0 B6R0.6 BrCCNCCBr NO11032 [0,0,0,0,0,0|2,0,0]=2 1 B6R0.6 C#CCNCCBr DY540501 [0,0,0,0,0,0|2,0,1]=3 2 B6R0.6 C#CCOCCO DY457828 [0,0,0,0,0,0|2,0,1]=3 3 B6R0.6 C=CCCCCCl DY427568 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.6 C=CCCCCO NO10397 [0,0,0,0,0,0|2,0,1]=3 5 B6R0.6 C=CCNCC=C DY563475 [0,0,0,0,0,0|2,0,2]=4 6 B6R0.6 CC#CCCCO DY580533 [0,0,0,0,0,0|2,0,2]=4 7 B6R0.6 CCCCSCC DY740893 [0,0,0,0,0,0|4,0,0]=4 8 B6R0.6 CCCOCCO DY740785 [0,0,0,0,0,0|2,0,0]=2 9 B6R0.6 CNCCCCBr DY741283 [0,0,0,0,0,0|4,0,0]=4 10 B6R0.6 CNCCCCO DY554133 [0,0,0,0,0,0|3,0,0]=3 11 B6R0.6 COCCCCBr NO22933 [0,0,0,0,0,0|4,0,0]=4 12 B6R0.6 COCCCCO DY741295 [0,0,0,0,0,0|3,0,0]=3 13 B6R0.6 ClCCCCCBr DY559653 [0,0,0,0,0,0|3,0,0]=3 14 B6R0.6 ClCCNCCCl NO16038 [0,0,0,0,0,0|2,0,0]=2 15 B6R0.6 FCCCCCBr NO14708 [0,0,0,0,0,0|3,0,0]=3 16 B6R0.6 FCCCCCF DY822300 [0,0,0,0,0,0|3,0,0]=3 17 B6R0.6 N#CCCCCCl NO10359 [0,0,0,0,0,0|3,0,1]=4 18 B6R0.6 NCCCCCN NO19074 [0,0,0,0,0,0|3,0,0]=3 19 B6R0.6 NCCNCCN DY740695 [0,0,0,0,0,0|2,0,0]=2 20 B6R0.6 NCCNCCO DY506670 [0,0,0,0,0,0|1,0,0]=1 21 B6R0.6 O=CCCCCBr DY510224 [0,0,0,0,0,0|2,0,2]=4 22 B6R0.6 OCCCCCCl NO14778 [0,0,0,0,0,0|2,0,0]=2 23 B6R0.6 OCCCCCF DY822292 [0,0,0,0,0,0|2,0,0]=2 24 B6R0.6 OCCCCCO NO20549 [0,0,0,0,0,0|1,0,0]=1 25 B6R0.6 OCCNCCCl DY544797 [0,0,0,0,0,0|1,0,0]=1 26 B5R0.2 C=CCCCBr DY460284 [1,0,0,0,0,0|2,0,1]=4 27 B5R0.2 CCC#CCC DY740797 [1,0,0,0,0,0|2,0,1]=4 28 B5R0.2 CCCCCBr NO20657 [1,0,0,0,0,0|2,0,0]=3 29 B5R0.2 CCCC[Mg]Cl DY567561 [1,0,0,0,0,0|3,0,0]=4 30 B5R0.2 CCOCCBr NO21396 [1,0,0,0,0,0|2,0,0]=3 31 B5R0.2 CC\C=C\CO DY527871 [1,0,0,0,0,0|1,0,1]=3 32 B5R0.2 CNCCCO NO14200 [1,0,0,0,0,0|2,0,0]=3 33 B5R0.2 COCCCBr NO20649 [1,0,0,0,0,0|3,0,0]=4 34 B5R0.2 COCCCO NO20039 [1,0,0,0,0,0|2,0,0]=3 35 B5R0.2 CSCCCO DY557199 [1,0,0,0,0,0|2,0,0]=3 36 B5R0.2 C\C=C\CCO DY799773 [1,0,0,0,0,0|1,0,1]=3 37 B5R0.2 FCCCCF DY822299 [1,0,0,0,0,0|2,0,0]=3 38 B5R0.2 N#CCCCN DY548775 [1,0,0,0,0,0|2,0,1]=4 39 B5R0.2 NCCCCBr NO14979 [1,0,0,0,0,0|2,0,0]=3 40 B5R0.2 NCCCCN NO19906 [1,0,0,0,0,0|2,0,0]=3 41 B5R0.2 OCCCCF DY822291 [1,0,0,0,0,0|1,0,0]=2 42 B5R0.2 OC\C=C\CCl DY10262 [1,0,0,0,0,0|1,0,2]=4 43 B7R0.1 BrCCCCCCBr NO20550 [0,1,0,0,0,0|3,0,0]=4 44 B7R0.1 C#CCCCCCC DY740767 [0,1,0,0,0,0|3,0,0]=4 45 B7R0.1 C#CCCCCCO NO10705 [0,1,0,0,0,0|2,0,0]=3 46 B7R0.1 C=CCCCCCBr NO19607 [0,1,0,0,0,0|3,0,0]=4 47 B7R0.1 CCCOCCCN DY740653 [0,1,0,0,0,0|3,0,0]=4 48 B7R0.1 COCCOCCBr DY559431 [0,1,0,0,0,0|2,0,0]=3 49 B7R0.1 COCCOCCCl DY740401 [0,1,0,0,0,0|2,0,0]=3 50 B7R0.1 ClCCCCCCI DY550149 [0,1,0,0,0,0|3,0,0]=4 51 B7R0.1 FCCCCCCF DY822301 [0,1,0,0,0,0|3,0,0]=4 52 B7R0.1 N#CCCSCCO DY791895 [0,1,0,0,0,0|2,0,0]=3 53 B7R0.1 NCCCCCCN DY740617 [0,1,0,0,0,0|3,0,0]=4 54 B7R0.1 NCCCNCCBr NO13982 [0,1,0,0,0,0|2,0,0]=3 55 B7R0.1 NCCSSCCN DY557499 [0,1,0,0,0,0|3,0,0]=4 56 B7R0.1 NCCSSCCN NO11190 [0,1,0,0,0,0|3,0,0]=4 57 B7R0.1 NCC[Se][Se]CCN DY435603 [0,1,0,0,0,0|3,0,0]=4 58 B7R0.1 OCCCCCCBr NO14335 [0,1,0,0,0,0|2,0,0]=3 59 B7R0.1 OCCCCCCF DY822293 [0,1,0,0,0,0|2,0,0]=3 60 B7R0.1 OCCOCCCCl DY740305 [0,1,0,0,0,0|2,0,0]=3 61 B7R0.1 SCCCCCCS DY741367 [0,1,0,0,0,0|1,2,0]=4 62 B7R0.3 C#CCC[C@H](N)CO DY516333 [0,1,0,0,0,0|2,0,1]=4 63 B7R0.3 CCCCC(O)CO DY567525 [0,1,0,0,0,0|2,0,0]=3 64 B7R0.3 CCCOC(C)CN DY605531 [0,1,0,0,0,0|3,0,0]=4 65 B7R0.3 CCN(C)CCCO DY604490 [0,1,0,0,0,0|3,0,0]=4 66 B7R0.3 NCC(Cl)CCCCl DY822547 [0,1,0,0,0,0|3,0,0]=4 67 B7R0.4 CC(O)COCCN DY560097 [0,1,0,0,0,0|2,0,0]=3 68 B7R0.4 CCCCCB(O)O NO22305 [0,1,0,0,0,0|3,0,0]=4 69 B7R0.4 CCCCCC(C)O NO21570 [0,1,0,0,0,0|2,0,0]=3 70 B7R0.4 CCCOCC(=O)O DY425744 [0,1,0,0,0,0|2,0,1]=4 71 B7R0.4 CN(C)CCCCO NO22813 [0,1,0,0,0,0|3,0,0]=4 72 B7R0.7 O=C(CCCl)CCCl NO19912 [0,1,0,0,0,0|3,0,0]=4 73 B7R0.7 O=C(NCO)NCO DY521673 [0,1,0,0,0,0|3,0,0]=4 74 B7R1.1 BrCC1CCCC1 DY20145 [0,0,0,1,0,0|3,0,0]=4 75 B7R1.1 BrCC1OCCO1 NO21401 [0,0,0,1,0,0|2,0,0]=3 76 B7R1.1 C#CC1CCCO1 DY586043 [0,0,0,1,0,0|2,0,1]=4 77 B7R1.1 CCC1CCCN1 DY738230 [0,0,0,1,0,0|2,0,0]=3 78 B7R1.1 FC[C@@H]1CCCN1 DY100102 [0,0,0,1,0,0|2,0,0]=3 79 B7R1.1 NCC1CCCC1 NO14873 [0,0,0,1,0,0|3,0,0]=4 80 B7R1.1 NCC1CCCN1 NO15469 [0,0,0,1,0,0|2,0,0]=3 81 B7R1.1 NC[C@H]1CCCN1 NO15745 [0,0,0,1,0,0|2,0,0]=3 82 B7R1.1 O=C[C@@H]1CCCN1 DY626191 [0,0,0,1,0,0|1,0,2]=4 83 B7R1.1 OCC1CCCC1 NO11185 [0,0,0,1,0,0|2,0,0]=3 84 B7R1.1 OCC1CCCN1 DY556821 [0,0,0,1,0,0|1,0,0]=2 85 B7R1.1 OCC1CCCN1 DY668415 [0,0,0,1,0,0|1,0,0]=2 86 B7R1.1 OCC1CCCO1 DY20392 [0,0,0,1,0,0|1,0,0]=2 87 B7R1.1 OCC1CCNC1 NO11284 [0,0,0,1,0,0|3,0,0]=4 88 B7R1.1 OCC1CCNC1 NO16764 [0,0,0,1,0,0|3,0,0]=4 89 B7R1.1 OCC1CCNC1 NO18341 [0,0,0,1,0,0|3,0,0]=4 90 B7R1.1 OC[C@@H]1CCCN1 NO22640 [0,0,0,1,0,0|1,0,0]=2 91 B7R1.1 OC[C@@H]1CCNC1 DY115660 [0,0,0,1,0,0|3,0,0]=4 92 B7R1.1 OC[C@H]1CCCN1 NO17003 [0,0,0,1,0,0|1,0,0]=2 93 B7R1.1 OC[C@H]1CCCO1 DY542355 [0,0,0,1,0,0|1,0,0]=2 94 B7R1.3 BrC1CCCCC1 NO11079 [0,0,0,1,0,0|3,0,0]=4 95 B7R1.3 CC1C=CCCO1 DY560079 [0,0,0,1,0,0|2,0,1]=4 96 B7R1.3 CC1CCCCN1 DY20418 [0,0,0,1,0,0|3,0,0]=4 97 B7R1.3 CC1CNCCN1 NO13503 [0,0,0,1,0,0|2,0,0]=3 98 B7R1.3 CC1CNCCO1 NO21692 [0,0,0,1,0,0|1,0,0]=2 99 B7R1.3 CC1COCCN1 NO22371 [0,0,0,1,0,0|3,0,0]=4 100 B7R1.3 C[C@@H]1CCCNC1 NO16133 [0,0,0,1,0,0|2,0,0]=3 101 B7R1.3 C[C@@H]1CNCCN1 DY622137 [0,0,0,1,0,0|2,0,0]=3 102 B7R1.3 C[C@@H]1CNCCN1 NO17164 [0,0,0,1,0,0|2,0,0]=3 103 B7R1.3 C[C@@H]1CNCCO1 NO14521 [0,0,0,1,0,0|1,0,0]=2 104 B7R1.3 C[C@@H]1COCCN1 NO14856 [0,0,0,1,0,0|3,0,0]=4 105 B7R1.3 C[C@@H]1COCCN1 NO20285 [0,0,0,1,0,0|3,0,0]=4 106 B7R1.3 C[C@H]1CNCCN1 NO17167 [0,0,0,1,0,0|2,0,0]=3 107 B7R1.3 C[C@H]1CNCCO1 NO14515 [0,0,0,1,0,0|1,0,0]=2 108 B7R1.3 C[C@H]1CNCCO1 NO19299 [0,0,0,1,0,0|1,0,0]=2 109 B7R1.3 C[C@H]1COCCN1 DY20820 [0,0,0,1,0,0|3,0,0]=4 110 B7R1.3 C[C@H]1COCCN1 NO22413 [0,0,0,1,0,0|3,0,0]=4 111 B7R1.3 ClC1CCCOC1 DY586426 [0,0,0,1,0,0|3,0,0]=4 112 B7R1.3 NC1CCCNC1 NO22655 [0,0,0,1,0,0|2,0,0]=3 113 B7R1.3 N[C@@H]1CCCNC1 NO17178 [0,0,0,1,0,0|2,0,0]=3 114 B7R1.3 N[C@@H]1CCCOC1 DY517515 [0,0,0,1,0,0|3,0,0]=4 115 B7R1.3 N[C@H]1CCCNC1 NO17182 [0,0,0,1,0,0|2,0,0]=3 116 B7R1.3 O=C1CCCCO1 NO11208 [0,0,0,1,0,0|1,0,2]=4 117 B7R1.3 O=C1CCCNC1 DY557319 [0,0,0,1,0,0|1,0,2]=4 118 B7R1.3 O=C1CCCNC1 NO17767 [0,0,0,1,0,0|1,0,2]=4 119 B7R1.3 O=C1CNCCN1 NO19142 [0,0,0,1,0,0|1,0,2]=4 120 B7R1.3 O=C1COCCO1 DY20725 [0,0,0,1,0,0|1,0,2]=4 121 B7R1.3 OC1C=CCNC1 DY552951 [0,0,0,1,0,0|1,0,1]=3 122 B7R1.3 OC1CCCNC1 NO22642 [0,0,0,1,0,0|1,0,0]=2 123 B7R1.3 OC1CCCOC1 NO17782 [0,0,0,1,0,0|2,0,0]=3 124 B7R1.3 OC1CCNCC1 NO22643 [0,0,0,1,0,0|3,0,0]=4 125 B7R1.3 OC1CCOCC1 NO13929 [0,0,0,1,0,0|3,0,0]=4 126 B7R1.3 OC1CCSCC1 NO12012 [0,0,0,1,0,0|3,0,0]=4 127 B7R1.3 O[C@@H]1CCCNC1 NO17016 [0,0,0,1,0,0|1,0,0]=2 128 B7R1.3 O[C@H]1CCCNC1 NO17020 [0,0,0,1,0,0|1,0,0]=2 129 B7R1.4 BrC1CCCC1Br DY585689 [0,0,0,1,0,0|3,0,0]=4 130 B7R1.4 CC1CCCC1O DY757267 [0,0,0,1,0,0|2,0,0]=3 131 B7R1.4 NC1CCCC1O NO19404 [0,0,0,1,0,0|2,0,0]=3 132 B7R1.4 N[C@@H]1CCC[C@@H]1O NO18884 [0,0,0,1,0,0|2,0,0]=3 133 B7R1.4 N[C@@H]1CCC[C@H]1O DY567117 [0,0,0,1,0,0|2,0,0]=3 134 B7R1.4 N[C@@H]1CNC[C@H]1F DY585432 [0,0,0,1,0,0|2,0,0]=3 135 B7R1.4 N[C@@H]1COC[C@@H]1F DY539427 [0,0,0,1,0,0|3,0,0]=4 136 B7R1.4 N[C@@H]1COC[C@H]1N DY444023 [0,0,0,1,0,0|3,0,0]=4 137 B7R1.4 N[C@@H]1COC[C@H]1O DY105386 [0,0,0,1,0,0|2,0,0]=3 138 B7R1.4 N[C@@H]1CSC[C@H]1O DY559281 [0,0,0,1,0,0|2,0,0]=3 139 B7R1.4 N[C@H]1CCC[C@@H]1N DY620340 [0,0,0,1,0,0|3,0,0]=4 140 B7R1.4 N[C@H]1CCC[C@@H]1O NO15594 [0,0,0,1,0,0|2,0,0]=3 141 B7R1.4 N[C@H]1CCC[C@H]1O NO11147 [0,0,0,1,0,0|2,0,0]=3 142 B7R1.4 N[C@H]1COC[C@@H]1O DY586645 [0,0,0,1,0,0|2,0,0]=3 143 B7R1.4 O[C@@H]1CCC[C@H]1F DY518337 [0,0,0,1,0,0|2,0,0]=3 144 B7R1.4 O[C@@H]1CCC[C@H]1O DY557241 [0,0,0,1,0,0|1,0,0]=2 145 B7R1.4 O[C@@H]1CNC[C@@H]1F DY586649 [0,0,0,1,0,0|1,0,0]=2 146 B7R1.4 O[C@@H]1CNC[C@H]1F DY457961 [0,0,0,1,0,0|1,0,0]=2 147 B7R1.4 O[C@H]1CNC[C@@H]1O NO20186 [0,0,0,1,0,0|0,0,0]=1 148 B7R1.5 C=C1CC1CCO DY790953 [0,0,0,1,0,0|2,0,1]=4 149 B7R1.5 C[C@@H]1C[C@@H]1CCO DY544215 [0,0,0,1,0,0|2,0,0]=3 150 B7R1.6 OCCC1CCO1 DY551169 [0,0,0,1,0,0|1,0,0]=2 151 B7R1.7 CCCC[C@H]1CO1 DY822259 [0,0,0,1,0,0|2,0,0]=3 152 B7R1.7 OCCC[C@@H]1CO1 DY536067 [0,0,0,1,0,0|1,0,0]=2 153 B7R1.8 NCC1CCC1F DY528009 [0,0,0,1,0,0|3,0,0]=4 154 B7R1.9 C#C[C@@H]1C[C@H]1CO DY586040 [0,0,0,1,0,0|2,0,1]=4 155 B7R1.9 N#CC1CC1CO DY757663 [0,0,0,1,0,0|2,0,1]=4 156 B7R1.9 NCC1CC1CO DY528789 [0,0,0,1,0,0|2,0,0]=3 157 B7R1.9 OC[C@H]1C[C@H]1CO DY543213 [0,0,0,1,0,0|1,0,0]=2 158 B7R1.24 C1CNCCOC1 NO17007 [0,0,0,1,0,0|1,0,0]=2 159 B4R0.2 BrCCCBr DY459264 [2,0,0,0,0,0|2,0,0]=4 160 B4R0.2 C#CCCO DY580491 [2,0,0,0,0,0|0,0,2]=4 161 B4R0.2 CCCCBr DY460620 [2,0,0,0,0,0|1,0,0]=3 162 B4R0.2 CCNCC NO11240 [2,0,0,0,0,0|0,0,0]=2 163 B4R0.2 CNCC#N NO19888 [2,0,0,0,0,0|1,0,1]=4 164 B4R0.2 CNCCBr DY584482 [2,0,0,0,0,0|1,0,0]=3 165 B4R0.2 CNCCO NO20910 [2,0,0,0,0,0|0,0,0]=2 166 B4R0.2 COCCBr DY578823 [2,0,0,0,0,0|2,0,0]=4 167 B4R0.2 COCCN DY822486 [2,0,0,0,0,0|2,0,0]=4 168 B4R0.2 COCCO DY457570 [2,0,0,0,0,0|1,0,0]=3 169 B4R0.2 FCCCF DY822298 [2,0,0,0,0,0|2,0,0]=4 170 B4R0.2 ICCCI DY564171 [2,0,0,0,0,0|2,0,0]=4 171 B4R0.2 NCCCBr NO22190 [2,0,0,0,0,0|2,0,0]=4 172 B4R0.2 OCCCF DY822290 [2,0,0,0,0,0|1,0,0]=3 173 B4R0.2 SCCCS DY740347 [2,0,0,0,0,0|0,2,0]=4 174 B4R0.2 [Li]CCCC DY790335 [2,0,0,0,0,0|1,0,0]=3 175 B6R0.1 CC(CN)CCN DY791871 [1,1,0,0,0,0|2,0,0]=4 176 B6R0.1 CCCC(C)CBr DY112368 [1,1,0,0,0,0|2,0,0]=4 177 B6R0.1 CCCC(O)CO NO20495 [1,1,0,0,0,0|1,0,0]=3 178 B6R0.1 CCNC(=O)CN DY461322 [1,1,0,0,0,0|1,0,1]=4 179 B6R0.1 CCOC(=O)CO NO11386 [1,1,0,0,0,0|1,0,1]=4 180 B6R0.1 NCCC(O)CO DY608108 [1,1,0,0,0,0|1,0,0]=3 181 B6R0.1 N\C(CCO)=N/O DY607623 [1,1,0,0,0,0|1,0,1]=4 182 B6R0.1 O=C(CCl)NCO NO14580 [1,1,0,0,0,0|1,0,1]=4 183 B6R0.1 OC(CBr)CCBr DY740743 [1,1,0,0,0,0|2,0,0]=4 184 B6R0.4 CC(=O)NCCCl DY33011 [1,1,0,0,0,0|1,0,1]=4 185 B6R0.4 CC(C)CCCBr DY740443 [1,1,0,0,0,0|2,0,0]=4 186 B6R0.4 CC(C)NCCN DY20461 [1,1,0,0,0,0|1,0,0]=3 187 B6R0.4 CCCCC(C)O DY740779 [1,1,0,0,0,0|1,0,0]=3 188 B6R0.4 CCNCC(C)C DY564723 [1,1,0,0,0,0|1,0,0]=3 189 B6R0.4 NCCCC(=O)O NO14998 [1,1,0,0,0,0|1,0,1]=4 190 B6R0.4 NCCNC(=O)O DY822495 [1,1,0,0,0,0|1,0,1]=4 191 B6R0.4 O=C(O)CCCBr NO14053 [1,1,0,0,0,0|1,0,1]=4 192 B8R0.1 CN(CCO)CCCN DY795333 [0,2,0,0,0,0|1,0,0]=3 193 B8R0.1 CNCC(=O)NCCO DY741259 [0,2,0,0,0,0|1,0,1]=4 194 B8R0.4 C#CCCCCCCO NO10833 [0,2,0,0,0,0|2,0,0]=4 195 B8R0.4 C=CCCCCCCO DY740623 [0,2,0,0,0,0|2,0,0]=4 196 B8R0.4 C=COCCOCCO DY799065 [0,2,0,0,0,0|1,0,0]=3 197 B8R0.4 CCCCNCCCC NO11229 [0,2,0,0,0,0|2,0,0]=4 198 B8R0.4 COCCOCCOC DY41925 [0,2,0,0,0,0|1,0,0]=3 199 B8R0.4 OCCCCCCCBr NO13415 [0,2,0,0,0,0|2,0,0]=4 200 B8R0.4 OCCCCCCCF DY822294 [0,2,0,0,0,0|2,0,0]=4 201 B8R0.4 OCCCNCCCO NO21826 [0,2,0,0,0,0|0,0,0]=2 202 B8R0.4 [N-]=[N+]=NCCOCCO DY521235 [0,2,0,0,0,0|2,0,0]=4 203 B8R0.6 NCC(=O)NCCCO DY741271 [0,2,0,0,0,0|1,0,1]=4 204 B8R0.7 CCCCCCC(=O)O DY822462 [0,2,0,0,0,0|2,0,0]=4 205 B8R0.7 CCCCCC[C@H](C)O DY626179 [0,2,0,0,0,0|2,0,0]=4 206 B8R0.7 CN(C)CCNCCO DY552351 [0,2,0,0,0,0|1,0,0]=3 207 B8R0.7 CN(C)CCOCCO DY531015 [0,2,0,0,0,0|2,0,0]=4 208 B8R0.7 NCCCCCC(=O)O NO13381 [0,2,0,0,0,0|2,0,0]=4 209 B8R0.7 NCCOCCC(=O)O DY739157 [0,2,0,0,0,0|2,0,0]=4 210 B8R0.7 O=C(O)CCCCCBr NO18405 [0,2,0,0,0,0|2,0,0]=4 211 B8R0.19 CC(CO)NC(C)CO NO17166 [0,2,0,0,0,0|0,0,0]=2 212 B8R0.30 C[N+](C)(CCO)CCO DY822336 [0,2,0,0,0,0|0,0,1]=3 213 B6R1.1 C1=CCNCC1 DY444071 [1,0,0,1,0,0|1,0,1]=4 214 B6R1.1 C1=COCCC1 DY20500 [1,0,0,1,0,0|1,0,1]=4 215 B6R1.1 C1CCNCC1 DY822173 [1,0,0,1,0,0|1,0,0]=3 216 B6R1.1 C1CCNNC1 DY586554 [1,0,0,1,0,0|2,0,0]=4 217 B6R1.1 C1CCNNC1 NO17893 [1,0,0,1,0,0|2,0,0]=4 218 B6R1.1 C1CCSCC1 DY822278 [1,0,0,1,0,0|1,1,0]=4 219 B6R1.1 C1CNCOC1 DY524601 [1,0,0,1,0,0|1,0,0]=3 220 B6R1.1 C1COCCN1 DY20726 [1,0,0,1,0,0|0,0,0]=2 221 B6R1.1 C1COCOC1 DY822672 [1,0,0,1,0,0|2,0,0]=4 222 B6R1.1 C1CSCCN1 DY20759 [1,0,0,1,0,0|0,1,0]=3 223 B6R1.2 BrC1CCNC1 NO15742 [1,0,0,1,0,0|1,0,0]=3 224 B6R1.2 CC1CCCN1 NO21699 [1,0,0,1,0,0|1,0,0]=3 225 B6R1.2 CC1CCCN1 NO21700 [1,0,0,1,0,0|1,0,0]=3 226 B6R1.2 CC1CCCO1 DY20580 [1,0,0,1,0,0|1,0,0]=3 227 B6R1.2 CC1CCNC1 DY667237 [1,0,0,1,0,0|1,0,0]=3 228 B6R1.2 C[C@@H]1CCCN1 NO18299 [1,0,0,1,0,0|1,0,0]=3 229 B6R1.2 C[C@H]1CCCN1 NO18800 [1,0,0,1,0,0|1,0,0]=3 230 B6R1.2 C[C@H]1CCCN1 NO19735 [1,0,0,1,0,0|1,0,0]=3 231 B6R1.2 FC1CCNC1 NO12894 [1,0,0,1,0,0|1,0,0]=3 232 B6R1.2 F[C@H]1CCNC1 NO14870 [1,0,0,1,0,0|1,0,0]=3 233 B6R1.2 NC1CCNC1 DY572169 [1,0,0,1,0,0|1,0,0]=3 234 B6R1.2 NC1CCOC1 NO12010 [1,0,0,1,0,0|2,0,0]=4 235 B6R1.2 N[C@@H]1CCOC1 DY623409 [1,0,0,1,0,0|2,0,0]=4 236 B6R1.2 N[C@@H]1CCOC1 NO13003 [1,0,0,1,0,0|2,0,0]=4 237 B6R1.2 N[C@H]1CCNC1 DY508670 [1,0,0,1,0,0|1,0,0]=3 238 B6R1.2 N[C@H]1CCOC1 DY626689 [1,0,0,1,0,0|2,0,0]=4 239 B6R1.2 N[C@H]1CCOC1 NO20366 [1,0,0,1,0,0|2,0,0]=4 240 B6R1.2 O=C1CCNC1 NO22412 [1,0,0,1,0,0|0,0,2]=4 241 B6R1.2 OC1CC=CC1 DY10342 [1,0,0,1,0,0|1,0,1]=4 242 B6R1.2 O[C@@H]1CCNC1 NO16635 [1,0,0,1,0,0|0,0,0]=2 243 B6R1.2 O[C@@H]1CCNC1 NO16650 [1,0,0,1,0,0|0,0,0]=2 244 B6R1.2 O[C@@H]1CCOC1 NO20284 [1,0,0,1,0,0|1,0,0]=3 245 B6R1.2 O[C@@H]1CNOC1 DY549543 [1,0,0,1,0,0|1,0,0]=3 246 B6R1.2 O[C@H]1CCNC1 NO21757 [1,0,0,1,0,0|0,0,0]=2 247 B6R1.2 S=C1NCCO1 DY561801 [1,0,0,1,0,0|0,1,1]=4 248 B6R1.2 SC1CCOC1 DY789441 [1,0,0,1,0,0|1,1,0]=4 249 B6R1.3 ICCC1CC1 DY549405 [1,0,0,1,0,0|2,0,0]=4 250 B6R1.3 OCCN1CC1 DY505047 [1,0,0,1,0,0|0,0,0]=2 251 B6R1.4 CC1OCC1N DY732961 [1,0,0,1,0,0|2,0,0]=4 252 B6R1.4 C[C@@H]1NC[C@H]1O DY519399 [1,0,0,1,0,0|0,0,0]=2 253 B6R1.4 C[C@@H]1OC[C@H]1O DY515625 [1,0,0,1,0,0|1,0,0]=3 254 B6R1.4 O[C@H]1CC[C@H]1O DY756385 [1,0,0,1,0,0|0,0,0]=2 255 B6R1.6 BrCC1CCC1 DY10470 [1,0,0,1,0,0|2,0,0]=4 256 B6R1.6 NCC1CCC1 DY554907 [1,0,0,1,0,0|2,0,0]=4 257 B6R1.6 NCC1CCC1 NO11178 [1,0,0,1,0,0|2,0,0]=4 258 B6R1.6 NCC1CCS1 DY585795 [1,0,0,1,0,0|1,1,0]=4 259 B6R1.6 OCC1CCO1 NO15009 [1,0,0,1,0,0|0,0,0]=2 260 B6R1.6 OCC1CNC1 NO12891 [1,0,0,1,0,0|2,0,0]=4 261 B6R1.6 OCC1COC1 NO14670 [1,0,0,1,0,0|2,0,0]=4 262 B6R1.6 OC[C@@H]1CCN1 NO15230 [1,0,0,1,0,0|0,0,0]=2 263 B6R1.8 N[C@@H]1C[C@H]1CO DY757435 [1,0,0,1,0,0|1,0,0]=3 264 B6R1.8 OCC1C[C@@H]1F DY102848 [1,0,0,1,0,0|1,0,0]=3 265 B8R1.2 BrC[C@@H]1COCCO1 DY585231 [0,1,0,1,0,0|2,0,0]=4 266 B8R1.2 CCC1CNCCO1 DY731791 [0,1,0,1,0,0|1,0,0]=3 267 B8R1.2 CC[C@@H]1CCCCN1 DY622095 [0,1,0,1,0,0|2,0,0]=4 268 B8R1.2 CC[C@@H]1CNCCO1 DY444035 [0,1,0,1,0,0|1,0,0]=3 269 B8R1.2 CC[C@@H]1COCCN1 DY20812 [0,1,0,1,0,0|1,0,0]=3 270 B8R1.2 CC[C@H]1CCCCN1 DY624979 [0,1,0,1,0,0|2,0,0]=4 271 B8R1.2 ClCC1CCCOC1 DY585697 [0,1,0,1,0,0|2,0,0]=4 272 B8R1.2 FC[C@@H]1CCCCN1 DY586647 [0,1,0,1,0,0|2,0,0]=4 273 B8R1.2 ICC1CCCCN1 DY635594 [0,1,0,1,0,0|2,0,0]=4 274 B8R1.2 N#CC1CNCCN1 NO12950 [0,1,0,1,0,0|2,0,0]=4 275 B8R1.2 N#CC1CNCCO1 DY442480 [0,1,0,1,0,0|1,0,0]=3 276 B8R1.2 N#CC1COCCN1 DY732613 [0,1,0,1,0,0|1,0,1]=4 277 B8R1.2 N#C[C@H]1CNCCO1 DY732649 [0,1,0,1,0,0|1,0,0]=3 278 B8R1.2 N#C[C@H]1COCCN1 DY625945 [0,1,0,1,0,0|1,0,1]=4 279 B8R1.2 NCC1CCCNC1 DY568713 [0,1,0,1,0,0|2,0,0]=4 280 B8R1.2 NCC1CCCNC1 DY641787 [0,1,0,1,0,0|2,0,0]=4 281 B8R1.2 NCC1CCCOC1 NO18439 [0,1,0,1,0,0|2,0,0]=4 282 B8R1.2 NCC1CNCCN1 DY517005 [0,1,0,1,0,0|2,0,0]=4 283 B8R1.2 NCC1COCCN1 DY580905 [0,1,0,1,0,0|1,0,0]=3 284 B8R1.2 NC[C@H]1CCCOC1 DY105501 [0,1,0,1,0,0|2,0,0]=4 285 B8R1.2 NOC1CCCCO1 NO17026 [0,1,0,1,0,0|1,0,0]=3 286 B8R1.2 OCC1CCC=CO1 DY20505 [0,1,0,1,0,0|1,0,1]=4 287 B8R1.2 OCC1CCCCC1 DY20144 [0,1,0,1,0,0|2,0,0]=4 288 B8R1.2 OCC1CCCCN1 NO21780 [0,1,0,1,0,0|1,0,0]=3 289 B8R1.2 OCC1CCCNC1 NO22817 [0,1,0,1,0,0|1,0,0]=3 290 B8R1.2 OCC1CCNCC1 NO22819 [0,1,0,1,0,0|2,0,0]=4 291 B8R1.2 OCC1CNCCO1 NO15312 [0,1,0,1,0,0|0,0,0]=2 292 B8R1.2 OC[C@@H]1CNCCO1 NO14518 [0,1,0,1,0,0|0,0,0]=2 293 B8R1.2 OC[C@@H]1COCCN1 DY539919 [0,1,0,1,0,0|0,0,0]=2 294 B8R1.2 OC[C@@H]1COCCN1 NO15269 [0,1,0,1,0,0|0,0,0]=2 295 B8R1.2 OC[C@H]1CCCNC1 NO15958 [0,1,0,1,0,0|1,0,0]=3 296 B8R1.2 OC[C@H]1COCCN1 NO15280 [0,1,0,1,0,0|0,0,0]=2 297 B8R1.5 CC1CNCCC1O DY549411 [0,1,0,1,0,0|1,0,0]=3 298 B8R1.5 C[C@H]1CCNC[C@H]1O DY103745 [0,1,0,1,0,0|1,0,0]=3 299 B8R1.5 N[C@@H]1CCCC[C@@H]1O NO12548 [0,1,0,1,0,0|2,0,0]=4 300 B8R1.5 N[C@@H]1CCCC[C@H]1O DY584529 [0,1,0,1,0,0|2,0,0]=4 301 B8R1.5 N[C@@H]1CCCC[C@H]1O NO12403 [0,1,0,1,0,0|2,0,0]=4 302 B8R1.5 N[C@@H]1CCCC[C@H]1O NO18590 [0,1,0,1,0,0|2,0,0]=4 303 B8R1.5 N[C@@H]1COCC[C@@H]1O DY529857 [0,1,0,1,0,0|2,0,0]=4 304 B8R1.5 N[C@@H]1COCC[C@H]1O DY519045 [0,1,0,1,0,0|2,0,0]=4 305 B8R1.5 N[C@H]1CCCC[C@@H]1O DY20824 [0,1,0,1,0,0|2,0,0]=4 306 B8R1.5 N[C@H]1CCCC[C@@H]1O NO14928 [0,1,0,1,0,0|2,0,0]=4 307 B8R1.5 N[C@H]1CCCC[C@H]1O DY20710 [0,1,0,1,0,0|2,0,0]=4 308 B8R1.5 N[C@H]1CCCC[C@H]1O NO12547 [0,1,0,1,0,0|2,0,0]=4 309 B8R1.5 N[C@H]1CCOC[C@H]1O DY102103 [0,1,0,1,0,0|2,0,0]=4 310 B8R1.5 N[C@H]1CCOC[C@H]1O DY621122 [0,1,0,1,0,0|2,0,0]=4 311 B8R1.5 O=C1NCCCC1O NO19689 [0,1,0,1,0,0|1,0,1]=4 312 B8R1.5 O=C1NCCC[C@H]1O DY541749 [0,1,0,1,0,0|1,0,1]=4 313 B8R1.5 OC1CNCCC1F DY638684 [0,1,0,1,0,0|1,0,0]=3 314 B8R1.5 O[C@@H]1CCCC[C@H]1O NO12029 [0,1,0,1,0,0|1,0,0]=3 315 B8R1.5 O[C@@H]1CCNC[C@H]1O DY116420 [0,1,0,1,0,0|0,0,0]=2 316 B8R1.5 O[C@H]1CCNC[C@H]1F DY586636 [0,1,0,1,0,0|1,0,0]=3 317 B8R1.5 O[C@H]1CNCC[C@H]1F DY621098 [0,1,0,1,0,0|1,0,0]=3 318 B8R1.8 BrCCC1OCCO1 NO18251 [0,1,0,1,0,0|2,0,0]=4 319 B8R1.8 COCC1CCCN1 DY571095 [0,1,0,1,0,0|1,0,0]=3 320 B8R1.8 COC[C@@H]1CCCN1 NO20310 [0,1,0,1,0,0|1,0,0]=3 321 B8R1.8 ClCCN1CCCC1 DY665330 [0,1,0,1,0,0|2,0,0]=4 322 B8R1.8 ClCCN1CCCC1 DY738470 [0,1,0,1,0,0|2,0,0]=4 323 B8R1.8 ClCCN1CCCC1 NO15769 [0,1,0,1,0,0|2,0,0]=4 324 B8R1.8 N#CCC1CCCO1 DY759470 [0,1,0,1,0,0|2,0,0]=4 325 B8R1.8 NCCC1OCCO1 DY758978 [0,1,0,1,0,0|2,0,0]=4 326 B8R1.8 OCCC1CCNC1 DY666359 [0,1,0,1,0,0|2,0,0]=4 327 B8R1.10 NCCOC1COC1 DY732937 [0,1,0,1,0,0|2,0,0]=4 328 B8R1.10 OCCCC1COC1 DY732715 [0,1,0,1,0,0|1,0,0]=3 329 B8R1.11 CN1CCCC1CO NO14186 [0,1,0,1,0,0|1,0,0]=3 330 B8R1.11 CN1CCC[C@H]1CCl DY664952 [0,1,0,1,0,0|2,0,0]=4 331 B8R1.11 CN1CCC[C@H]1CO NO22816 [0,1,0,1,0,0|1,0,0]=3 332 B8R1.11 CO[C@@H]1COC[C@H]1N DY535695 [0,1,0,1,0,0|2,0,0]=4 333 B8R1.11 CO[C@H]1CNC[C@H]1O DY555813 [0,1,0,1,0,0|0,0,0]=2 334 B8R1.11 C[C@@H]1NCC[C@@H]1CO DY664706 [0,1,0,1,0,0|2,0,0]=4 335 B8R1.11 NC[C@H]1COC[C@H]1O DY529311 [0,1,0,1,0,0|2,0,0]=4 336 B8R1.11 NN1CCC[C@H]1CO DY623433 [0,1,0,1,0,0|1,0,0]=3 337 B8R1.22 CC1CCOCCN1 DY685698 [0,1,0,1,0,0|1,0,0]=3 338 B8R1.22 FC1CCCCNC1 DY685529 [0,1,0,1,0,0|2,0,0]=4 339 B8R1.22 NC1CCCCNC1 NO18624 [0,1,0,1,0,0|2,0,0]=4 340 B8R1.22 NC1CNCCOC1 DY770733 [0,1,0,1,0,0|1,0,0]=3 341 B8R1.22 O=C1CCCNCC1 NO19096 [0,1,0,1,0,0|1,0,1]=4 342 B8R1.22 O=C1CCNCCN1 NO18857 [0,1,0,1,0,0|1,0,1]=4 343 B8R1.22 O[C@H]1CCCCNC1 DY625519 [0,1,0,1,0,0|1,0,0]=3 344 B8R1.22 O[C@H]1CCCOCC1 DY770757 [0,1,0,1,0,0|2,0,0]=4 345 B8R1.1 C[C@@H]1CN[C@H](CO)C1 DY620034 [0,1,0,1,0,0|1,0,0]=3 346 B8R1.1 NC[C@@H]1CC[C@@H](O)C1 DY582081 [0,1,0,1,0,0|2,0,0]=4 347 B8R1.1 O=C1CCC(CO)N1 DY564003 [0,1,0,1,0,0|1,0,1]=4 348 B8R1.1 O=C1CC[C@@H](CO)N1 NO13834 [0,1,0,1,0,0|1,0,1]=4 349 B8R1.1 O=C1CC[C@H](CO)N1 NO15562 [0,1,0,1,0,0|1,0,1]=4 350 B8R1.1 OCC1CC(O)CO1 DY759500 [0,1,0,1,0,0|1,0,0]=3 351 B8R1.1 OC[C@@H]1C[C@@H](O)CN1 NO20184 [0,1,0,1,0,0|0,0,0]=2 352 B8R1.1 OC[C@H]1C[C@@H](O)CN1 DY664628 [0,1,0,1,0,0|0,0,0]=2 353 B8R1.3 CC1CCC(O)CC1 DY562059 [0,1,0,1,0,0|2,0,0]=4 354 B8R1.3 C[C@H]1CC[C@@H](O)CN1 DY542115 [0,1,0,1,0,0|1,0,0]=3 355 B8R1.3 C[C@H]1CN[C@H](C)CN1 NO14078 [0,1,0,1,0,0|2,0,0]=4 356 B8R1.3 C[C@H]1CO[C@@H](C)CN1 DY107002 [0,1,0,1,0,0|1,0,0]=3 357 B8R1.3 C[C@H]1CO[C@H](C)CN1 DY620618 [0,1,0,1,0,0|1,0,0]=3 358 B8R1.3 NC1CCC(O)CC1 DY585958 [0,1,0,1,0,0|2,0,0]=4 359 B8R1.3 NC1CCC(O)CC1 NO18581 [0,1,0,1,0,0|2,0,0]=4 360 B8R1.3 N[C@H]1CC[C@@H](O)CC1 NO15381 [0,1,0,1,0,0|2,0,0]=4 361 B8R1.3 N[C@H]1CC[C@H](O)CC1 NO12038 [0,1,0,1,0,0|2,0,0]=4 362 B8R1.3 N[C@H]1CC[C@H](O)CC1 NO18592 [0,1,0,1,0,0|2,0,0]=4 363 B8R1.3 O=C1CC[C@@H](O)CN1 DY502941 [0,1,0,1,0,0|1,0,1]=4 364 B8R1.3 O[C@H]1CC[C@@H](F)CC1 DY585400 [0,1,0,1,0,0|2,0,0]=4 365 B8R1.50 N[C@@H]1CC[C@H](O)[C@@H]1O DY608362 [0,1,0,1,0,0|1,0,0]=3 366 B8R1.52 CC1(CO)CCCO1 DY585353 [0,1,0,1,0,0|1,0,0]=3 367 B8R1.4 CC1CCCN(N)C1 DY774663 [0,1,0,1,0,0|2,0,0]=4 368 B8R1.4 CC1CNCC(C)C1 NO14191 [0,1,0,1,0,0|2,0,0]=4 369 B8R1.4 CC1CNCC(C)N1 NO18625 [0,1,0,1,0,0|2,0,0]=4 370 B8R1.4 CN1CCOC(=O)C1 NO17566 [0,1,0,1,0,0|0,0,2]=4 371 B8R1.4 C[C@@H]1CCC[C@H](O)C1 DY757141 [0,1,0,1,0,0|2,0,0]=4 372 B8R1.4 C[C@H]1CNC[C@@H](C)N1 NO21187 [0,1,0,1,0,0|2,0,0]=4 373 B8R1.4 C[C@H]1CNC[C@@H](C)O1 DY459894 [0,1,0,1,0,0|1,0,0]=3 374 B8R1.4 C[C@H]1CNC[C@H](C)N1 DY103637 [0,1,0,1,0,0|2,0,0]=4 375 B8R1.4 NC1CCCC(O)C1 NO17342 [0,1,0,1,0,0|2,0,0]=4 376 B8R1.4 NC1CCCC(O)C1 NO18558 [0,1,0,1,0,0|2,0,0]=4 377 B8R1.4 NN1CCCC(O)C1 DY775186 [0,1,0,1,0,0|1,0,0]=3 378 B8R1.4 N[C@H]1CCC[C@H](O)C1 DY513927 [0,1,0,1,0,0|2,0,0]=4 379 B8R1.6 NCC[C@H]1C[C@@H](O)C1 DY608447 [0,1,0,1,0,0|2,0,0]=4 380 B8R1.7 CC(N)C1CCCO1 DY580113 [0,1,0,1,0,0|2,0,0]=4 381 B8R1.7 CC(O)C1CCCC1 DY757207 [0,1,0,1,0,0|2,0,0]=4 382 B8R1.7 FC(F)[C@H]1CCCN1 DY621939 [0,1,0,1,0,0|2,0,0]=4 383 B8R1.7 O=C(O)C1CCCN1 NO18287 [0,1,0,1,0,0|1,0,1]=4 384 B8R1.7 O=C(O)C1CCCO1 DY20393 [0,1,0,1,0,0|1,0,1]=4 385 B8R1.7 O=C(O)C1NCCS1 NO16514 [0,1,0,1,0,0|0,1,1]=4 386 B8R1.7 O=C(O)[C@@H]1CCCO1 NO18232 [0,1,0,1,0,0|1,0,1]=4 387 B8R1.7 O=C(O)[C@H]1CCCN1 NO22249 [0,1,0,1,0,0|1,0,1]=4 388 B8R1.7 O=C(O)[C@H]1CCCO1 NO16192 [0,1,0,1,0,0|1,0,1]=4 389 B8R1.19 OC1CCCC1(F)F DY586464 [0,1,0,1,0,0|2,0,0]=4 390 B8R1.34 O=C(O)CN1CCC1 DY719380 [0,1,0,1,0,0|1,0,1]=4 391 B8R1.72 CC1(C)CCCNC1 DY510344 [0,1,0,1,0,0|2,0,0]=4 392 B8R1.72 CC1(C)CNCCN1 NO18507 [0,1,0,1,0,0|2,0,0]=4 393 B8R1.72 FC1(F)CCCNC1 NO21902 [0,1,0,1,0,0|2,0,0]=4 394 B8R1.18 CN1CC(N)C(O)C1 DY586575 [0,1,0,1,0,0|1,0,0]=3 395 B8R1.18 CN1C[C@@H](N)[C@H](O)C1 DY586574 [0,1,0,1,0,0|1,0,0]=3 396 B8R1.18 CN1C[C@@H](N)[C@H](O)C1 DY586576 [0,1,0,1,0,0|1,0,0]=3 397 B8R1.18 CN1C[C@H](N)[C@@H](O)C1 DY586572 [0,1,0,1,0,0|1,0,0]=3 398 B8R1.18 CN1C[C@H](N)[C@H](O)C1 DY538791 [0,1,0,1,0,0|1,0,0]=3 399 B8R1.18 CN1C[C@H](N)[C@H](O)C1 DY586573 [0,1,0,1,0,0|1,0,0]=3 400 B8R1.18 CN1C[C@H](N)[C@H](O)C1 DY586625 [0,1,0,1,0,0|1,0,0]=3 401 B8R1.18 CN1C[C@H](O)[C@H](N)C1 DY586571 [0,1,0,1,0,0|1,0,0]=3 402 B8R2.34 C1CC2CCC1N2 NO10780 [0,0,0,2,0,0|2,0,0]=4 403 B8R2.34 C1C[C@H]2CC1CN2 DY620286 [0,0,0,2,0,0|2,0,0]=4 404 B8R2.34 C1NC2CNC1C2 DY566511 [0,0,0,2,0,0|2,0,0]=4 405 B8R2.34 C1NC2CNC1C2 DY685187 [0,0,0,2,0,0|2,0,0]=4 406 B8R2.34 C1O[C@@H]2CN[C@H]1C2 NO12565 [0,0,0,2,0,0|1,0,0]=3 407 B8R2.34 C1O[C@H]2CN[C@@H]1C2 DY103903 [0,0,0,2,0,0|1,0,0]=3