0 B6R0.6 BrCCNCCBr NO11032 [0,0,0,0,0,0|3,0,0]=3 1 B6R0.6 C#CCCCC=C DY565911 [0,0,0,0,0,0|1,0,3]=4 2 B6R0.6 C#CCNCCBr DY540501 [0,0,0,0,0,0|2,0,2]=4 3 B6R0.6 C#CCOCCO DY457828 [0,0,0,0,0,0|1,1,2]=4 4 B6R0.6 C=CCCCCCl DY427568 [0,0,0,0,0,0|1,0,2]=3 5 B6R0.6 C=CCCCCO NO10397 [0,0,0,0,0,0|0,1,2]=3 6 B6R0.6 C=CCCC[Zn]Br DY121349 [0,0,0,0,0,0|2,0,2]=4 7 B6R0.6 CC#CCCCO DY580533 [0,0,0,0,0,0|0,1,2]=3 8 B6R0.6 CCCCON=O DY461106 [0,0,0,0,0,0|2,1,0]=3 9 B6R0.6 CCCCSCC DY740893 [0,0,0,0,0,0|2,0,0]=2 10 B6R0.6 CCCOCCO DY740785 [0,0,0,0,0,0|1,1,0]=2 11 B6R0.6 CNCCCCBr DY741283 [0,0,0,0,0,0|2,0,0]=2 12 B6R0.6 CNCCCCO DY554133 [0,0,0,0,0,0|1,1,0]=2 13 B6R0.6 COCCCCBr NO22933 [0,0,0,0,0,0|2,0,0]=2 14 B6R0.6 COCCCCO DY741295 [0,0,0,0,0,0|1,1,0]=2 15 B6R0.6 COCCCOC DY792147 [0,0,0,0,0,0|3,0,0]=3 16 B6R0.6 ClCCCCCBr DY559653 [0,0,0,0,0,0|2,0,0]=2 17 B6R0.6 ClCCNCCCl NO16038 [0,0,0,0,0,0|3,0,0]=3 18 B6R0.6 FCCCCCBr NO14708 [0,0,0,0,0,0|2,0,0]=2 19 B6R0.6 FCCCCCF DY822300 [0,0,0,0,0,0|2,0,0]=2 20 B6R0.6 N#CCCCCCl NO10359 [0,0,0,0,0,0|2,0,1]=3 21 B6R0.6 NCCCCCN NO19074 [0,0,0,0,0,0|2,0,0]=2 22 B6R0.6 NCCNCCN DY740695 [0,0,0,0,0,0|3,0,0]=3 23 B6R0.6 NCCNCCO DY506670 [0,0,0,0,0,0|2,1,0]=3 24 B6R0.6 O=CCCCC=O DY822316 [0,0,0,0,0,0|1,1,2]=4 25 B6R0.6 O=CCCCCBr DY510224 [0,0,0,0,0,0|1,1,1]=3 26 B6R0.6 OCCCCCCl NO14778 [0,0,0,0,0,0|1,1,0]=2 27 B6R0.6 OCCCCCF DY822292 [0,0,0,0,0,0|1,1,0]=2 28 B6R0.6 OCCCCCO NO20549 [0,0,0,0,0,0|1,1,0]=2 29 B6R0.6 OCCNCCCl DY544797 [0,0,0,0,0,0|2,1,0]=3 30 B5R0.2 C=CCCCBr DY460284 [1,0,0,0,0,0|1,0,2]=4 31 B5R0.2 CCC#CCC DY740797 [1,0,0,0,0,0|0,0,2]=3 32 B5R0.2 CCCCCBr NO20657 [1,0,0,0,0,0|1,0,0]=2 33 B5R0.2 CCCC[Mg]Cl DY567561 [1,0,0,0,0,0|2,0,0]=3 34 B5R0.2 CCOCCBr NO21396 [1,0,0,0,0,0|2,0,0]=3 35 B5R0.2 CC\C=C\CO DY527871 [1,0,0,0,0,0|0,1,2]=4 36 B5R0.2 CNCCC#N NO22369 [1,0,0,0,0,0|2,0,1]=4 37 B5R0.2 CNCCCO NO14200 [1,0,0,0,0,0|1,1,0]=3 38 B5R0.2 CNCCNC NO15116 [1,0,0,0,0,0|2,0,0]=3 39 B5R0.2 COCCC#N NO22345 [1,0,0,0,0,0|2,0,1]=4 40 B5R0.2 COCCCBr NO20649 [1,0,0,0,0,0|2,0,0]=3 41 B5R0.2 COCCCO NO20039 [1,0,0,0,0,0|1,1,0]=3 42 B5R0.2 COCCOC DY546591 [1,0,0,0,0,0|2,0,0]=3 43 B5R0.2 CSCCCO DY557199 [1,0,0,0,0,0|1,1,0]=3 44 B5R0.2 C\C=C\CCO DY799773 [1,0,0,0,0,0|0,1,2]=4 45 B5R0.2 FCCCCF DY822299 [1,0,0,0,0,0|2,0,0]=3 46 B5R0.2 N#CCCCN DY548775 [1,0,0,0,0,0|2,0,1]=4 47 B5R0.2 NCCCCBr NO14979 [1,0,0,0,0,0|2,0,0]=3 48 B5R0.2 NCCCCN NO19906 [1,0,0,0,0,0|2,0,0]=3 49 B5R0.2 OCCCCF DY822291 [1,0,0,0,0,0|1,1,0]=3 50 B7R0.1 BrCCCCCCBr NO20550 [0,1,0,0,0,0|1,0,0]=2 51 B7R0.1 C#CCCCCCC DY740767 [0,1,0,0,0,0|1,0,0]=2 52 B7R0.1 C#CCCCCCO NO10705 [0,1,0,0,0,0|0,1,1]=3 53 B7R0.1 C=CCCCCCBr NO19607 [0,1,0,0,0,0|1,0,1]=3 54 B7R0.1 CCCOCCCN DY740653 [0,1,0,0,0,0|1,0,0]=2 55 B7R0.1 COCCOCCBr DY559431 [0,1,0,0,0,0|2,0,0]=3 56 B7R0.1 COCCOCCCl DY740401 [0,1,0,0,0,0|2,0,0]=3 57 B7R0.1 ClCCCCCCI DY550149 [0,1,0,0,0,0|1,0,0]=2 58 B7R0.1 FCCCCCCF DY822301 [0,1,0,0,0,0|1,0,0]=2 59 B7R0.1 N#CCCSCCO DY791895 [0,1,0,0,0,0|1,1,1]=4 60 B7R0.1 NCCCCCCN DY740617 [0,1,0,0,0,0|1,0,0]=2 61 B7R0.1 NCCCNCCBr NO13982 [0,1,0,0,0,0|2,0,0]=3 62 B7R0.1 NCCSSCCN DY557499 [0,1,0,0,0,0|3,0,0]=4 63 B7R0.1 NCCSSCCN NO11190 [0,1,0,0,0,0|3,0,0]=4 64 B7R0.1 NCC[Se][Se]CCN DY435603 [0,1,0,0,0,0|3,0,0]=4 65 B7R0.1 OCCCCCCBr NO14335 [0,1,0,0,0,0|0,1,0]=2 66 B7R0.1 OCCCCCCF DY822293 [0,1,0,0,0,0|0,1,0]=2 67 B7R0.1 OCCOCCCCl DY740305 [0,1,0,0,0,0|1,1,0]=3 68 B7R0.1 SCCCCCCS DY741367 [0,1,0,0,0,0|0,0,0]=1 69 B7R0.3 C#CCC[C@H](N)CO DY516333 [0,1,0,0,0,0|0,1,2]=4 70 B7R0.3 CCCCC(O)CO DY567525 [0,1,0,0,0,0|0,1,0]=2 71 B7R0.3 CCCOC(C)CN DY605531 [0,1,0,0,0,0|2,0,0]=3 72 B7R0.3 CCN(C)CCCO DY604490 [0,1,0,0,0,0|1,1,0]=3 73 B7R0.3 NCC(Cl)CCCCl DY822547 [0,1,0,0,0,0|2,0,0]=3 74 B7R0.4 CC(=O)CCCCBr NO10627 [0,1,0,0,0,0|1,0,1]=3 75 B7R0.4 CC(C)OCCCN DY546693 [0,1,0,0,0,0|2,0,0]=3 76 B7R0.4 CC(O)COCCN DY560097 [0,1,0,0,0,0|2,0,0]=3 77 B7R0.4 CCCCCB(O)O NO22305 [0,1,0,0,0,0|1,1,0]=3 78 B7R0.4 CCCCCC(=O)Cl DY822275 [0,1,0,0,0,0|0,1,1]=3 79 B7R0.4 CCCCCC(C)O NO21570 [0,1,0,0,0,0|0,1,0]=2 80 B7R0.4 CCCOCC(=O)O DY425744 [0,1,0,0,0,0|1,1,1]=4 81 B7R0.4 CCCSCC(N)=O DY742801 [0,1,0,0,0,0|1,1,1]=4 82 B7R0.4 CN(C)CCCCCl DY551337 [0,1,0,0,0,0|2,0,0]=3 83 B7R0.4 CN(C)CCCCO NO22813 [0,1,0,0,0,0|1,1,0]=3 84 B7R0.4 CNCCCC(=O)O DY702793 [0,1,0,0,0,0|1,1,1]=4 85 B7R0.4 CNCCCN(C)C DY584479 [0,1,0,0,0,0|3,0,0]=4 86 B7R0.4 O=C(Cl)CCCCCl DY460464 [0,1,0,0,0,0|1,1,1]=4 87 B7R0.7 CCOC(=O)CCN NO14330 [0,1,0,0,0,0|2,0,1]=4 88 B7R0.7 COCC(N)COC NO21215 [0,1,0,0,0,0|3,0,0]=4 89 B7R0.7 O=C(CCCl)CCCl NO19912 [0,1,0,0,0,0|2,0,1]=4 90 B7R1.1 BrCC1CCCC1 DY20145 [0,0,0,1,0,0|1,0,0]=2 91 B7R1.1 BrCC1OCCO1 NO21401 [0,0,0,1,0,0|2,1,0]=4 92 B7R1.1 C#CC1CCCC1 DY822738 [0,0,0,1,0,0|1,0,1]=3 93 B7R1.1 C#CC1CCCO1 DY586043 [0,0,0,1,0,0|0,1,2]=4 94 B7R1.1 C#CC1CCOC1 DY103679 [0,0,0,1,0,0|2,0,1]=4 95 B7R1.1 CCC1CCCN1 DY738230 [0,0,0,1,0,0|1,0,0]=2 96 B7R1.1 CCC1CCNC1 DY585732 [0,0,0,1,0,0|2,0,0]=3 97 B7R1.1 CNC1CCCC1 DY757231 [0,0,0,1,0,0|2,0,0]=3 98 B7R1.1 CNC1CCOC1 DY579885 [0,0,0,1,0,0|3,0,0]=4 99 B7R1.1 CN[C@@H]1CCOC1 DY104966 [0,0,0,1,0,0|3,0,0]=4 100 B7R1.1 COC1=NCCC1 NO10423 [0,0,0,1,0,0|2,0,1]=4 101 B7R1.1 COC1CCCC1 DY459258 [0,0,0,1,0,0|2,0,0]=3 102 B7R1.1 COC1CCNC1 NO22350 [0,0,0,1,0,0|3,0,0]=4 103 B7R1.1 CO[C@@H]1CCNC1 NO12137 [0,0,0,1,0,0|3,0,0]=4 104 B7R1.1 CO[C@H]1CCNC1 DY510861 [0,0,0,1,0,0|3,0,0]=4 105 B7R1.1 CO[C@H]1CCNC1 NO12136 [0,0,0,1,0,0|3,0,0]=4 106 B7R1.1 FC[C@@H]1CCCN1 DY100102 [0,0,0,1,0,0|2,0,0]=3 107 B7R1.1 N#C[C@H]1CCNC1 DY508184 [0,0,0,1,0,0|2,0,1]=4 108 B7R1.1 NCC1CCCC1 NO14873 [0,0,0,1,0,0|1,0,0]=2 109 B7R1.1 NCC1CCCN1 NO15469 [0,0,0,1,0,0|2,0,0]=3 110 B7R1.1 NC[C@H]1CCCN1 NO15745 [0,0,0,1,0,0|2,0,0]=3 111 B7R1.1 NC[C@H]1CCOC1 DY102307 [0,0,0,1,0,0|2,0,0]=3 112 B7R1.1 NNC1CCCC1 DY543699 [0,0,0,1,0,0|2,0,0]=3 113 B7R1.1 O=CC1CCCC1 DY21048 [0,0,0,1,0,0|0,1,1]=3 114 B7R1.1 O=C[C@@H]1CCCN1 DY626191 [0,0,0,1,0,0|1,1,1]=4 115 B7R1.1 OCC1CC=CC1 NO20734 [0,0,0,1,0,0|0,1,2]=4 116 B7R1.1 OCC1CCCC1 NO11185 [0,0,0,1,0,0|0,1,0]=2 117 B7R1.1 OCC1CCCN1 DY556821 [0,0,0,1,0,0|1,1,0]=3 118 B7R1.1 OCC1CCCN1 DY668415 [0,0,0,1,0,0|1,1,0]=3 119 B7R1.1 OCC1CCCO1 DY20392 [0,0,0,1,0,0|1,1,0]=3 120 B7R1.1 OCC1CCNC1 NO11284 [0,0,0,1,0,0|1,1,0]=3 121 B7R1.1 OCC1CCNC1 NO16764 [0,0,0,1,0,0|1,1,0]=3 122 B7R1.1 OCC1CCNC1 NO18341 [0,0,0,1,0,0|1,1,0]=3 123 B7R1.1 OC[C@@H]1CCCN1 NO22640 [0,0,0,1,0,0|1,1,0]=3 124 B7R1.1 OC[C@@H]1CCNC1 DY115660 [0,0,0,1,0,0|1,1,0]=3 125 B7R1.1 OC[C@H]1CCCN1 NO17003 [0,0,0,1,0,0|1,1,0]=3 126 B7R1.1 OC[C@H]1CCCO1 DY542355 [0,0,0,1,0,0|1,1,0]=3 127 B7R1.3 BrC1CCCCC1 NO11079 [0,0,0,1,0,0|1,0,0]=2 128 B7R1.3 BrC1CCNCC1 NO18356 [0,0,0,1,0,0|2,0,0]=3 129 B7R1.3 BrC1CCOCC1 NO18193 [0,0,0,1,0,0|2,0,0]=3 130 B7R1.3 CC1C=CCCO1 DY560079 [0,0,0,1,0,0|0,1,2]=4 131 B7R1.3 CC1CCCCN1 DY20418 [0,0,0,1,0,0|1,0,0]=2 132 B7R1.3 CC1CNCCN1 NO13503 [0,0,0,1,0,0|2,0,0]=3 133 B7R1.3 CC1CNCCO1 NO21692 [0,0,0,1,0,0|1,1,0]=3 134 B7R1.3 CC1COCCN1 NO22371 [0,0,0,1,0,0|2,0,0]=3 135 B7R1.3 CN1CCNCC1 DY20458 [0,0,0,1,0,0|3,0,0]=4 136 B7R1.3 C[C@@H]1CCCNC1 NO16133 [0,0,0,1,0,0|2,0,0]=3 137 B7R1.3 C[C@@H]1CNCCN1 DY622137 [0,0,0,1,0,0|2,0,0]=3 138 B7R1.3 C[C@@H]1CNCCN1 NO17164 [0,0,0,1,0,0|2,0,0]=3 139 B7R1.3 C[C@@H]1CNCCO1 NO14521 [0,0,0,1,0,0|1,1,0]=3 140 B7R1.3 C[C@@H]1COCCN1 NO14856 [0,0,0,1,0,0|2,0,0]=3 141 B7R1.3 C[C@@H]1COCCN1 NO20285 [0,0,0,1,0,0|2,0,0]=3 142 B7R1.3 C[C@H]1CNCCN1 NO17167 [0,0,0,1,0,0|2,0,0]=3 143 B7R1.3 C[C@H]1CNCCO1 NO14515 [0,0,0,1,0,0|1,1,0]=3 144 B7R1.3 C[C@H]1CNCCO1 NO19299 [0,0,0,1,0,0|1,1,0]=3 145 B7R1.3 C[C@H]1COCCN1 DY20820 [0,0,0,1,0,0|2,0,0]=3 146 B7R1.3 C[C@H]1COCCN1 NO22413 [0,0,0,1,0,0|2,0,0]=3 147 B7R1.3 ClC1CCCOC1 DY586426 [0,0,0,1,0,0|2,0,0]=3 148 B7R1.3 FC1CCNCC1 NO22845 [0,0,0,1,0,0|2,0,0]=3 149 B7R1.3 IC1CCNCC1 DY638708 [0,0,0,1,0,0|2,0,0]=3 150 B7R1.3 IC1CCOCC1 NO18194 [0,0,0,1,0,0|2,0,0]=3 151 B7R1.3 NC1C=CCCC1 DY608404 [0,0,0,1,0,0|1,0,2]=4 152 B7R1.3 NC1CCCNC1 NO22655 [0,0,0,1,0,0|2,0,0]=3 153 B7R1.3 NC1CCOCC1 NO16997 [0,0,0,1,0,0|2,0,0]=3 154 B7R1.3 NC1CCSCC1 DY541371 [0,0,0,1,0,0|2,0,0]=3 155 B7R1.3 N[C@@H]1CCCNC1 NO17178 [0,0,0,1,0,0|2,0,0]=3 156 B7R1.3 N[C@@H]1CCCOC1 DY517515 [0,0,0,1,0,0|2,0,0]=3 157 B7R1.3 N[C@H]1CCCNC1 NO17182 [0,0,0,1,0,0|2,0,0]=3 158 B7R1.3 O=C1CCCCO1 NO11208 [0,0,0,1,0,0|1,1,1]=4 159 B7R1.3 O=C1CCCNC1 DY557319 [0,0,0,1,0,0|1,1,1]=4 160 B7R1.3 O=C1CCCNC1 NO17767 [0,0,0,1,0,0|1,1,1]=4 161 B7R1.3 O=C1CCOCC1 NO13380 [0,0,0,1,0,0|1,1,1]=4 162 B7R1.3 O=C1CCSCC1 NO18797 [0,0,0,1,0,0|1,1,1]=4 163 B7R1.3 O=S1CCCCC1 DY822282 [0,0,0,1,0,0|1,1,0]=3 164 B7R1.3 O=S1CCNCC1 DY570699 [0,0,0,1,0,0|2,1,0]=4 165 B7R1.3 OC1CCCNC1 NO22642 [0,0,0,1,0,0|1,1,0]=3 166 B7R1.3 OC1CCCOC1 NO17782 [0,0,0,1,0,0|1,1,0]=3 167 B7R1.3 OC1CCNCC1 NO22643 [0,0,0,1,0,0|1,1,0]=3 168 B7R1.3 OC1CCOCC1 NO13929 [0,0,0,1,0,0|1,1,0]=3 169 B7R1.3 OC1CCSCC1 NO12012 [0,0,0,1,0,0|1,1,0]=3 170 B7R1.3 O[C@@H]1CCCNC1 NO17016 [0,0,0,1,0,0|1,1,0]=3 171 B7R1.3 O[C@H]1CCCNC1 NO17020 [0,0,0,1,0,0|1,1,0]=3 172 B7R1.3 SC1CCOCC1 DY107026 [0,0,0,1,0,0|1,0,0]=2 173 B7R1.4 BrC1CCCC1Br DY585689 [0,0,0,1,0,0|2,0,0]=3 174 B7R1.4 CC1CCCC1O DY757267 [0,0,0,1,0,0|0,1,0]=2 175 B7R1.4 CC1CCOC1=O DY759320 [0,0,0,1,0,0|1,1,1]=4 176 B7R1.4 CC1OCCC1=O NO14135 [0,0,0,1,0,0|1,1,1]=4 177 B7R1.4 C[C@@H]1CCNC1=O DY546075 [0,0,0,1,0,0|1,1,1]=4 178 B7R1.4 C[C@H]1CCNC1=O DY560337 [0,0,0,1,0,0|1,1,1]=4 179 B7R1.4 NC1CCCC1O NO19404 [0,0,0,1,0,0|1,1,0]=3 180 B7R1.4 N[C@@H]1CCC[C@@H]1O NO18884 [0,0,0,1,0,0|1,1,0]=3 181 B7R1.4 N[C@@H]1CCC[C@H]1O DY567117 [0,0,0,1,0,0|1,1,0]=3 182 B7R1.4 N[C@@H]1CNC[C@H]1F DY585432 [0,0,0,1,0,0|3,0,0]=4 183 B7R1.4 N[C@@H]1COC[C@@H]1F DY539427 [0,0,0,1,0,0|3,0,0]=4 184 B7R1.4 N[C@@H]1COC[C@H]1N DY444023 [0,0,0,1,0,0|3,0,0]=4 185 B7R1.4 N[C@@H]1COC[C@H]1O DY105386 [0,0,0,1,0,0|2,1,0]=4 186 B7R1.4 N[C@@H]1CSC[C@H]1O DY559281 [0,0,0,1,0,0|2,1,0]=4 187 B7R1.4 N[C@H]1CCC[C@@H]1N DY620340 [0,0,0,1,0,0|2,0,0]=3 188 B7R1.4 N[C@H]1CCC[C@@H]1O NO15594 [0,0,0,1,0,0|1,1,0]=3 189 B7R1.4 N[C@H]1CCC[C@H]1O NO11147 [0,0,0,1,0,0|1,1,0]=3 190 B7R1.4 N[C@H]1COC[C@@H]1O DY586645 [0,0,0,1,0,0|2,1,0]=4 191 B7R1.4 O=C1CCCC1Cl DY567621 [0,0,0,1,0,0|1,1,1]=4 192 B7R1.4 O[C@@H]1CCC[C@H]1F DY518337 [0,0,0,1,0,0|1,1,0]=3 193 B7R1.4 O[C@@H]1CCC[C@H]1O DY557241 [0,0,0,1,0,0|1,1,0]=3 194 B7R1.4 O[C@@H]1CNC[C@@H]1F DY586649 [0,0,0,1,0,0|2,1,0]=4 195 B7R1.4 O[C@@H]1CNC[C@H]1F DY457961 [0,0,0,1,0,0|2,1,0]=4 196 B7R1.4 O[C@H]1CNC[C@@H]1O NO20186 [0,0,0,1,0,0|2,1,0]=4 197 B7R1.5 C=C1CC1CCO DY790953 [0,0,0,1,0,0|0,1,2]=4 198 B7R1.5 CC1CC1N=C=O DY121381 [0,0,0,1,0,0|1,1,1]=4 199 B7R1.5 C[C@@H]1C[C@@H]1CCO DY544215 [0,0,0,1,0,0|0,1,0]=2 200 B7R1.6 C=CCC1CNC1 DY586612 [0,0,0,1,0,0|2,0,1]=4 201 B7R1.6 CCOC1CNC1 DY577479 [0,0,0,1,0,0|3,0,0]=4 202 B7R1.6 OCCC1CCO1 DY551169 [0,0,0,1,0,0|1,1,0]=3 203 B7R1.7 CCCC[C@H]1CO1 DY822259 [0,0,0,1,0,0|0,1,0]=2 204 B7R1.7 CCNCC1CC1 DY606135 [0,0,0,1,0,0|2,0,0]=3 205 B7R1.7 CNCCC1CC1 DY758521 [0,0,0,1,0,0|2,0,0]=3 206 B7R1.7 N#CCCC1CC1 DY558495 [0,0,0,1,0,0|1,0,1]=3 207 B7R1.7 OCCC[C@@H]1CO1 DY536067 [0,0,0,1,0,0|1,1,0]=3 208 B7R1.7 S=C=NCC1CC1 DY796827 [0,0,0,1,0,0|1,0,2]=4 209 B7R1.8 CN1CCC1CN DY104666 [0,0,0,1,0,0|2,0,0]=3 210 B7R1.8 NCC1CCC1F DY528009 [0,0,0,1,0,0|2,0,0]=3 211 B7R1.9 C#C[C@@H]1C[C@H]1CO DY586040 [0,0,0,1,0,0|0,1,2]=4 212 B7R1.9 N#CC1CC1CO DY757663 [0,0,0,1,0,0|1,1,1]=4 213 B7R1.9 NCC1CC1CO DY528789 [0,0,0,1,0,0|1,1,0]=3 214 B7R1.9 OC[C@H]1C[C@H]1CO DY543213 [0,0,0,1,0,0|1,1,0]=3 215 B7R1.24 C1CNCCOC1 NO17007 [0,0,0,1,0,0|1,1,0]=3 216 B4R0.2 BrCCCBr DY459264 [2,0,0,0,0,0|2,0,0]=4 217 B4R0.2 CCCCBr DY460620 [2,0,0,0,0,0|1,0,0]=3 218 B4R0.2 CCNCC NO11240 [2,0,0,0,0,0|1,0,0]=3 219 B4R0.2 CNCCBr DY584482 [2,0,0,0,0,0|2,0,0]=4 220 B4R0.2 CNCCO NO20910 [2,0,0,0,0,0|1,1,0]=4 221 B4R0.2 COCCBr DY578823 [2,0,0,0,0,0|2,0,0]=4 222 B4R0.2 COCCN DY822486 [2,0,0,0,0,0|2,0,0]=4 223 B4R0.2 COCCO DY457570 [2,0,0,0,0,0|1,1,0]=4 224 B4R0.2 CSCSC DY528795 [2,0,0,0,0,0|2,0,0]=4 225 B4R0.2 FCCCF DY822298 [2,0,0,0,0,0|2,0,0]=4 226 B4R0.2 ICCCI DY564171 [2,0,0,0,0,0|2,0,0]=4 227 B4R0.2 NCCCBr NO22190 [2,0,0,0,0,0|2,0,0]=4 228 B4R0.2 OCCCF DY822290 [2,0,0,0,0,0|1,1,0]=4 229 B4R0.2 SCCCS DY740347 [2,0,0,0,0,0|1,0,0]=3 230 B4R0.2 [Li]CCCC DY790335 [2,0,0,0,0,0|1,0,0]=3 231 B6R0.1 CC(CN)CCN DY791871 [1,1,0,0,0,0|2,0,0]=4 232 B6R0.1 CCCC(C)CBr DY112368 [1,1,0,0,0,0|1,0,0]=3 233 B6R0.1 CCCC(O)CO NO20495 [1,1,0,0,0,0|0,1,0]=3 234 B6R0.1 CCOC(=O)CC DY460554 [1,1,0,0,0,0|1,0,1]=4 235 B6R0.1 NCCC(O)CO DY608108 [1,1,0,0,0,0|1,1,0]=4 236 B6R0.1 OC(CBr)CCBr DY740743 [1,1,0,0,0,0|2,0,0]=4 237 B6R0.4 CC(=O)CCCBr NO10305 [1,1,0,0,0,0|1,0,1]=4 238 B6R0.4 CC(=O)CCCCl NO10334 [1,1,0,0,0,0|1,0,1]=4 239 B6R0.4 CC(C)CCCBr DY740443 [1,1,0,0,0,0|1,0,0]=3 240 B6R0.4 CC(C)NCCN DY20461 [1,1,0,0,0,0|2,0,0]=4 241 B6R0.4 CCCCC(C)O DY740779 [1,1,0,0,0,0|0,0,0]=2 242 B6R0.4 CCCC[SiH](C)C DY500283 [1,1,0,0,0,0|0,1,0]=3 243 B6R0.4 CCNCC(C)C DY564723 [1,1,0,0,0,0|1,0,0]=3 244 B6R0.4 CN(C)CCCBr NO22184 [1,1,0,0,0,0|2,0,0]=4 245 B6R0.4 CN(C)CCCCl NO13505 [1,1,0,0,0,0|2,0,0]=4 246 B6R0.4 CN(C)CCCCl NO14943 [1,1,0,0,0,0|2,0,0]=4 247 B6R0.4 CNCCC(C)C DY543681 [1,1,0,0,0,0|1,0,0]=3 248 B6R0.4 CNCCC(C)C DY553713 [1,1,0,0,0,0|1,0,0]=3 249 B6R0.4 CNCCN(C)C NO11723 [1,1,0,0,0,0|2,0,0]=4 250 B6R0.4 CNCCN(C)C NO15131 [1,1,0,0,0,0|2,0,0]=4 251 B6R0.4 CSCCC(C)=O DY740809 [1,1,0,0,0,0|1,0,1]=4 252 B8R0.1 C#CCCC(=O)CCC DY822712 [0,2,0,0,0,0|1,0,1]=4 253 B8R0.1 CCOC(=O)CCCCl DY822383 [0,2,0,0,0,0|1,0,1]=4 254 B8R0.1 CCOC(=O)CCCO DY111642 [0,2,0,0,0,0|0,1,1]=4 255 B8R0.1 CN(CCO)CCCN DY795333 [0,2,0,0,0,0|1,1,0]=4 256 B8R0.4 C#CCCCCCCO NO10833 [0,2,0,0,0,0|0,1,0]=3 257 B8R0.4 C=CCCCCCCO DY740623 [0,2,0,0,0,0|0,1,0]=3 258 B8R0.4 CCCCCCCCN DY506682 [0,2,0,0,0,0|1,0,0]=3 259 B8R0.4 CCCCCCCCS DY741379 [0,2,0,0,0,0|0,0,0]=2 260 B8R0.4 CCCCNCCCC NO11229 [0,2,0,0,0,0|1,0,0]=3 261 B8R0.4 COCCOCCOC DY41925 [0,2,0,0,0,0|1,1,0]=4 262 B8R0.4 FCCCCCCCF DY822302 [0,2,0,0,0,0|1,0,0]=3 263 B8R0.4 N#CCCCCCC#N NO19974 [0,2,0,0,0,0|1,0,1]=4 264 B8R0.4 OCCCCCCCBr NO13415 [0,2,0,0,0,0|0,1,0]=3 265 B8R0.4 OCCCCCCCF DY822294 [0,2,0,0,0,0|0,1,0]=3 266 B8R0.4 OCCCNCCCO NO21826 [0,2,0,0,0,0|0,1,0]=3 267 B8R0.6 CCCCNC(=O)CCl NO11766 [0,2,0,0,0,0|1,0,1]=4 268 B8R0.7 CCCCCCC(=O)O DY822462 [0,2,0,0,0,0|0,1,0]=3 269 B8R0.7 CCCCCC[C@H](C)O DY626179 [0,2,0,0,0,0|0,1,0]=3 270 B8R0.7 CN(C)CCNCCO DY552351 [0,2,0,0,0,0|1,1,0]=4 271 B8R0.7 CN(C)CCOCCO DY531015 [0,2,0,0,0,0|1,1,0]=4 272 B8R0.7 CSCCCCC(=O)O DY112374 [0,2,0,0,0,0|0,1,1]=4 273 B8R0.7 NCCCCCC(=O)O NO13381 [0,2,0,0,0,0|0,1,1]=4 274 B8R0.7 O=C(O)CCCCCBr NO18405 [0,2,0,0,0,0|0,1,1]=4 275 B8R0.3 CCN(C)C(C)CCN DY604545 [0,2,0,0,0,0|2,0,0]=4 276 B8R0.8 CCCC[C@H](C)C(=O)O DY585471 [0,2,0,0,0,0|0,1,1]=4 277 B8R0.9 CC(C)NC[C@H](O)CO DY437814 [0,2,0,0,0,0|1,1,0]=4 278 B8R0.19 CCN(C)CC(C)CN DY604863 [0,2,0,0,0,0|2,0,0]=4 279 B8R0.19 CC[C@@H](O)C[C@H](O)CC DY571299 [0,2,0,0,0,0|1,0,0]=3 280 B8R0.21 CCCCCS(=O)(=O)[O-] DY445019 [0,2,0,0,0,0|1,1,0]=4 281 B8R0.21 CCCCCS(=O)(=O)[O-] DY445025 [0,2,0,0,0,0|1,1,0]=4 282 B8R0.21 CS(=O)(=O)CCCCN DY116558 [0,2,0,0,0,0|2,0,0]=4 283 B8R0.28 CC(C)CCCC(=O)O DY564243 [0,2,0,0,0,0|0,1,1]=4 284 B8R0.28 CC(C)CCCC(C)N DY822701 [0,2,0,0,0,0|1,0,0]=3 285 B8R0.28 CC(C)COCC(C)C DY740839 [0,2,0,0,0,0|2,0,0]=4 286 B8R0.30 CCNC(C)(C)CCO DY525453 [0,2,0,0,0,0|1,1,0]=4 287 B6R1.1 C1=CCSCC1 DY427366 [1,0,0,1,0,0|0,0,2]=4 288 B6R1.1 C1CCNCC1 DY822173 [1,0,0,1,0,0|1,0,0]=3 289 B6R1.1 C1CCNNC1 DY586554 [1,0,0,1,0,0|2,0,0]=4 290 B6R1.1 C1CCNNC1 NO17893 [1,0,0,1,0,0|2,0,0]=4 291 B6R1.1 C1CCSCC1 DY822278 [1,0,0,1,0,0|0,0,0]=2 292 B6R1.1 C1CNCOC1 DY524601 [1,0,0,1,0,0|1,1,0]=4 293 B6R1.1 C1COCCN1 DY20726 [1,0,0,1,0,0|1,1,0]=4 294 B6R1.1 C1COCOC1 DY822672 [1,0,0,1,0,0|1,1,0]=4 295 B6R1.1 C1CSCCN1 DY20759 [1,0,0,1,0,0|1,0,0]=3 296 B6R1.2 BrC1CCNC1 NO15742 [1,0,0,1,0,0|2,0,0]=4 297 B6R1.2 CC1=NCCC1 NO21664 [1,0,0,1,0,0|1,0,1]=4 298 B6R1.2 CC1CCCN1 NO21699 [1,0,0,1,0,0|1,0,0]=3 299 B6R1.2 CC1CCCN1 NO21700 [1,0,0,1,0,0|1,0,0]=3 300 B6R1.2 CC1CCCO1 DY20580 [1,0,0,1,0,0|0,1,0]=3 301 B6R1.2 CC1CCNC1 DY667237 [1,0,0,1,0,0|1,0,0]=3 302 B6R1.2 C[C@@H]1CCCN1 NO18299 [1,0,0,1,0,0|1,0,0]=3 303 B6R1.2 C[C@H]1CCCN1 NO18800 [1,0,0,1,0,0|1,0,0]=3 304 B6R1.2 C[C@H]1CCCN1 NO19735 [1,0,0,1,0,0|1,0,0]=3 305 B6R1.2 FC1CCNC1 NO12894 [1,0,0,1,0,0|2,0,0]=4 306 B6R1.2 F[C@H]1CCNC1 NO14870 [1,0,0,1,0,0|2,0,0]=4 307 B6R1.2 N=C1CCCS1 DY556065 [1,0,0,1,0,0|1,0,1]=4 308 B6R1.2 NC1CCNC1 DY572169 [1,0,0,1,0,0|2,0,0]=4 309 B6R1.2 NC1CCOC1 NO12010 [1,0,0,1,0,0|2,0,0]=4 310 B6R1.2 NN1CCCC1 DY564555 [1,0,0,1,0,0|2,0,0]=4 311 B6R1.2 N[C@@H]1CCOC1 DY623409 [1,0,0,1,0,0|2,0,0]=4 312 B6R1.2 N[C@@H]1CCOC1 NO13003 [1,0,0,1,0,0|2,0,0]=4 313 B6R1.2 N[C@H]1CCNC1 DY508670 [1,0,0,1,0,0|2,0,0]=4 314 B6R1.2 N[C@H]1CCOC1 DY626689 [1,0,0,1,0,0|2,0,0]=4 315 B6R1.2 N[C@H]1CCOC1 NO20366 [1,0,0,1,0,0|2,0,0]=4 316 B6R1.2 O=C1CCCC1 DY21085 [1,0,0,1,0,0|0,1,1]=4 317 B6R1.2 O[C@@H]1CCNC1 NO16635 [1,0,0,1,0,0|1,1,0]=4 318 B6R1.2 O[C@@H]1CCNC1 NO16650 [1,0,0,1,0,0|1,1,0]=4 319 B6R1.2 O[C@@H]1CCOC1 NO20284 [1,0,0,1,0,0|1,1,0]=4 320 B6R1.2 O[C@H]1CCNC1 NO21757 [1,0,0,1,0,0|1,1,0]=4 321 B6R1.2 SC1CCOC1 DY789441 [1,0,0,1,0,0|1,0,0]=3 322 B6R1.3 ICCC1CC1 DY549405 [1,0,0,1,0,0|1,0,0]=3 323 B6R1.3 N#CCC1CC1 DY433947 [1,0,0,1,0,0|1,0,1]=4 324 B6R1.3 NNCC1CC1 DY509474 [1,0,0,1,0,0|2,0,0]=4 325 B6R1.3 NNCC1CC1 DY586553 [1,0,0,1,0,0|2,0,0]=4 326 B6R1.3 OCCN1CC1 DY505047 [1,0,0,1,0,0|1,1,0]=4 327 B6R1.4 CC1OCC1N DY732961 [1,0,0,1,0,0|2,0,0]=4 328 B6R1.4 C[C@@H]1NC[C@H]1O DY519399 [1,0,0,1,0,0|1,1,0]=4 329 B6R1.4 C[C@@H]1OC[C@H]1O DY515625 [1,0,0,1,0,0|1,1,0]=4 330 B6R1.4 O[C@H]1CC[C@H]1O DY756385 [1,0,0,1,0,0|1,1,0]=4 331 B6R1.6 BrCC1CCC1 DY10470 [1,0,0,1,0,0|1,0,0]=3 332 B6R1.6 COC1CNC1 NO17370 [1,0,0,1,0,0|2,0,0]=4 333 B6R1.6 NCC1CCC1 DY554907 [1,0,0,1,0,0|1,0,0]=3 334 B6R1.6 NCC1CCC1 NO11178 [1,0,0,1,0,0|1,0,0]=3 335 B6R1.6 NCC1CCS1 DY585795 [1,0,0,1,0,0|1,0,0]=3 336 B6R1.6 NCC1CNC1 DY508838 [1,0,0,1,0,0|2,0,0]=4 337 B6R1.6 NCC1COC1 DY10517 [1,0,0,1,0,0|2,0,0]=4 338 B6R1.6 NNC1CCC1 DY527943 [1,0,0,1,0,0|2,0,0]=4 339 B6R1.6 OCC1CCO1 NO15009 [1,0,0,1,0,0|1,1,0]=4 340 B6R1.6 OCC1CNC1 NO12891 [1,0,0,1,0,0|1,1,0]=4 341 B6R1.6 OCC1COC1 NO14670 [1,0,0,1,0,0|1,1,0]=4 342 B6R1.6 OC[C@@H]1CCN1 NO15230 [1,0,0,1,0,0|1,1,0]=4 343 B6R1.8 COC1CC1N DY503985 [1,0,0,1,0,0|2,0,0]=4 344 B6R1.8 N[C@@H]1C[C@H]1CO DY757435 [1,0,0,1,0,0|1,1,0]=4 345 B6R1.8 OCC1C[C@@H]1F DY102848 [1,0,0,1,0,0|1,1,0]=4 346 B8R1.2 BrCC1CCCCC1 NO19887 [0,1,0,1,0,0|1,0,0]=3 347 B8R1.2 BrCC1CCNCC1 DY586644 [0,1,0,1,0,0|1,0,0]=3 348 B8R1.2 BrCC1CCOCC1 DY514587 [0,1,0,1,0,0|1,0,0]=3 349 B8R1.2 BrC[C@@H]1COCCO1 DY585231 [0,1,0,1,0,0|1,1,0]=4 350 B8R1.2 Br[Zn]C1CCCCC1 DY121343 [0,1,0,1,0,0|1,0,0]=3 351 B8R1.2 C#CC1CCCOC1 DY104582 [0,1,0,1,0,0|1,0,1]=4 352 B8R1.2 CCC1CCNCC1 DY602027 [0,1,0,1,0,0|1,0,0]=3 353 B8R1.2 CCC1CNCCO1 DY731791 [0,1,0,1,0,0|0,1,0]=3 354 B8R1.2 CCN1CCNCC1 NO20680 [0,1,0,1,0,0|2,0,0]=4 355 B8R1.2 CC[C@@H]1CCCCN1 DY622095 [0,1,0,1,0,0|1,0,0]=3 356 B8R1.2 CC[C@@H]1CNCCO1 DY444035 [0,1,0,1,0,0|0,1,0]=3 357 B8R1.2 CC[C@@H]1COCCN1 DY20812 [0,1,0,1,0,0|1,0,0]=3 358 B8R1.2 CC[C@H]1CCCCN1 DY624979 [0,1,0,1,0,0|1,0,0]=3 359 B8R1.2 CNC1CCNCC1 DY512505 [0,1,0,1,0,0|2,0,0]=4 360 B8R1.2 CNC1CCNCC1 DY641666 [0,1,0,1,0,0|2,0,0]=4 361 B8R1.2 CNC1CCOCC1 NO15192 [0,1,0,1,0,0|2,0,0]=4 362 B8R1.2 COC1=CCCCC1 DY789345 [0,1,0,1,0,0|1,0,1]=4 363 B8R1.2 COC1=NCCCC1 DY711079 [0,1,0,1,0,0|1,0,1]=4 364 B8R1.2 ClCC1CCCCC1 DY788085 [0,1,0,1,0,0|1,0,0]=3 365 B8R1.2 ClCC1CCCOC1 DY585697 [0,1,0,1,0,0|1,0,0]=3 366 B8R1.2 FC[C@@H]1CCCCN1 DY586647 [0,1,0,1,0,0|1,0,0]=3 367 B8R1.2 ICC1CCCCN1 DY635594 [0,1,0,1,0,0|1,0,0]=3 368 B8R1.2 N#CC1CCOCC1 NO12562 [0,1,0,1,0,0|1,0,1]=4 369 B8R1.2 N#CN1CCCCC1 DY775156 [0,1,0,1,0,0|1,0,1]=4 370 B8R1.2 NCC1CCCCC1 DY20908 [0,1,0,1,0,0|1,0,0]=3 371 B8R1.2 NCC1CCCNC1 DY568713 [0,1,0,1,0,0|1,0,0]=3 372 B8R1.2 NCC1CCCNC1 DY641787 [0,1,0,1,0,0|1,0,0]=3 373 B8R1.2 NCC1CCCOC1 NO18439 [0,1,0,1,0,0|1,0,0]=3 374 B8R1.2 NCC1CCOCC1 NO18584 [0,1,0,1,0,0|1,0,0]=3 375 B8R1.2 NCC1CCSCC1 DY102976 [0,1,0,1,0,0|1,0,0]=3 376 B8R1.2 NCC1CNCCN1 DY517005 [0,1,0,1,0,0|2,0,0]=4 377 B8R1.2 NCC1COCCN1 DY580905 [0,1,0,1,0,0|2,0,0]=4 378 B8R1.2 NC[C@H]1CCCOC1 DY105501 [0,1,0,1,0,0|1,0,0]=3 379 B8R1.2 NNC1CCCCC1 DY822741 [0,1,0,1,0,0|1,0,0]=3 380 B8R1.2 NNC1CCNCC1 DY638690 [0,1,0,1,0,0|2,0,0]=4 381 B8R1.2 NNC1CCOCC1 NO13041 [0,1,0,1,0,0|2,0,0]=4 382 B8R1.2 NNC1CCOCC1 NO20368 [0,1,0,1,0,0|2,0,0]=4 383 B8R1.2 NOC1CCCCO1 NO17026 [0,1,0,1,0,0|1,1,0]=4 384 B8R1.2 O=CC1CCCCC1 DY20143 [0,1,0,1,0,0|0,1,0]=3 385 B8R1.2 O=CC1CCCOC1 DY442323 [0,1,0,1,0,0|0,1,1]=4 386 B8R1.2 O=CC1CCCSC1 DY563535 [0,1,0,1,0,0|0,1,1]=4 387 B8R1.2 O=C[C@@H]1CCCOC1 DY585694 [0,1,0,1,0,0|0,1,1]=4 388 B8R1.2 O=C[C@H]1CCCOC1 DY585690 [0,1,0,1,0,0|0,1,1]=4 389 B8R1.2 OCC1CCCCC1 DY20144 [0,1,0,1,0,0|0,1,0]=3 390 B8R1.2 OCC1CCCCN1 NO21780 [0,1,0,1,0,0|0,1,0]=3 391 B8R1.2 OCC1CCCNC1 NO22817 [0,1,0,1,0,0|0,1,0]=3 392 B8R1.2 OCC1CCNCC1 NO22819 [0,1,0,1,0,0|0,1,0]=3 393 B8R1.2 OCC1CNCCO1 NO15312 [0,1,0,1,0,0|1,1,0]=4 394 B8R1.2 OC[C@@H]1CNCCO1 NO14518 [0,1,0,1,0,0|1,1,0]=4 395 B8R1.2 OC[C@@H]1COCCN1 DY539919 [0,1,0,1,0,0|1,1,0]=4 396 B8R1.2 OC[C@@H]1COCCN1 NO15269 [0,1,0,1,0,0|1,1,0]=4 397 B8R1.2 OC[C@H]1CCCNC1 NO15958 [0,1,0,1,0,0|0,1,0]=3 398 B8R1.2 OC[C@H]1COCCN1 NO15280 [0,1,0,1,0,0|1,1,0]=4 399 B8R1.5 BrC1CCCCC1Br NO20488 [0,1,0,1,0,0|1,0,0]=3 400 B8R1.5 Br[C@@H]1CCCC[C@H]1Br DY756619 [0,1,0,1,0,0|1,0,0]=3 401 B8R1.5 CC1CNCCC1O DY549411 [0,1,0,1,0,0|0,1,0]=3 402 B8R1.5 C[C@@H]1COCC[C@@H]1N DY567579 [0,1,0,1,0,0|1,0,0]=3 403 B8R1.5 C[C@H]1CCCC[C@H]1N DY540861 [0,1,0,1,0,0|1,0,0]=3 404 B8R1.5 C[C@H]1CCNC[C@H]1O DY103745 [0,1,0,1,0,0|0,1,0]=3 405 B8R1.5 NC1CCCCC1N DY756925 [0,1,0,1,0,0|1,0,0]=3 406 B8R1.5 NC1CCCCC1N DY822566 [0,1,0,1,0,0|1,0,0]=3 407 B8R1.5 NC1CCCCC1N DY822654 [0,1,0,1,0,0|1,0,0]=3 408 B8R1.5 NC1CCOCC1F DY459065 [0,1,0,1,0,0|2,0,0]=4 409 B8R1.5 N[C@@H]1CCCC[C@@H]1O NO12548 [0,1,0,1,0,0|0,1,0]=3 410 B8R1.5 N[C@@H]1CCCC[C@H]1F DY586539 [0,1,0,1,0,0|1,0,0]=3 411 B8R1.5 N[C@@H]1CCCC[C@H]1N DY507005 [0,1,0,1,0,0|1,0,0]=3 412 B8R1.5 N[C@@H]1CCCC[C@H]1N DY538371 [0,1,0,1,0,0|1,0,0]=3 413 B8R1.5 N[C@@H]1CCCC[C@H]1N DY564255 [0,1,0,1,0,0|1,0,0]=3 414 B8R1.5 N[C@@H]1CCCC[C@H]1O DY584529 [0,1,0,1,0,0|0,1,0]=3 415 B8R1.5 N[C@@H]1CCCC[C@H]1O NO12403 [0,1,0,1,0,0|0,1,0]=3 416 B8R1.5 N[C@@H]1CCCC[C@H]1O NO18590 [0,1,0,1,0,0|0,1,0]=3 417 B8R1.5 N[C@@H]1COCC[C@@H]1O DY529857 [0,1,0,1,0,0|1,1,0]=4 418 B8R1.5 N[C@@H]1COCC[C@H]1O DY519045 [0,1,0,1,0,0|1,1,0]=4 419 B8R1.5 N[C@H]1CCCC[C@@H]1O DY20824 [0,1,0,1,0,0|0,1,0]=3 420 B8R1.5 N[C@H]1CCCC[C@@H]1O NO14928 [0,1,0,1,0,0|0,1,0]=3 421 B8R1.5 N[C@H]1CCCC[C@H]1N DY620142 [0,1,0,1,0,0|1,0,0]=3 422 B8R1.5 N[C@H]1CCCC[C@H]1O DY20710 [0,1,0,1,0,0|0,1,0]=3 423 B8R1.5 N[C@H]1CCCC[C@H]1O NO12547 [0,1,0,1,0,0|0,1,0]=3 424 B8R1.5 N[C@H]1CCOC[C@H]1F DY529293 [0,1,0,1,0,0|2,0,0]=4 425 B8R1.5 N[C@H]1CCOC[C@H]1F DY535515 [0,1,0,1,0,0|2,0,0]=4 426 B8R1.5 N[C@H]1CCOC[C@H]1O DY102103 [0,1,0,1,0,0|1,1,0]=4 427 B8R1.5 N[C@H]1CCOC[C@H]1O DY621122 [0,1,0,1,0,0|1,1,0]=4 428 B8R1.5 O=C1CCCCC1Br DY573183 [0,1,0,1,0,0|0,1,1]=4 429 B8R1.5 OC1CNCCC1F DY638684 [0,1,0,1,0,0|1,1,0]=4 430 B8R1.5 O[C@@H]1CCCC[C@H]1O NO12029 [0,1,0,1,0,0|0,1,0]=3 431 B8R1.5 O[C@@H]1CCNC[C@H]1O DY116420 [0,1,0,1,0,0|1,1,0]=4 432 B8R1.5 O[C@H]1CCNC[C@H]1F DY586636 [0,1,0,1,0,0|1,1,0]=4 433 B8R1.5 O[C@H]1CNCC[C@H]1F DY621098 [0,1,0,1,0,0|1,1,0]=4 434 B8R1.8 BrCCC1OCCO1 NO18251 [0,1,0,1,0,0|1,1,0]=4 435 B8R1.8 CNCC1CCOC1 DY537651 [0,1,0,1,0,0|1,1,0]=4 436 B8R1.8 CNCC1CCOC1 DY568737 [0,1,0,1,0,0|1,1,0]=4 437 B8R1.8 COCC1CCCN1 DY571095 [0,1,0,1,0,0|1,0,0]=3 438 B8R1.8 COC[C@@H]1CCCN1 NO20310 [0,1,0,1,0,0|1,0,0]=3 439 B8R1.8 COC[C@H]1CCNC1 DY522807 [0,1,0,1,0,0|1,1,0]=4 440 B8R1.8 CSCC1CCNC1 DY585729 [0,1,0,1,0,0|1,0,0]=3 441 B8R1.8 ClCCN1CCCC1 DY665330 [0,1,0,1,0,0|1,0,0]=3 442 B8R1.8 ClCCN1CCCC1 DY738470 [0,1,0,1,0,0|1,0,0]=3 443 B8R1.8 ClCCN1CCCC1 NO15769 [0,1,0,1,0,0|1,0,0]=3 444 B8R1.8 N#CCC1CCCO1 DY759470 [0,1,0,1,0,0|0,1,1]=4 445 B8R1.8 NCCC1OCCO1 DY758978 [0,1,0,1,0,0|1,1,0]=4 446 B8R1.8 OCCC1CCNC1 DY666359 [0,1,0,1,0,0|0,1,0]=3 447 B8R1.10 FCCOC1CNC1 DY719092 [0,1,0,1,0,0|2,0,0]=4 448 B8R1.10 NCCCC1CNC1 DY586086 [0,1,0,1,0,0|1,0,0]=3 449 B8R1.10 NCCOC1COC1 DY732937 [0,1,0,1,0,0|2,0,0]=4 450 B8R1.10 OCCCC1COC1 DY732715 [0,1,0,1,0,0|0,1,0]=3 451 B8R1.11 CN1CCCC1CO NO14186 [0,1,0,1,0,0|0,1,0]=3 452 B8R1.11 CN1CCC[C@H]1CCl DY664952 [0,1,0,1,0,0|1,0,0]=3 453 B8R1.11 CN1CCC[C@H]1CO NO22816 [0,1,0,1,0,0|0,1,0]=3 454 B8R1.11 CO[C@@H]1COC[C@H]1N DY535695 [0,1,0,1,0,0|2,0,0]=4 455 B8R1.11 CO[C@H]1CNC[C@H]1O DY555813 [0,1,0,1,0,0|1,1,0]=4 456 B8R1.11 C[C@@H]1NCC[C@@H]1CO DY664706 [0,1,0,1,0,0|0,1,0]=3 457 B8R1.11 N#C[C@@H]1CCC[C@@H]1N DY104396 [0,1,0,1,0,0|1,0,1]=4 458 B8R1.11 NC[C@H]1COC[C@H]1O DY529311 [0,1,0,1,0,0|1,1,0]=4 459 B8R1.11 NN1CCC[C@H]1CO DY623433 [0,1,0,1,0,0|1,1,0]=4 460 B8R1.22 CC1CCOCCN1 DY685698 [0,1,0,1,0,0|1,0,0]=3 461 B8R1.22 FC1CCCCNC1 DY685529 [0,1,0,1,0,0|1,0,0]=3 462 B8R1.22 NC1CCCCNC1 NO18624 [0,1,0,1,0,0|1,0,0]=3 463 B8R1.22 NC1CNCCOC1 DY770733 [0,1,0,1,0,0|1,1,0]=4 464 B8R1.22 O=C1CCCCCC1 DY461238 [0,1,0,1,0,0|0,1,0]=3 465 B8R1.22 O=C1CCCNCC1 NO19096 [0,1,0,1,0,0|0,1,1]=4 466 B8R1.22 O[C@H]1CCCCNC1 DY625519 [0,1,0,1,0,0|0,1,0]=3 467 B8R1.22 O[C@H]1CCCOCC1 DY770757 [0,1,0,1,0,0|0,1,0]=3 468 B8R1.1 CCN1CC[C@@H](N)C1 DY516273 [0,1,0,1,0,0|2,0,0]=4 469 B8R1.1 CCN1CC[C@@H](N)C1 DY570393 [0,1,0,1,0,0|2,0,0]=4 470 B8R1.1 CN1CC[C@H](CN)C1 DY104144 [0,1,0,1,0,0|2,0,0]=4 471 B8R1.1 C[C@@H]1CN[C@H](CO)C1 DY620034 [0,1,0,1,0,0|1,1,0]=4 472 B8R1.1 NC[C@@H]1CC[C@@H](O)C1 DY582081 [0,1,0,1,0,0|1,0,0]=3 473 B8R1.1 OCC1CC(O)CO1 DY759500 [0,1,0,1,0,0|1,1,0]=4 474 B8R1.1 OC[C@@H]1C[C@@H](O)CN1 NO20184 [0,1,0,1,0,0|1,1,0]=4 475 B8R1.1 OC[C@H]1C[C@@H](O)CN1 DY664628 [0,1,0,1,0,0|1,1,0]=4 476 B8R1.3 CC1CCC(O)CC1 DY562059 [0,1,0,1,0,0|0,1,0]=3 477 B8R1.3 CC1CCN(N)CC1 DY535737 [0,1,0,1,0,0|2,0,0]=4 478 B8R1.3 CN1CCC(N)CC1 NO18628 [0,1,0,1,0,0|2,0,0]=4 479 B8R1.3 CN1CCC(O)CC1 NO13491 [0,1,0,1,0,0|1,1,0]=4 480 B8R1.3 C[C@H]1CC[C@@H](O)CN1 DY542115 [0,1,0,1,0,0|1,0,0]=3 481 B8R1.3 C[C@H]1CN[C@H](C)CN1 NO14078 [0,1,0,1,0,0|2,0,0]=4 482 B8R1.3 C[C@H]1CO[C@@H](C)CN1 DY107002 [0,1,0,1,0,0|1,1,0]=4 483 B8R1.3 C[C@H]1CO[C@H](C)CN1 DY620618 [0,1,0,1,0,0|1,1,0]=4 484 B8R1.3 NC1CCC(=O)CC1 NO22583 [0,1,0,1,0,0|0,1,1]=4 485 B8R1.3 NC1CCC(O)CC1 DY585958 [0,1,0,1,0,0|0,1,0]=3 486 B8R1.3 NC1CCC(O)CC1 NO18581 [0,1,0,1,0,0|0,1,0]=3 487 B8R1.3 N[C@H]1CC[C@@H](N)CC1 DY20732 [0,1,0,1,0,0|1,0,0]=3 488 B8R1.3 N[C@H]1CC[C@@H](O)CC1 NO15381 [0,1,0,1,0,0|0,1,0]=3 489 B8R1.3 N[C@H]1CC[C@H](N)CC1 NO18629 [0,1,0,1,0,0|1,0,0]=3 490 B8R1.3 N[C@H]1CC[C@H](O)CC1 NO12038 [0,1,0,1,0,0|0,1,0]=3 491 B8R1.3 N[C@H]1CC[C@H](O)CC1 NO18592 [0,1,0,1,0,0|0,1,0]=3 492 B8R1.3 N[C@H]1CC[S@H+]([O-])CC1 DY585300 [0,1,0,1,0,0|1,1,0]=4 493 B8R1.3 O=C1CCC(O)CC1 NO22889 [0,1,0,1,0,0|0,1,1]=4 494 B8R1.3 O[C@H]1CC[C@@H](F)CC1 DY585400 [0,1,0,1,0,0|0,1,0]=3 495 B8R1.38 CCC(O)C1COC1 DY526581 [0,1,0,1,0,0|2,0,0]=4 496 B8R1.38 O=C(CBr)C1CCC1 DY742339 [0,1,0,1,0,0|1,0,1]=4 497 B8R1.47 CCN1CC(CO)C1 DY585829 [0,1,0,1,0,0|1,1,0]=4 498 B8R1.47 CO[C@H]1C[C@@H](CN)C1 DY538389 [0,1,0,1,0,0|2,0,0]=4 499 B8R1.50 N[C@@H]1CC[C@H](O)[C@@H]1O DY608362 [0,1,0,1,0,0|1,1,0]=4 500 B8R1.52 CC1(CBr)CCOC1 DY104228 [0,1,0,1,0,0|2,0,0]=4 501 B8R1.52 CC1(CN)CCCC1 DY585763 [0,1,0,1,0,0|1,0,0]=3 502 B8R1.52 CC1(CN)CCNC1 DY529341 [0,1,0,1,0,0|2,0,0]=4 503 B8R1.52 CC1(CN)CCOC1 DY103499 [0,1,0,1,0,0|2,0,0]=4 504 B8R1.52 CC1(CO)CCCO1 DY585353 [0,1,0,1,0,0|1,1,0]=4 505 B8R1.52 CCC1(C)CCNC1 DY550311 [0,1,0,1,0,0|2,0,0]=4 506 B8R1.52 CCC1(C)CCNC1 DY585216 [0,1,0,1,0,0|2,0,0]=4 507 B8R1.52 CCC1(N)CCCC1 DY603592 [0,1,0,1,0,0|1,0,0]=3 508 B8R1.52 NC1(CO)CCOC1 DY103469 [0,1,0,1,0,0|1,1,0]=4 509 B8R1.52 NCC1(F)CCCC1 DY584015 [0,1,0,1,0,0|1,0,0]=3 510 B8R1.52 NCC1(O)CCCC1 NO15390 [0,1,0,1,0,0|1,0,0]=3 511 B8R1.52 OC1(CF)CCNC1 DY586652 [0,1,0,1,0,0|2,0,0]=4 512 B8R1.4 CC1CCCN(N)C1 DY774663 [0,1,0,1,0,0|2,0,0]=4 513 B8R1.4 CC1CCNC(C)C1 NO21125 [0,1,0,1,0,0|1,0,0]=3 514 B8R1.4 CC1CNCC(C)C1 NO14191 [0,1,0,1,0,0|2,0,0]=4 515 B8R1.4 CC1CNCC(C)N1 NO18625 [0,1,0,1,0,0|2,0,0]=4 516 B8R1.4 CC1CSCC(C)N1 DY738722 [0,1,0,1,0,0|2,0,0]=4 517 B8R1.4 C[C@@H]1CC(=O)CCN1 DY586650 [0,1,0,1,0,0|1,0,1]=4 518 B8R1.4 C[C@@H]1CCC[C@H](O)C1 DY757141 [0,1,0,1,0,0|0,1,0]=3 519 B8R1.4 C[C@H]1CNC[C@@H](C)N1 NO21187 [0,1,0,1,0,0|2,0,0]=4 520 B8R1.4 C[C@H]1CNC[C@@H](C)O1 DY459894 [0,1,0,1,0,0|1,1,0]=4 521 B8R1.4 C[C@H]1CNC[C@H](C)N1 DY103637 [0,1,0,1,0,0|2,0,0]=4 522 B8R1.4 C[C@H]1C[C@@H](O)CCN1 DY102289 [0,1,0,1,0,0|1,0,0]=3 523 B8R1.4 NC1CCCC(O)C1 NO17342 [0,1,0,1,0,0|0,1,0]=3 524 B8R1.4 NC1CCCC(O)C1 NO18558 [0,1,0,1,0,0|0,1,0]=3 525 B8R1.4 NN1CCCC(O)C1 DY775186 [0,1,0,1,0,0|1,1,0]=4 526 B8R1.4 N[C@H]1CCC[C@@H](N)C1 DY525135 [0,1,0,1,0,0|1,0,0]=3 527 B8R1.4 N[C@H]1CCC[C@@H](N)C1 DY545481 [0,1,0,1,0,0|1,0,0]=3 528 B8R1.4 N[C@H]1CCC[C@@H](N)C1 NO17066 [0,1,0,1,0,0|1,0,0]=3 529 B8R1.4 N[C@H]1CCC[C@H](F)C1 DY586540 [0,1,0,1,0,0|1,0,0]=3 530 B8R1.4 N[C@H]1CCC[C@H](O)C1 DY513927 [0,1,0,1,0,0|0,1,0]=3 531 B8R1.4 O=S1CCCC(Br)C1 DY586414 [0,1,0,1,0,0|1,1,0]=4 532 B8R1.6 CCCC1CC(=O)C1 DY561087 [0,1,0,1,0,0|0,1,1]=4 533 B8R1.6 CN1CC(CCBr)C1 DY585804 [0,1,0,1,0,0|2,0,0]=4 534 B8R1.6 N#CC[C@H]1C[C@@H](O)C1 DY742027 [0,1,0,1,0,0|1,0,1]=4 535 B8R1.6 NCC[C@H]1C[C@@H](O)C1 DY608447 [0,1,0,1,0,0|1,0,0]=3 536 B8R1.7 CC(=O)C1CCCC1 DY445790 [0,1,0,1,0,0|0,1,1]=4 537 B8R1.7 CC(=O)C1CCCC1 NO20673 [0,1,0,1,0,0|0,1,1]=4 538 B8R1.7 CC(=O)C1CCCO1 DY586599 [0,1,0,1,0,0|0,1,1]=4 539 B8R1.7 CC(=O)[C@H]1CCCN1 DY586041 [0,1,0,1,0,0|1,0,1]=4 540 B8R1.7 CC(=O)[C@H]1CCCO1 DY586598 [0,1,0,1,0,0|0,1,1]=4 541 B8R1.7 CC(N)C1CCCO1 DY580113 [0,1,0,1,0,0|0,1,0]=3 542 B8R1.7 CC(O)C1CCCC1 DY757207 [0,1,0,1,0,0|0,1,0]=3 543 B8R1.7 FC(F)[C@H]1CCCN1 DY621939 [0,1,0,1,0,0|2,0,0]=4 544 B8R1.7 N=C(N)C1CCCC1 DY585765 [0,1,0,1,0,0|1,0,1]=4 545 B8R1.7 NC(=O)C1CCCC1 DY794313 [0,1,0,1,0,0|0,1,1]=4 546 B8R1.19 CC1(C)CCCC1N DY540435 [0,1,0,1,0,0|1,0,0]=3 547 B8R1.19 N[C@@H]1CCCC1(F)F DY586242 [0,1,0,1,0,0|2,0,0]=4 548 B8R1.19 N[C@H]1CCCC1(F)F DY586241 [0,1,0,1,0,0|2,0,0]=4 549 B8R1.19 OC1CCCC1(F)F DY586464 [0,1,0,1,0,0|1,1,0]=4 550 B8R1.27 CCOC1CC1(C)C DY788847 [0,1,0,1,0,0|2,0,0]=4 551 B8R1.34 O=C(O)CC1CCC1 NO11177 [0,1,0,1,0,0|0,1,1]=4 552 B8R1.35 CC(C)OCC1CO1 DY553215 [0,1,0,1,0,0|1,1,0]=4 553 B8R1.35 O=C(O)CCC1CC1 NO19562 [0,1,0,1,0,0|0,1,1]=4 554 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O DY586259 [0,1,0,1,0,0|0,1,1]=4 555 B8R1.43 CC[C@H]1C[C@@H]1C(=O)O DY586268 [0,1,0,1,0,0|0,1,1]=4 556 B8R1.72 CC1(Br)CCCCC1 DY584406 [0,1,0,1,0,0|1,0,0]=3 557 B8R1.72 CC1(C)CCCNC1 DY510344 [0,1,0,1,0,0|2,0,0]=4 558 B8R1.72 CC1(C)CCNCC1 DY586635 [0,1,0,1,0,0|2,0,0]=4 559 B8R1.72 CC1(C)CCNCC1 NO13819 [0,1,0,1,0,0|2,0,0]=4 560 B8R1.72 CC1(C)CNCCN1 NO18507 [0,1,0,1,0,0|2,0,0]=4 561 B8R1.72 CC1(C)COCCN1 NO21909 [0,1,0,1,0,0|2,0,0]=4 562 B8R1.72 CC1(N)CCOCC1 NO14346 [0,1,0,1,0,0|2,0,0]=4 563 B8R1.72 CC1(O)CCOCC1 NO12641 [0,1,0,1,0,0|1,1,0]=4 564 B8R1.72 FC1(Br)CCCCC1 DY797283 [0,1,0,1,0,0|1,0,0]=3 565 B8R1.72 FC1(F)CCCNC1 NO21902 [0,1,0,1,0,0|2,0,0]=4 566 B8R1.72 FC1(F)CCNCC1 NO18259 [0,1,0,1,0,0|2,0,0]=4 567 B8R1.72 OC1(O)CCNCC1 NO10106 [0,1,0,1,0,0|1,1,0]=4 568 B8R1.66 OCCC1(O)COC1 DY530925 [0,1,0,1,0,0|1,1,0]=4 569 B8R2.11 OC1C2CNCC12 DY686011 [0,0,0,2,0,0|1,1,0]=4 570 B8R2.11 OC1C2CNCC12 DY738446 [0,0,0,2,0,0|1,1,0]=4 571 B8R2.34 C1=CC2CCC1C2 NO11805 [0,0,0,2,0,0|1,0,1]=4 572 B8R2.34 C1CC2CCC1C2 DY753433 [0,0,0,2,0,0|1,0,0]=3 573 B8R2.34 C1CC2CCC1N2 NO10780 [0,0,0,2,0,0|1,0,0]=3 574 B8R2.34 C1C[C@H]2CC1CN2 DY620286 [0,0,0,2,0,0|1,0,0]=3 575 B8R2.34 C1NC2CNC1C2 DY566511 [0,0,0,2,0,0|2,0,0]=4 576 B8R2.34 C1NC2CNC1C2 DY685187 [0,0,0,2,0,0|2,0,0]=4 577 B8R2.34 C1O[C@@H]2CN[C@H]1C2 NO12565 [0,0,0,2,0,0|1,1,0]=4 578 B8R2.34 C1O[C@H]2CN[C@@H]1C2 DY103903 [0,0,0,2,0,0|1,1,0]=4 579 B8R2.55 C1CC2(CC2)CN1 DY534537 [0,0,0,2,0,0|2,0,0]=4 580 B8R2.1 C1CC1C2CNC2 DY585799 [0,0,0,2,0,0|2,0,0]=4 581 B8R2.1 C1C[C@H](C2CC2)N1 DY622089 [0,0,0,2,0,0|1,0,0]=3 582 B8R2.42 C1CC2(C1)CCN2 DY102079 [0,0,0,2,0,0|1,0,0]=3 583 B8R2.42 C1CC2(CNC2)O1 DY102331 [0,0,0,2,0,0|1,1,0]=4