|2,0,1]=4 58 B6R0.6 C\C=C\CCCO 433438 [1,0,0,0,0,0|3,0,0]=4 59 B6R0.6 O=C=NCCCCl 013917 [1,0,0,0,0,0|2,0,1]=4 60 B6R0.6 O=CCCCCCl 238851 [1,0,0,0,0,0|2,0,0]=3 61 B8R0.5 CCOC(=O)CC(C)C 098989 [0,1,0,0,0,0|1,0,2]=4 62 B8R0.7 CN(C)CCOCCO 437714 [0,1,0,0,0,0|1,0,2]=4 63 B8R0.21 C[Si](C)(C)CCOCCl S03978 [0,1,0,0,0,0|1,1,1]=4 64 B8R0.28 CC(=O)CCC=C(C)C 242741 [0,1,0,0,0,0|1,0,2]=4 65 B8R0.28 CC(=O)CCCC(=O)O 208771 [0,1,0,0,0,0|2,0,1]=4 66 B8R0.28 CC(=O)CCCC(C)C 242651 [0,1,0,0,0,0|1,0,0]=2 67 B8R0.28 CC(=O)NCCC(C)C 341839 [0,1,0,0,0,0|1,0,0]=2 68 B8R0.28 CC(=O)OCC=C(C)C 241095 [0,1,0,0,0,0|0,0,2]=3 69 B8R0.28 CC(=O)OCCC(C)C 106519 [0,1,0,0,0,0|0,0,0]=1 70 B8R0.28 CC(C)CCCC(=O)O 002773 [0,1,0,0,0,0|1,0,0]=2 71 B8R0.28 CC(C)CCCC(C)N 097752 [0,1,0,0,0,0|2,0,1]=4 72 B8R0.28 CC(C)CCCC(C)N 101453 [0,1,0,0,0,0|2,0,1]=4 73 B8R0.28 CC(C)CCO[N+](=O)[O-] 341782 [0,1,0,0,0,0|1,0,0]=2 74 B8R0.28 CC(C)CSCC(=O)O 042364 [0,1,0,0,0,0|2,0,0]=3 75 B8R0.28 CN(C)CCCC(=O)O 236794 [0,1,0,0,0,0|2,0,0]=3 76 B8R0.28 CN(C)C\C=C\C(=O)O 062980 [0,1,0,0,0,0|2,0,1]=4 77 B8R0.28 CN(C)C\C=C\C(=O)O 078562 [0,1,0,0,0,0|2,0,1]=4 78 B8R1.4 O=C1CCCC(=O)C1 078597 [0,0,0,1,0,0|2,0,1]=4 79 B8R1.4 O=C1CCNC(=O)C1 044088 [0,0,0,1,0,0|2,0,1]=4 80 B8R1.19 CC1(C)CCOC1=O 432330 [0,0,0,1,0,0|0,0,0]=1 81 B8R1.72 CC1(C)CCNCC1 075595 [0,0,0,1,0,0|2,0,1]=4 82 B5R0.1 C#CCC(C)C 104535 [2,0,0,0,0,0|0,0,2]=4 83 B5R0.1 C=C(C)CCO 358461 [2,0,0,0,0,0|0,0,2]=4 84 B5R0.1 C=CCC(C)C 106337 [2,0,0,0,0,0|0,0,1]=3 85 B5R0.1 CC(=O)CCO 358442 [2,0,0,0,0,0|1,0,1]=4 86 B5R0.1 CC(Br)CCBr BR1240 [2,0,0,0,0,0|2,0,0]=4 87 B5R0.1 CC(C)=CC=O 386384 [2,0,0,0,0,0|0,0,2]=4 88 B5R0.1 CC(C)=CCO 358414 [2,0,0,0,0,0|0,0,2]=4 89 B5R0.1 CC(C)CC#N 386919 [2,0,0,0,0,0|1,0,1]=4 90 B5R0.1 CC(C)CC=O 094970 [2,0,0,0,0,0|0,0,0]=2 91 B5R0.1 CC(C)CCBr BR1353 [2,0,0,0,0,0|1,0,0]=3 92 B5R0.1 CC(C)CCI 046949 [2,0,0,0,0,0|1,0,0]=3 93 B5R0.1 CC(C)CCN 097749 [2,0,0,0,0,0|1,0,0]=3 94 B5R0.1 CC(C)CCO 097704 [2,0,0,0,0,0|0,0,0]=2 95 B5R0.1 CC(C)CCO 103352 [2,0,0,0,0,0|0,0,0]=2 96 B5R0.1 CC(C)CCS 358459 [2,0,0,0,0,0|0,1,0]=3 97 B5R0.1 CC(C)CNN 023508 [2,0,0,0,0,0|2,0,0]=4 98 B5R0.1 CC(C)NC=O 103706 [2,0,0,0,0,0|1,0,0]=3 99 B5R0.1 CC(O)CCO 099380 [2,0,0,0,0,0|1,0,0]=3 100 B5R0.1 CCCC(C)Br 024476 [2,0,0,0,0,0|1,0,1]=4 101 B5R0.1 CCCC(C)Br BR1101 [2,0,0,0,0,0|1,0,1]=4 102 B5R0.1 CCCC(C)C 098758 [2,0,0,0,0,0|0,0,1]=3 103 B5R0.1 CCCC(C)N 097754 [2,0,0,0,0,0|1,0,1]=4 104 B5R0.1 CCCC(C)O 099024 [2,0,0,0,0,0|1,0,1]=4 105 B5R0.1 CCCC(C)S 070734 [2,0,0,0,0,0|1,0,1]=4 106 B5R0.1 CCC[C@H](C)O 036089 [2,0,0,0,0,0|1,0,1]=4 107 B5R0.1 CCNC(C)C 057128 [2,0,0,0,0,0|1,0,1]=4 108 B5R0.1 CN(C)CCBr 077959 [2,0,0,0,0,0|2,0,0]=4 109 B5R0.1 CN(C)CCCl 077638 [2,0,0,0,0,0|2,0,0]=4 110 B5R0.1 CN(C)CCN 043851 [2,0,0,0,0,0|2,0,0]=4 111 B5R0.1 CN(C)CCO 044665 [2,0,0,0,0,0|1,0,0]=3 112 B5R0.1 CN(C)CCS 450419 [2,0,0,0,0,0|1,1,0]=4 113 B5R0.1 CNCC(C)C 047078 [2,0,0,0,0,0|1,0,1]=4 114 B5R0.1 COCC(C)N 402335 [2,0,0,0,0,0|1,0,1]=4 115 B5R0.1 COCC(C)O 093985 [2,0,0,0,0,0|1,0,1]=4 116 B5R0.1 COC[C@@H](C)N 079780 [2,0,0,0,0,0|1,0,1]=4 117 B5R0.1 COC[C@@H](C)O 036090 [2,0,0,0,0,0|1,0,1]=4 118 B5R0.1 C[C@@H](N)CCO 092790 [2,0,0,0,0,0|1,0,0]=3 119 B5R0.1 C[C@@H](O)CCO 041923 [2,0,0,0,0,0|1,0,0]=3 120 B5R0.1 C[C@H](N)CCO 092789 [2,0,0,0,0,0|1,0,0]=3 121 B5R0.1 C[C@H](O)CCO 041922 [2,0,0,0,0,0|1,0,0]=3 122 B5R0.2 C#CCCCC 098932 [2,0,0,0,0,0|1,0,1]=4 123 B5R0.2 C=CCCCBr 013455 [2,0,0,0,0,0|2,0,0]=4 124 B5R0.2 C=CCCCC 098845 [2,0,0,0,0,0|1,0,0]=3 125 B5R0.2 C=CCCCI 103315 [2,0,0,0,0,0|2,0,0]=4 126 B5R0.2 C=CCCCO 164000 [2,0,0,0,0,0|2,0,0]=4 127 B5R0.2 C=CCCNC 104185 [2,0,0,0,0,0|2,0,0]=4 128 B5R0.2 C=COCCO 463043 [2,0,0,0,0,0|2,0,0]=4 129 B5R0.2 CCCCC#N 386692 [2,0,0,0,0,0|1,0,1]=4 130 B5R0.2 CCCCC=O 094967 [2,0,0,0,0,0|0,0,0]=2 131 B5R0.2 CCCCC=O 106333 [2,0,0,0,0,0|0,0,0]=2 132 B5R0.2 CCCCCBr 098930 [2,0,0,0,0,0|1,0,1]=4 133 B5R0.2 CCCCCC 094916 [2,0,0,0,0,0|1,0,1]=4 134 B5R0.2 CCCCCC 099897 [2,0,0,0,0,0|1,0,1]=4 135 B5R0.2 CCCCCC 102229 [2,0,0,0,0,0|1,0,1]=4 136 B5R0.2 CCCCCC 102412 [2,0,0,0,0,0|1,0,1]=4 137 B5R0.2 CCCCCI 349297 [2,0,0,0,0,0|1,0,1]=4 138 B5R0.2 CCCCCN 099587 [2,0,0,0,0,0|1,0,1]=4 139 B5R0.2 CCCCCO 101568 [2,0,0,0,0,0|0,0,2]=4 140 B5R0.2 CCCCNC 098817 [2,0,0,0,0,0|1,0,1]=4 141 B5R0.2 CCCCNN 324841 [2,0,0,0,0,0|2,0,0]=4 142 B5R0.2 CCCC[Zn]Br 213843 [2,0,0,0,0,0|2,0,0]=4 143 B5R0.2 CC\C=C\C=O 466581 [2,0,0,0,0,0|0,0,2]=4 144 B5R0.2 CNCCOC 011340 [2,0,0,0,0,0|1,0,1]=4 145 B5R0.2 COCCCBr 043598 [2,0,0,0,0,0|1,0,1]=4 146 B5R0.2 COCCCN 242837 [2,0,0,0,0,0|1,0,1]=4 147 B5R0.2 COCCCO 078666 [2,0,0,0,0,0|1,0,1]=4 148 B5R0.2 COCCOC 098861 [2,0,0,0,0,0|1,0,1]=4 149 B5R0.2 COCCOC 106693 [2,0,0,0,0,0|1,0,1]=4 150 B5R0.2 CSCCC=O 103329 [2,0,0,0,0,0|1,0,0]=3 151 B5R0.2 [C-]#[N+]CCCC 021027 [2,0,0,0,0,0|1,0,1]=4 152 B7R0.2 CC(C)C[C@H](N)CO M03441 [1,1,0,0,0,0|0,0,2]=4 153 B7R0.2 COC(=O)CC(C)C 046834 [1,1,0,0,0,0|0,0,2]=4 154 B7R0.3 CC(CN)CCCN 098814 [1,1,0,0,0,0|1,0,1]=4 155 B7R0.6 CC(=O)CCC(=O)O 079484 [1,1,0,0,0,0|1,0,1]=4 156 B7R0.6 CC(=O)CCC(C)=O 494125 [1,1,0,0,0,0|1,0,1]=4 157 B7R0.6 CC(=O)CCC(C)C 106440 [1,1,0,0,0,0|0,0,0]=2 158 B7R0.6 CC(=O)CCN(C)C 043224 [1,1,0,0,0,0|1,0,0]=3 159 B7R0.6 CC(=O)NCC(C)C 103683 [1,1,0,0,0,0|1,0,0]=3 160 B7R0.6 CC(=O)OCC(C)C 095004 [1,1,0,0,0,0|0,0,0]=2 161 B7R0.6 CC(C)COC(=O)Cl 046752 [1,1,0,0,0,0|0,0,0]=2 162 B7R0.6 CC(C)SCC(=O)O 311009 [1,1,0,0,0,0|1,0,0]=3 163 B7R0.6 CC(C)\C=C\C(=O)O 011183 [1,1,0,0,0,0|0,0,2]=4 164 B7R0.6 CN(C)CCC(=O)O 046799 [1,1,0,0,0,0|1,0,0]=3 165 B7R0.8 C=CCNC(C)(C)C 102065 [1,1,0,0,0,0|2,0,0]=4 166 B7R0.8 CNCCC(C)(C)C 104302 [1,1,0,0,0,0|1,0,1]=4 167 B7R0.8 O=COCC(F)(F)F 037821 [1,1,0,0,0,0|2,0,0]=4 168 B7R0.1 C=CCCCCCBr 043892 [1,1,0,0,0,0|2,0,0]=4 169 B7R0.1 C=CCCCCCC 200048 [1,1,0,0,0,0|2,0,0]=4 170 B7R0.1 C=CCCCCCI 103485 [1,1,0,0,0,0|2,0,0]=4 171 B7R0.1 C=CCCCCNC 036092 [1,1,0,0,0,0|2,0,0]=4 172 B7R0.1 CCCCCCC=O 520883 [1,1,0,0,0,0|1,0,0]=3 173 B7R0.1 CCCCOCCO 349293 [1,1,0,0,0,0|0,0,2]=4 174 B7R0.1 CCCC\C=C\C=O 240980 [1,1,0,0,0,0|1,0,0]=3 175 B7R0.1 CCOCCOCC 098939 [1,1,0,0,0,0|1,0,1]=4 176 B7R0.1 COCCCN=C=O 044446 [1,1,0,0,0,0|1,0,1]=4 177 B7R0.1 O=COCCOC=O 069885 [1,1,0,0,0,0|1,0,1]=4 178 B7R0.7 C=COC(=O)CCC 005032 [1,1,0,0,0,0|1,0,1]=4 179 B9R0.44 CC(CC=O)CC(C)(C)C 241564 [0,2,0,0,0,0|1,0,0]=3 180 B9R0.53 CC(=O)CC(=O)CC(C)C 156900 [0,2,0,0,0,0|1,0,1]=4 181 B9R0.53 CC(C)C[C@@H](N)CC(=O)O 040136 [0,2,0,0,0,0|1,0,0]=3 182 B9R0.53 CN(C)CC(O)OS(=O)O 378863 [0,2,0,0,0,0|2,0,0]=4 183 B9R0.1 CC(C)=CCCC(C)C=O 431186 [0,2,0,0,0,0|1,0,1]=4 184 B9R0.1 COC(=O)\C=C\CC(C)C 011191 [0,2,0,0,0,0|1,0,1]=4 185 B9R0.1 COC(C)CCOC(C)=O 208973 [0,2,0,0,0,0|0,0,0]=2 186 B9R0.56 CC(=O)OCC[Si](C)(C)Cl S00014 [0,2,0,0,0,0|0,1,0]=3 187 B9R0.56 C[N+](C)(C)CCCC(=O)O 241255 [0,2,0,0,0,0|2,0,0]=4 188 B7R1.2 CC1=CC(=O)CC1 078668 [1,0,0,1,0,0|0,0,2]=4 189 B7R1.2 CC1CCC(=O)N1 232918 [1,0,0,1,0,0|1,0,0]=3 190 B7R1.2 CC1CCC(=O)O1 243089 [1,0,0,1,0,0|1,0,0]=3 191 B7R1.2 CC1CCC(O)C1 013642 [1,0,0,1,0,0|0,0,2]=4 192 B7R1.2 CC1COC(=O)O1 044922 [1,0,0,1,0,0|1,0,0]=3 193 B7R1.2 C[C@@H]1COC(=O)O1 237778 [1,0,0,1,0,0|1,0,0]=3 194 B7R1.2 O=C1CCC(=O)C1 024257 [1,0,0,1,0,0|1,0,1]=4 195 B7R1.2 O=C1C[C@@H](O)CN1 047704 [1,0,0,1,0,0|2,0,0]=4 196 B7R1.2 O=C1C[C@H](O)CN1 093766 [1,0,0,1,0,0|2,0,0]=4 197 B7R1.2 O=C1OCC(F)O1 098380 [1,0,0,1,0,0|2,0,0]=4 198 B7R1.3 BrC1CCOCC1 077342 [1,0,0,1,0,0|1,0,1]=4 199 B7R1.3 CC1CCCCC1 013924 [1,0,0,1,0,0|1,0,1]=4 200 B7R1.3 CC1CCCNC1 095841 [1,0,0,1,0,0|1,0,1]=4 201 B7R1.3 CC1CCNCC1 005025 [1,0,0,1,0,0|1,0,1]=4 202 B7R1.3 CC1CCNCC1 106043 [1,0,0,1,0,0|1,0,1]=4 203 B7R1.3 CN1CCOCC1 043444 [1,0,0,1,0,0|1,0,1]=4 204 B7R1.3 CN1CCOCC1 104657 [1,0,0,1,0,0|1,0,1]=4 205 B7R1.3 IC1CCOCC1 067477 [1,0,0,1,0,0|1,0,1]=4 206 B7R1.3 NC1CCOCC1 023514 [1,0,0,1,0,0|1,0,1]=4 207 B7R1.3 NC1CCOCC1 043887 [1,0,0,1,0,0|1,0,1]=4 208 B7R1.3 OC1CCOCC1 068764 [1,0,0,1,0,0|1,0,1]=4 209 B7R1.7 O=C=NCC1CC1 214423 [1,0,0,1,0,0|1,0,1]=4 210 B7R1.14 CC1(C)COC=N1 094824 [1,0,0,1,0,0|1,0,0]=3 211 B7R1.14 CC1(C)COCN1 535769 [1,0,0,1,0,0|1,0,1]=4 212 B7R1.1 C(=O)N1CCCC1 341911 [1,0,0,1,0,0|1,0,0]=3 213 B7R1.4 CC1CCCC1=O 217631 [1,0,0,1,0,0|1,0,0]=3 214 B7R1.4 CC1CCOC1=O 092467 [1,0,0,1,0,0|0,0,0]=2 215 B7R1.4 CN1CCCC1=O 035918 [1,0,0,1,0,0|2,0,0]=4 216 B7R1.4 CN1CCCC1=O 041934 [1,0,0,1,0,0|2,0,0]=4 217 B7R1.4 CN1CCNC1=O 091683 [1,0,0,1,0,0|2,0,0]=4 218 B7R1.4 NC1CCNC1=O 047644 [1,0,0,1,0,0|2,0,0]=4 219 B7R1.4 NC1CCOC1=O 432676 [1,0,0,1,0,0|1,0,0]=3 220 B7R1.4 N[C@H]1CCOC1=O 078519 [1,0,0,1,0,0|1,0,0]=3 221 B7R1.4 O=C1NCCC1O 093757 [1,0,0,1,0,0|2,0,0]=4 222 B9R1.34 CC1CC(=O)CC(=O)C1 011195 [0,1,0,1,0,0|1,0,1]=4 223 B9R1.34 CC1CC(=O)OC(=O)C1 358400 [0,1,0,1,0,0|0,0,1]=3 224 B9R1.34 CN1CC(=O)OC(=O)C1 245515 [0,1,0,1,0,0|1,0,1]=4 225 B9R1.38 CC1(C)CC(=O)OC1=O 002557 [0,1,0,1,0,0|0,0,1]=3 226 B9R1.41 CC(=O)C1CCOC1=O 462873 [0,1,0,1,0,0|1,0,1]=4 227 B9R1.41 CC(C)N1CCNC1=O 063013 [0,1,0,1,0,0|1,0,0]=3 228 B9R1.66 CC1(C)CC(=O)CCO1 043695 [0,1,0,1,0,0|2,0,0]=4 229 B9R1.49 CN1CCCC(=O)CC1 069080 [0,1,0,1,0,0|2,0,0]=4 230 B9R1.40 CC1(C)CCCCC1=O 049771 [0,1,0,1,0,0|1,0,0]=3 231 B9R1.85 O=C(O)CSCC1CC1 311042 [0,1,0,1,0,0|2,0,0]=4 232 B9R1.35 CC(C)[C@@H]1COC(=O)N1 092262 [0,1,0,1,0,0|0,0,0]=2 233 B9R1.35 CC(C)[C@H]1COC(=O)N1 208760 [0,1,0,1,0,0|0,0,0]=2 234 B9R1.69 CC1CCC(=O)CC1C 474237 [0,1,0,1,0,0|1,0,0]=3 235 B9R1.10 CC1(C)C=CC(=O)CC1 013544 [0,1,0,1,0,0|2,0,0]=4 236 B9R1.133 CC1(C)OC[C@H](C=O)O1 038227 [0,1,0,1,0,0|2,0,0]=4 237 B9R2.39 O=C1CC2CCC1C2 463393 [0,0,0,2,0,0|1,0,0]=3 238 B9R2.109 O=C1CCCC2OC12 329460 [0,0,0,2,0,0|2,0,0]=4