0 B8R0.6 CCCCNC(=O)CCl NO11766 [0,0,0,0,0,0|2,0,0]=2 1 B8R0.6 CCCCNC(=S)NN DY797331 [0,0,0,0,0,0|3,1,0]=4 2 B8R0.6 NCC(=O)NCCCO DY741271 [0,0,0,0,0,0|3,0,0]=3 3 B7R0.1 BrCCCCCCBr NO20550 [1,0,0,0,0,0|2,0,1]=4 4 B7R0.1 C#CCCCCCC DY740767 [1,0,0,0,0,0|0,0,3]=4 5 B7R0.1 CCCOCCCN DY740653 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.1 ClCCCCCCI DY550149 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.1 FCCCCCCF DY822301 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.1 NCCCCCCN DY740617 [1,0,0,0,0,0|2,0,1]=4 9 B7R0.1 OCCCCCCBr NO14335 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.1 OCCCCCCF DY822293 [1,0,0,0,0,0|2,0,1]=4 11 B7R0.1 SCCCCCCS DY741367 [1,0,0,0,0,0|2,0,1]=4 12 B7R0.3 C#CCCC(=O)OC DY424002 [1,0,0,0,0,0|1,0,2]=4 13 B7R0.3 CCCCC(O)CO DY567525 [1,0,0,0,0,0|1,0,2]=4 14 B7R0.3 CCN(C)CCCO DY604490 [1,0,0,0,0,0|3,0,0]=4 15 B7R0.3 CC\C=C\C(=O)OC DY741019 [1,0,0,0,0,0|1,0,2]=4 16 B7R0.3 COC(=O)CCC#N DY553731 [1,0,0,0,0,0|2,0,1]=4 17 B7R0.3 COC(=O)CCC=O DY21172 [1,0,0,0,0,0|2,0,1]=4 18 B7R0.4 C#CCCCC(=O)O NO14686 [1,0,0,0,0,0|1,0,2]=4 19 B7R0.4 CC(=O)CCCCBr NO10627 [1,0,0,0,0,0|1,0,0]=2 20 B7R0.4 CCCCCB(O)O NO22305 [1,0,0,0,0,0|2,0,1]=4 21 B7R0.4 CCCCCC(=O)Cl DY822275 [1,0,0,0,0,0|1,0,0]=2 22 B7R0.4 CCCCCC(C)O NO21570 [1,0,0,0,0,0|0,0,2]=3 23 B7R0.4 CCCOCC(=O)O DY425744 [1,0,0,0,0,0|2,0,0]=3 24 B7R0.4 CCCSCC(N)=O DY742801 [1,0,0,0,0,0|2,0,0]=3 25 B7R0.4 CN(C)CCCCCl DY551337 [1,0,0,0,0,0|3,0,0]=4 26 B7R0.4 CN(C)CCCCO NO22813 [1,0,0,0,0,0|3,0,0]=4 27 B7R0.4 CNCCCC(=O)O DY702793 [1,0,0,0,0,0|2,0,0]=3 28 B7R0.4 CNCCCN(C)C DY584479 [1,0,0,0,0,0|3,0,0]=4 29 B7R0.4 O=C(Cl)CCCCCl DY460464 [1,0,0,0,0,0|2,0,0]=3 30 B9R0.5 CCCCCC(=O)OCC DY822461 [0,1,0,0,0,0|0,0,0]=1 31 B9R0.5 CCCCNC(=O)CCN DY741211 [0,1,0,0,0,0|1,0,0]=2 32 B9R0.5 CCNCCC(=O)OCC DY703477 [0,1,0,0,0,0|1,0,0]=2 33 B9R0.5 CCOC(=O)CCCCBr NO13726 [0,1,0,0,0,0|1,0,0]=2 34 B9R0.5 CCOC(=O)CCCCN NO14354 [0,1,0,0,0,0|1,0,0]=2 35 B9R0.5 CCO\C=C\C(=O)OCC DY20656 [0,1,0,0,0,0|1,0,2]=4 36 B9R0.24 O=C(CCl)NCC(O)CO DY742681 [0,1,0,0,0,0|3,0,0]=4 37 B9R0.34 CCOC(=O)CC(=O)CBr NO13599 [0,1,0,0,0,0|2,0,1]=4 38 B9R0.34 CCOC(=O)CC(=O)CC NO11391 [0,1,0,0,0,0|1,0,1]=3 39 B9R0.34 COCC(=O)CC(=O)OC DY20562 [0,1,0,0,0,0|2,0,1]=4 40 B9R0.46 COC(=O)CCCCCBr DY523155 [0,1,0,0,0,0|1,0,0]=2 41 B9R0.46 COC(=O)CCCCCN NO11662 [0,1,0,0,0,0|1,0,0]=2 42 B9R0.46 COCCCNC(=O)CN DY741265 [0,1,0,0,0,0|2,0,0]=3 43 B9R0.47 C=C(C)C(=O)NCCCN NO11712 [0,1,0,0,0,0|2,0,1]=4 44 B9R0.47 CCCCOC(=O)C(C)=O DY792807 [0,1,0,0,0,0|1,0,1]=3 45 B9R0.47 CCCCOC(=O)C(C)C DY583197 [0,1,0,0,0,0|1,0,0]=2 46 B9R0.47 CCCCOC(=O)[C@H](C)N NO15628 [0,1,0,0,0,0|1,0,0]=2 47 B9R0.50 CCN(CC)CCCNC DY559701 [0,1,0,0,0,0|3,0,0]=4 48 B9R1.1 CC1CCC(CO)CC1 DY756931 [0,0,0,1,0,0|2,0,1]=4 49 B9R1.1 CCN1CCC(N)CC1 DY557223 [0,0,0,1,0,0|2,0,1]=4 50 B9R1.1 CN1CCC(CBr)CC1 DY585696 [0,0,0,1,0,0|3,0,0]=4 51 B9R1.1 CN1CCC(CN)CC1 NO21766 [0,0,0,1,0,0|3,0,0]=4 52 B9R1.1 CN1CCC(CO)CC1 NO19632 [0,0,0,1,0,0|3,0,0]=4 53 B9R1.1 CNC1CCC(=O)CC1 NO14610 [0,0,0,1,0,0|1,0,0]=2 54 B9R1.1 CNC1CCN(C)CC1 NO18451 [0,0,0,1,0,0|3,0,0]=4 55 B9R1.1 COC1CCC(=O)CC1 NO14437 [0,0,0,1,0,0|1,0,0]=2 56 B9R1.1 COC1CCC(N)CC1 NO13257 [0,0,0,1,0,0|2,0,1]=4 57 B9R1.1 COC1CCC(O)CC1 NO15906 [0,0,0,1,0,0|1,0,2]=4 58 B9R1.1 COC1CCN(N)CC1 DY638744 [0,0,0,1,0,0|3,0,0]=4 59 B9R1.1 NCC1CCC(O)CC1 DY102788 [0,0,0,1,0,0|1,0,2]=4 60 B9R1.2 CCN1CCCC(N)C1 DY634240 [0,0,0,1,0,0|3,0,0]=4 61 B9R1.2 CCN1CCN[C@H](C)C1 DY548511 [0,0,0,1,0,0|3,0,0]=4 62 B9R1.3 CC1C(=O)CCCC1=O NO10132 [0,0,0,1,0,0|1,0,1]=3 63 B9R1.3 CC1C(N)CCCN1C DY632168 [0,0,0,1,0,0|2,0,1]=4 64 B9R1.5 NC1CCCCNC1=O NO15569 [0,0,0,1,0,0|2,0,0]=3 65 B9R1.5 NC1CCCCNC1=O NO15816 [0,0,0,1,0,0|2,0,0]=3 66 B9R1.5 N[C@H]1CCCCNC1=O DY545019 [0,0,0,1,0,0|2,0,0]=3 67 B9R1.5 O=C1NCCCCC1Br DY550035 [0,0,0,1,0,0|2,0,0]=3 68 B9R1.7 CCC[C@H]1COC(=O)C1 DY426027 [0,0,0,1,0,0|1,0,0]=2 69 B9R1.7 NCCC1CCC(=O)N1 DY667478 [0,0,0,1,0,0|2,0,0]=3 70 B9R1.11 COC(=O)C1=CCCC1 NO18911 [0,0,0,1,0,0|1,0,2]=4 71 B9R1.11 COC(=O)C1CCCN1 NO11440 [0,0,0,1,0,0|2,0,0]=3 72 B9R1.11 COC(=O)[C@@H]1CCCN1 NO18447 [0,0,0,1,0,0|2,0,0]=3 73 B9R1.11 COC(=O)[C@@H]1CCCO1 DY576465 [0,0,0,1,0,0|2,0,0]=3 74 B9R1.11 COC(=O)[C@@H]1CSCN1 DY565929 [0,0,0,1,0,0|3,0,0]=4 75 B9R1.11 COC(=O)[C@H]1CCNC1 DY103933 [0,0,0,1,0,0|2,0,0]=3 76 B9R1.11 O=C(CBr)C1CCCO1 DY585542 [0,0,0,1,0,0|2,0,0]=3 77 B9R1.11 O=C(CCl)C1CCCC1 DY822737 [0,0,0,1,0,0|1,0,0]=2 78 B9R1.49 CN1CCCC(=O)CC1 NO13899 [0,0,0,1,0,0|1,0,0]=2 79 B9R1.49 CN1CCCC(O)CC1 DY685139 [0,0,0,1,0,0|1,0,2]=4 80 B9R1.49 CN1CCCC(O)CC1 NO13879 [0,0,0,1,0,0|1,0,2]=4 81 B9R1.49 O=C1CCCC(O)CN1 DY743185 [0,0,0,1,0,0|2,0,0]=3 82 B9R1.50 O=C1CCCCCCN1 NO21316 [0,0,0,1,0,0|1,0,0]=2 83 B9R1.79 CCC(=O)NC1CNC1 DY585826 [0,0,0,1,0,0|2,0,0]=3 84 B9R1.79 COC(=O)NC1CNC1 DY720544 [0,0,0,1,0,0|3,0,0]=4 85 B9R1.80 NNC(=O)CCN1CC1 DY743911 [0,0,0,1,0,0|3,0,0]=4 86 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N DY505035 [0,0,0,1,0,0|2,0,0]=3 87 B9R1.88 COC(=O)[C@H]1C[C@@H]1CO DY573705 [0,0,0,1,0,0|2,0,0]=3 88 B9R1.89 CCN1CCCNCC1 DY584487 [0,0,0,1,0,0|3,0,0]=4 89 B9R1.118 CCC1(N)CCCOC1 DY508382 [0,0,0,1,0,0|2,0,1]=4 90 B9R1.118 CCC1(O)CCCNC1 DY637340 [0,0,0,1,0,0|1,0,2]=4 91 B9R1.118 CC[C@]1(C)CCCNC1 DY603694 [0,0,0,1,0,0|2,0,1]=4 92 B9R1.118 NCC1(N)CCCCC1 DY513231 [0,0,0,1,0,0|2,0,1]=4 93 B9R1.132 CN1C(=O)CCC1CO DY102373 [0,0,0,1,0,0|2,0,0]=3 94 B9R1.132 CN1C(=O)CC[C@@H]1CO DY738224 [0,0,0,1,0,0|2,0,0]=3 95 B6R0.6 C=CCCCCCl DY427568 [2,0,0,0,0,0|1,0,1]=4 96 B6R0.6 C=CCCCCO NO10397 [2,0,0,0,0,0|1,0,1]=4 97 B6R0.6 CCCCON=O DY461106 [2,0,0,0,0,0|2,0,0]=4 98 B6R0.6 CCCCSCC DY740893 [2,0,0,0,0,0|1,0,0]=3 99 B6R0.6 CCCOCCO DY740785 [2,0,0,0,0,0|2,0,0]=4 100 B6R0.6 CNCCCCBr DY741283 [2,0,0,0,0,0|2,0,0]=4 101 B6R0.6 CNCCCCO DY554133 [2,0,0,0,0,0|2,0,0]=4 102 B6R0.6 COCCCCBr NO22933 [2,0,0,0,0,0|2,0,0]=4 103 B6R0.6 COCCCCO DY741295 [2,0,0,0,0,0|2,0,0]=4 104 B6R0.6 COCCCOC DY792147 [2,0,0,0,0,0|2,0,0]=4 105 B6R0.6 ClCCCCCBr DY559653 [2,0,0,0,0,0|2,0,0]=4 106 B6R0.6 FCCCCCBr NO14708 [2,0,0,0,0,0|2,0,0]=4 107 B6R0.6 FCCCCCF DY822300 [2,0,0,0,0,0|2,0,0]=4 108 B6R0.6 NCCCCCN NO19074 [2,0,0,0,0,0|2,0,0]=4 109 B6R0.6 O=CCCCC=O DY822316 [2,0,0,0,0,0|1,0,1]=4 110 B6R0.6 O=CCCCCBr DY510224 [2,0,0,0,0,0|1,0,0]=3 111 B6R0.6 OCCCCCCl NO14778 [2,0,0,0,0,0|2,0,0]=4 112 B6R0.6 OCCCCCF DY822292 [2,0,0,0,0,0|2,0,0]=4 113 B6R0.6 OCCCCCO NO20549 [2,0,0,0,0,0|2,0,0]=4 114 B6R0.1 CCCC(=O)NN NO22544 [2,0,0,0,0,0|2,0,0]=4 115 B6R0.1 CCNC(=O)CN DY461322 [2,0,0,0,0,0|2,0,0]=4 116 B6R0.1 CCOC(=O)CC DY460554 [2,0,0,0,0,0|1,0,0]=3 117 B6R0.1 CCOC(=O)CN DY700831 [2,0,0,0,0,0|2,0,0]=4 118 B6R0.1 CCOC(=O)CN NO15347 [2,0,0,0,0,0|2,0,0]=4 119 B6R0.1 CCOC(=O)CO NO11386 [2,0,0,0,0,0|2,0,0]=4 120 B6R0.1 COC(=O)CCCl DY741043 [2,0,0,0,0,0|2,0,0]=4 121 B6R0.1 COC(=O)CCN NO22266 [2,0,0,0,0,0|2,0,0]=4 122 B6R0.1 COC(=O)CSC DY460536 [2,0,0,0,0,0|2,0,0]=4 123 B6R0.4 CC(=O)CCCBr NO10305 [2,0,0,0,0,0|1,0,0]=3 124 B6R0.4 CC(=O)CCCCl NO10334 [2,0,0,0,0,0|1,0,0]=3 125 B6R0.4 CC(=O)NCCCl DY33011 [2,0,0,0,0,0|2,0,0]=4 126 B6R0.4 CCCCC(C)O DY740779 [2,0,0,0,0,0|0,0,2]=4 127 B6R0.4 CCCC[SiH](C)C DY500283 [2,0,0,0,0,0|1,1,0]=4 128 B6R0.4 CC\C=C\C(C)=O DY822743 [2,0,0,0,0,0|0,0,2]=4 129 B6R0.4 CSCCC(C)=O DY740809 [2,0,0,0,0,0|1,0,0]=3 130 B6R0.4 NCCCC(=O)O NO14998 [2,0,0,0,0,0|2,0,0]=4 131 B6R0.4 O=C(O)CCCBr NO14053 [2,0,0,0,0,0|2,0,0]=4 132 B8R0.4 CCCCCCCCN DY506682 [1,1,0,0,0,0|0,0,1]=3 133 B8R0.4 CCCCCCCCS DY741379 [1,1,0,0,0,0|0,0,1]=3 134 B8R0.4 CCCCNCCCC NO11229 [1,1,0,0,0,0|0,0,1]=3 135 B8R0.4 FCCCCCCCF DY822302 [1,1,0,0,0,0|1,0,1]=4 136 B8R0.4 OCCCCCCCBr NO13415 [1,1,0,0,0,0|1,0,1]=4 137 B8R0.4 OCCCCCCCF DY822294 [1,1,0,0,0,0|1,0,1]=4 138 B8R0.7 CCCCCC[C@H](C)O DY626179 [1,1,0,0,0,0|0,0,1]=3 139 B8R0.3 CCOC(=O)C(=O)CC NO13439 [1,1,0,0,0,0|1,0,1]=4 140 B8R0.8 CNCCC(=O)N(C)C DY606171 [1,1,0,0,0,0|2,0,0]=4 141 B8R0.19 CCC(=O)CC(=O)CC NO22007 [1,1,0,0,0,0|0,0,1]=3 142 B8R0.19 CCC(=O)CC(=O)OC NO18389 [1,1,0,0,0,0|1,0,1]=4 143 B8R0.19 CC[C@@H](O)C[C@H](O)CC DY571299 [1,1,0,0,0,0|0,0,2]=4 144 B8R0.19 CC[C@H](N)CC(=O)OC DY628425 [1,1,0,0,0,0|1,0,0]=3 145 B8R0.19 COC(=O)C[C@@H](O)CCl NO18252 [1,1,0,0,0,0|2,0,0]=4 146 B8R0.19 COC(=O)C[C@H](O)CO DY627328 [1,1,0,0,0,0|2,0,0]=4 147 B8R0.5 COCC(C)OC(C)=O DY822378 [1,1,0,0,0,0|2,0,0]=4 148 B8R0.21 CCCCCS(=O)(=O)[O-] DY445019 [1,1,0,0,0,0|2,0,0]=4 149 B8R0.21 CCCCCS(=O)(=O)[O-] DY445025 [1,1,0,0,0,0|2,0,0]=4 150 B8R0.21 CS(=O)(=O)CCCCN DY116558 [1,1,0,0,0,0|2,0,0]=4 151 B8R0.28 CC(=O)CCC=C(C)C DY506172 [1,1,0,0,0,0|0,0,2]=4 152 B8R0.28 CC(=O)CCCC(=O)O DY547923 [1,1,0,0,0,0|1,0,1]=4 153 B8R0.28 CC(C)CCCC(=O)O DY564243 [1,1,0,0,0,0|1,0,0]=3 154 B8R0.28 CC(C)CCCC(C)N DY822701 [1,1,0,0,0,0|1,0,1]=4 155 B8R0.28 CN(C)CCCC(=O)O NO18615 [1,1,0,0,0,0|2,0,0]=4 156 B10R0.3 CCCC(=O)SCCN(C)C DY584383 [0,2,0,0,0,0|2,0,0]=4 157 B10R0.3 CCOC(=O)CCCC(=O)O DY461244 [0,2,0,0,0,0|1,0,1]=4 158 B10R0.3 CCOC(=O)CCNC(C)C DY461304 [0,2,0,0,0,0|1,0,0]=3 159 B10R0.57 COC(=O)[C@@H](N)CCC(C)C DY625885 [0,2,0,0,0,0|1,0,0]=3 160 B10R0.60 CCC(C)CCCC(C)(C)O DY792507 [0,2,0,0,0,0|1,0,1]=4 161 B10R0.65 CCC(C)(O)CCCC(C)C DY571707 [0,2,0,0,0,0|0,0,2]=4 162 B10R0.1 CCCCCCC(O)CCO DY741139 [0,2,0,0,0,0|0,0,2]=4 163 B10R0.1 CCOC(=O)CCCCCBr DY544671 [0,2,0,0,0,0|0,0,0]=2 164 B10R0.1 CCOC(=O)CNCCC#N DY702199 [0,2,0,0,0,0|1,0,1]=4 165 B10R0.2 CCOC(=N)CC(=O)OCC NO19628 [0,2,0,0,0,0|1,0,1]=4 166 B10R0.2 CCOC(=O)CC(O)CCN DY788463 [0,2,0,0,0,0|1,0,0]=3 167 B10R0.2 CCOC(=O)C[C@@H](O)CC#N DY20928 [0,2,0,0,0,0|1,0,1]=4 168 B10R0.2 CCOC(=O)C[C@H](O)CC#N NO19605 [0,2,0,0,0,0|1,0,1]=4 169 B10R0.6 CC(C)NC(=O)NCCCN DY112536 [0,2,0,0,0,0|2,0,0]=4 170 B10R0.19 CCCCC(=O)C(=O)OCC NO11379 [0,2,0,0,0,0|0,0,1]=3 171 B10R0.19 CCOC(=O)C(N)CCSC DY437954 [0,2,0,0,0,0|1,0,0]=3 172 B10R0.83 COC(=O)[C@H](N)CCCCN DY535029 [0,2,0,0,0,0|1,0,0]=3 173 B10R0.91 C#CCOC(=O)NCCCC DY798021 [0,2,0,0,0,0|1,0,1]=4 174 B10R0.91 CCCCCC(=O)OCCC DY564117 [0,2,0,0,0,0|0,0,0]=2 175 B10R0.91 CCCCCC(=O)\C=C\C=O DY503457 [0,2,0,0,0,0|0,0,2]=4 176 B10R0.91 CCCCCN(C)CCC#N DY740449 [0,2,0,0,0,0|2,0,0]=4 177 B10R0.108 CCCC(=O)OCC(O)CO DY822776 [0,2,0,0,0,0|2,0,0]=4 178 B10R0.124 CCCCC(F)(F)C(=O)OC DY458681 [0,2,0,0,0,0|1,0,0]=3 179 B10R0.55 COC(=O)CCCCC(=O)O NO19614 [0,2,0,0,0,0|1,0,1]=4 180 B10R0.74 CCCCCCCC(=O)NO NO11097 [0,2,0,0,0,0|2,0,0]=4 181 B10R0.74 COC(=O)CCCCCCN NO14288 [0,2,0,0,0,0|1,0,0]=3 182 B10R0.74 COC(=O)CCCCCCO DY524613 [0,2,0,0,0,0|1,0,0]=3 183 B10R0.75 C=C(C)C(=O)OCCOCC DY822660 [0,2,0,0,0,0|1,0,1]=4 184 B8R1.2 BrCC1CCCCC1 NO19887 [1,0,0,1,0,0|1,0,1]=4 185 B8R1.2 BrCC1CCNCC1 DY586644 [1,0,0,1,0,0|2,0,0]=4 186 B8R1.2 BrCC1CCOCC1 DY514587 [1,0,0,1,0,0|2,0,0]=4 187 B8R1.2 CCC1CCNCC1 DY602027 [1,0,0,1,0,0|1,0,0]=3 188 B8R1.2 CCN1CCNCC1 NO20680 [1,0,0,1,0,0|2,0,0]=4 189 B8R1.2 CC[C@@H]1CCCCN1 DY622095 [1,0,0,1,0,0|1,0,1]=4 190 B8R1.2 CC[C@H]1CCCCN1 DY624979 [1,0,0,1,0,0|1,0,1]=4 191 B8R1.2 CNC1CCNCC1 DY512505 [1,0,0,1,0,0|2,0,0]=4 192 B8R1.2 CNC1CCNCC1 DY641666 [1,0,0,1,0,0|2,0,0]=4 193 B8R1.2 CNC1CCOCC1 NO15192 [1,0,0,1,0,0|2,0,0]=4 194 B8R1.2 COC1=CCCCC1 DY789345 [1,0,0,1,0,0|1,0,1]=4 195 B8R1.2 COC1=NCCCC1 DY711079 [1,0,0,1,0,0|2,0,0]=4 196 B8R1.2 ClCC1CCCCC1 DY788085 [1,0,0,1,0,0|1,0,1]=4 197 B8R1.2 NCC1CCCCC1 DY20908 [1,0,0,1,0,0|1,0,1]=4 198 B8R1.2 NCC1CCOCC1 NO18584 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.2 NCC1CCSCC1 DY102976 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.2 OCC1CCCCC1 DY20144 [1,0,0,1,0,0|1,0,1]=4 201 B8R1.2 OCC1CCNCC1 NO22819 [1,0,0,1,0,0|2,0,0]=4 202 B8R1.5 C[C@H]1CCCC[C@H]1N DY540861 [1,0,0,1,0,0|1,0,1]=4 203 B8R1.8 CNCC1CCOC1 DY537651 [1,0,0,1,0,0|2,0,0]=4 204 B8R1.8 CNCC1CCOC1 DY568737 [1,0,0,1,0,0|2,0,0]=4 205 B8R1.8 COC[C@H]1CCNC1 DY522807 [1,0,0,1,0,0|2,0,0]=4 206 B8R1.8 CSCC1CCNC1 DY585729 [1,0,0,1,0,0|2,0,0]=4 207 B8R1.8 OCCC1CCNC1 DY666359 [1,0,0,1,0,0|2,0,0]=4 208 B8R1.11 C[C@@H]1NCC[C@@H]1CO DY664706 [1,0,0,1,0,0|2,0,0]=4 209 B8R1.22 CC1CCOCCN1 DY685698 [1,0,0,1,0,0|2,0,0]=4 210 B8R1.22 O[C@H]1CCCOCC1 DY770757 [1,0,0,1,0,0|2,0,0]=4 211 B8R1.1 CCC1COC(=O)N1 DY607707 [1,0,0,1,0,0|2,0,0]=4 212 B8R1.1 N#C[C@@H]1CCC(=O)C1 DY533241 [1,0,0,1,0,0|1,0,1]=4 213 B8R1.1 NC[C@H]1CNC(=O)C1 DY529623 [1,0,0,1,0,0|2,0,0]=4 214 B8R1.1 O=C1CCC(CO)N1 DY564003 [1,0,0,1,0,0|2,0,0]=4 215 B8R1.1 O=C1CC[C@@H](CO)N1 NO13834 [1,0,0,1,0,0|2,0,0]=4 216 B8R1.1 O=C1CC[C@H](CO)N1 NO15562 [1,0,0,1,0,0|2,0,0]=4 217 B8R1.1 O=C1C[C@H](CF)CO1 DY822230 [1,0,0,1,0,0|2,0,0]=4 218 B8R1.3 CC1CCC(=O)OC1 DY777526 [1,0,0,1,0,0|1,0,0]=3 219 B8R1.3 CC1CCC(O)CC1 DY562059 [1,0,0,1,0,0|0,0,2]=4 220 B8R1.3 CC1CCN(N)CC1 DY535737 [1,0,0,1,0,0|2,0,0]=4 221 B8R1.3 CN1CCC(=O)CC1 DY634332 [1,0,0,1,0,0|1,0,0]=3 222 B8R1.3 CN1CCC(=O)CC1 NO18410 [1,0,0,1,0,0|1,0,0]=3 223 B8R1.3 NC1CCC(=O)CC1 NO22583 [1,0,0,1,0,0|1,0,0]=3 224 B8R1.3 NC1CCC(=O)NC1 DY444382 [1,0,0,1,0,0|2,0,0]=4 225 B8R1.3 O=C1CCC(=O)CC1 NO19236 [1,0,0,1,0,0|1,0,1]=4 226 B8R1.3 O=C1CCC(O)CC1 NO22889 [1,0,0,1,0,0|1,0,0]=3 227 B8R1.3 O=C1CC[C@@H](O)CN1 DY502941 [1,0,0,1,0,0|2,0,0]=4 228 B8R1.38 CCC(=O)C1COC1 DY526161 [1,0,0,1,0,0|1,0,0]=3 229 B8R1.38 CNC(=O)C1CCC1 DY514599 [1,0,0,1,0,0|1,0,0]=3 230 B8R1.38 COC(=O)C1CNC1 NO13402 [1,0,0,1,0,0|2,0,0]=4 231 B8R1.38 COC(=O)[C@@H]1CCN1 DY625939 [1,0,0,1,0,0|2,0,0]=4 232 B8R1.38 COC(=O)[C@H]1CCN1 DY565389 [1,0,0,1,0,0|2,0,0]=4 233 B8R1.38 COC(=O)[C@H]1CCN1 DY627322 [1,0,0,1,0,0|2,0,0]=4 234 B8R1.38 O=C(CBr)C1CCC1 DY742339 [1,0,0,1,0,0|1,0,0]=3 235 B8R1.40 NCC(=O)NC1CC1 DY511215 [1,0,0,1,0,0|2,0,0]=4 236 B8R1.50 CC1C(=O)CCC1=O NO21655 [1,0,0,1,0,0|1,0,1]=4 237 B8R1.52 CCC1(N)CCCC1 DY603592 [1,0,0,1,0,0|1,0,1]=4 238 B8R1.83 COC(=O)C1CC1Br DY430638 [1,0,0,1,0,0|2,0,0]=4 239 B8R1.4 CC1=CC(C)OCC1 DY560031 [1,0,0,1,0,0|2,0,0]=4 240 B8R1.4 CC1CCCN(N)C1 DY774663 [1,0,0,1,0,0|2,0,0]=4 241 B8R1.4 CC1CCNC(=O)N1 DY694421 [1,0,0,1,0,0|2,0,0]=4 242 B8R1.4 CN1CCCC(=O)C1 DY774909 [1,0,0,1,0,0|1,0,0]=3 243 B8R1.4 CN1CCNC(=O)C1 NO13438 [1,0,0,1,0,0|2,0,0]=4 244 B8R1.4 CN1CCOC(=O)C1 NO17566 [1,0,0,1,0,0|2,0,0]=4 245 B8R1.4 C[C@@H]1CC(=O)CCN1 DY586650 [1,0,0,1,0,0|1,0,0]=3 246 B8R1.4 C[C@@H]1CCC[C@H](O)C1 DY757141 [1,0,0,1,0,0|0,0,2]=4 247 B8R1.4 NC1CCNC(=O)C1 NO15459 [1,0,0,1,0,0|2,0,0]=4 248 B8R1.4 O=C1CCCC(=O)C1 NO19094 [1,0,0,1,0,0|1,0,1]=4 249 B8R1.4 O=C1C[C@@H](O)CCN1 DY555969 [1,0,0,1,0,0|2,0,0]=4 250 B8R1.4 O=S1CCCC(Br)C1 DY586414 [1,0,0,1,0,0|2,0,0]=4 251 B8R1.6 CCCC1CC(=O)C1 DY561087 [1,0,0,1,0,0|0,0,0]=2 252 B8R1.7 CC(=O)C1CCCC1 DY445790 [1,0,0,1,0,0|0,0,0]=2 253 B8R1.7 CC(=O)C1CCCC1 NO20673 [1,0,0,1,0,0|0,0,0]=2 254 B8R1.7 CC(=O)C1CCCO1 DY586599 [1,0,0,1,0,0|1,0,0]=3 255 B8R1.7 CC(=O)[C@H]1CCCN1 DY586041 [1,0,0,1,0,0|1,0,0]=3 256 B8R1.7 CC(=O)[C@H]1CCCO1 DY586598 [1,0,0,1,0,0|1,0,0]=3 257 B8R1.7 CC(O)C1CCCC1 DY757207 [1,0,0,1,0,0|0,0,2]=4 258 B8R1.7 N=C(N)C1CCCC1 DY585765 [1,0,0,1,0,0|2,0,0]=4 259 B8R1.7 NC(=O)C1CCCC1 DY794313 [1,0,0,1,0,0|1,0,0]=3 260 B8R1.7 NC(=O)C1CCNC1 DY555753 [1,0,0,1,0,0|2,0,0]=4 261 B8R1.7 NC(=O)C1CCNC1 DY565263 [1,0,0,1,0,0|2,0,0]=4 262 B8R1.7 NC(=O)N1CCCC1 DY717045 [1,0,0,1,0,0|2,0,0]=4 263 B8R1.7 NC(=O)[C@@H]1CCCN1 NO22629 [1,0,0,1,0,0|2,0,0]=4 264 B8R1.7 NC(=O)[C@H]1CCCN1 DY438122 [1,0,0,1,0,0|2,0,0]=4 265 B8R1.7 O=C(O)C1CCCN1 NO18287 [1,0,0,1,0,0|2,0,0]=4 266 B8R1.7 O=C(O)C1CCCO1 DY20393 [1,0,0,1,0,0|2,0,0]=4 267 B8R1.7 O=C(O)C1CCNC1 NO18444 [1,0,0,1,0,0|2,0,0]=4 268 B8R1.7 O=C(O)C1CCNC1 NO19637 [1,0,0,1,0,0|2,0,0]=4 269 B8R1.7 O=C(O)C1CCOC1 DY444586 [1,0,0,1,0,0|2,0,0]=4 270 B8R1.7 O=C(O)[C@@H]1CCCO1 NO18232 [1,0,0,1,0,0|2,0,0]=4 271 B8R1.7 O=C(O)[C@@H]1CCOC1 NO19475 [1,0,0,1,0,0|2,0,0]=4 272 B8R1.7 O=C(O)[C@H]1CCCN1 NO22249 [1,0,0,1,0,0|2,0,0]=4 273 B8R1.7 O=C(O)[C@H]1CCCO1 NO16192 [1,0,0,1,0,0|2,0,0]=4 274 B8R1.7 O=C(O)[C@H]1CCNC1 DY569091 [1,0,0,1,0,0|2,0,0]=4 275 B8R1.34 CC(=O)NC1CNC1 DY502431 [1,0,0,1,0,0|2,0,0]=4 276 B8R1.34 O=C(O)CC1CCC1 NO11177 [1,0,0,1,0,0|1,0,0]=3 277 B8R1.34 O=C(O)CC1CCN1 DY584158 [1,0,0,1,0,0|2,0,0]=4 278 B8R1.34 O=C(O)CN1CCC1 DY719380 [1,0,0,1,0,0|2,0,0]=4 279 B8R1.35 O=C(O)CCC1CC1 NO19562 [1,0,0,1,0,0|1,0,0]=3 280 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O DY586259 [1,0,0,1,0,0|1,0,0]=3 281 B8R1.43 CC[C@H]1C[C@@H]1C(=O)O DY586268 [1,0,0,1,0,0|1,0,0]=3 282 B8R1.72 CC1(Br)CCCCC1 DY584406 [1,0,0,1,0,0|1,0,1]=4 283 B10R1.13 CC(C)N1CCC(=O)CC1 DY559023 [0,1,0,1,0,0|1,0,0]=3 284 B10R1.13 CC1CCC(C(C)C)CC1 DY822415 [0,1,0,1,0,0|1,0,1]=4 285 B10R1.13 CC1CCC(C(C)C)CC1 DY822416 [0,1,0,1,0,0|1,0,1]=4 286 B10R1.14 COC(=O)C1CCC(N)C1 NO17586 [0,1,0,1,0,0|1,0,0]=3 287 B10R1.14 COC(=O)C1CNC(C)C1 DY520101 [0,1,0,1,0,0|2,0,0]=4 288 B10R1.14 COC(=O)N1CCC(N)C1 DY585745 [0,1,0,1,0,0|2,0,0]=4 289 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 DY104918 [0,1,0,1,0,0|1,0,1]=4 290 B10R1.14 COC(=O)[C@@H]1C[C@@H](O)CN1 NO18459 [0,1,0,1,0,0|2,0,0]=4 291 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 DY586640 [0,1,0,1,0,0|2,0,0]=4 292 B10R1.14 COC(=O)[C@@H]1C[C@H](O)CN1 NO11437 [0,1,0,1,0,0|2,0,0]=4 293 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 DY586646 [0,1,0,1,0,0|2,0,0]=4 294 B10R1.54 CC(C)C[C@H]1CCC(=O)N1 DY513969 [0,1,0,1,0,0|1,0,0]=3 295 B10R1.150 COC(=O)CC1CC(=O)C1 NO15796 [0,1,0,1,0,0|1,0,1]=4 296 B10R1.150 COC(=O)C[C@H]1C[C@@H](O)C1 DY507950 [0,1,0,1,0,0|1,0,0]=3 297 B10R1.153 CNC(=O)\C=C\CC1CC1 DY757765 [0,1,0,1,0,0|1,0,1]=4 298 B10R1.416 COC(=O)C1NCC1(C)C DY719434 [0,1,0,1,0,0|2,0,0]=4 299 B10R1.11 CCOC(=O)C1CC=CC1 DY540813 [0,1,0,1,0,0|0,0,2]=4 300 B10R1.11 CCOC(=O)C1CCNC1 NO13485 [0,1,0,1,0,0|1,0,0]=3 301 B10R1.11 CCOC(=O)[C@@H]1CCNC1 DY533325 [0,1,0,1,0,0|1,0,0]=3 302 B10R1.11 CCOC(=O)[C@@H]1CCNC1 DY628887 [0,1,0,1,0,0|1,0,0]=3 303 B10R1.19 CNC1CCCCNC1=O DY685481 [0,1,0,1,0,0|1,0,0]=3 304 B10R1.19 COC1CCCCCC1N DY585651 [0,1,0,1,0,0|1,0,1]=4 305 B10R1.25 CCC1CNC(=O)CC1O DY639106 [0,1,0,1,0,0|1,0,0]=3 306 B10R1.29 CCCCN1CCCC1=O DY550161 [0,1,0,1,0,0|1,0,0]=3 307 B10R1.130 CCO[C@H]1OC(=O)C[C@@H]1N DY621266 [0,1,0,1,0,0|2,0,0]=4 308 B10R1.135 CCOC(=O)C1CC1CBr DY116546 [0,1,0,1,0,0|1,0,0]=3 309 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CC DY586270 [0,1,0,1,0,0|0,0,0]=2 310 B10R1.137 CCOC(=O)CC1CSC1 DY529545 [0,1,0,1,0,0|1,0,0]=3 311 B10R1.137 COCC(=O)NC1CNC1 DY585825 [0,1,0,1,0,0|2,0,0]=4 312 B10R1.138 CCOC(=O)CNC1CC1 DY703555 [0,1,0,1,0,0|1,0,0]=3 313 B10R1.138 CCOC(=O)\C=C\C1CC1 DY608344 [0,1,0,1,0,0|0,0,2]=4 314 B10R1.186 CCCCOC(=O)C1CN1 DY743875 [0,1,0,1,0,0|1,0,0]=3 315 B10R1.245 CC1CCNC(=O)C1CN DY637076 [0,1,0,1,0,0|1,0,0]=3 316 B10R1.406 CC1CC(=O)N1CCCO DY719800 [0,1,0,1,0,0|2,0,0]=4 317 B10R1.15 CCC(=O)N1CCSCC1 DY518595 [0,1,0,1,0,0|1,0,0]=3 318 B10R1.15 CC[C@H](N)C1CCCCC1 NO18551 [0,1,0,1,0,0|1,0,1]=4 319 B10R1.15 CNC(=O)[C@H]1CCCNC1 DY507119 [0,1,0,1,0,0|1,0,0]=3 320 B10R1.15 COC(=O)C1CCCCC1 NO22810 [0,1,0,1,0,0|1,0,0]=3 321 B10R1.15 COC(=O)C1CCCCN1 NO14321 [0,1,0,1,0,0|1,0,0]=3 322 B10R1.15 COC(=O)C1CCCNC1 NO19621 [0,1,0,1,0,0|1,0,0]=3 323 B10R1.15 COC(=O)C1CCOCC1 NO13506 [0,1,0,1,0,0|1,0,0]=3 324 B10R1.15 COC(=O)C1CNCCN1 DY512679 [0,1,0,1,0,0|2,0,0]=4 325 B10R1.15 COC(=O)C1CNCCO1 NO15369 [0,1,0,1,0,0|2,0,0]=4 326 B10R1.15 COC(=O)[C@@H]1CCCCN1 NO19623 [0,1,0,1,0,0|1,0,0]=3 327 B10R1.15 COC(=O)[C@@H]1COCCN1 DY569763 [0,1,0,1,0,0|2,0,0]=4 328 B10R1.15 COC(=O)[C@H]1CCCCN1 NO19622 [0,1,0,1,0,0|1,0,0]=3 329 B10R1.15 COC(=O)[C@H]1CCCNC1 NO15320 [0,1,0,1,0,0|1,0,0]=3 330 B10R1.15 NCC(=O)N1CCOCC1 DY732463 [0,1,0,1,0,0|2,0,0]=4 331 B10R1.15 O=C(CCl)N1CCOCC1 NO22432 [0,1,0,1,0,0|2,0,0]=4 332 B10R1.99 CCCN1CC1C(=O)OC DY743857 [0,1,0,1,0,0|1,0,0]=3 333 B10R1.99 CCON1CC1C(=O)OC DY743917 [0,1,0,1,0,0|2,0,0]=4 334 B10R1.159 CC[C@@H]1C[C@@]1(N)C(=O)OC DY620304 [0,1,0,1,0,0|1,0,0]=3 335 B10R1.169 COC(=O)[C@H]1C[C@@H](CN)C1 DY532563 [0,1,0,1,0,0|2,0,0]=4 336 B10R1.169 COC(=O)[C@H]1C[C@H](OC)C1 DY585667 [0,1,0,1,0,0|2,0,0]=4 337 B10R1.176 CCC1CN(C)C(=O)CN1 DY500199 [0,1,0,1,0,0|2,0,0]=4 338 B10R1.275 CN1CCCCC(Br)C1=O DY743569 [0,1,0,1,0,0|1,0,0]=3 339 B10R1.275 CN1CCCCC(N)C1=O DY585331 [0,1,0,1,0,0|1,0,0]=3 340 B10R1.275 CN1CCCC[C@H](N)C1=O DY625165 [0,1,0,1,0,0|1,0,0]=3 341 B10R1.411 CNC(=O)C1(N)CCCC1 DY585776 [0,1,0,1,0,0|1,0,0]=3 342 B10R1.411 COC(=O)C1(C)CCOC1 DY104210 [0,1,0,1,0,0|2,0,0]=4 343 B10R1.411 COC(=O)C1(N)CCCC1 NO15228 [0,1,0,1,0,0|1,0,0]=3 344 B10R1.411 COC(=O)C1(N)CCOC1 DY509510 [0,1,0,1,0,0|2,0,0]=4 345 B10R1.411 COC(=O)C1(N)CCSC1 DY585552 [0,1,0,1,0,0|2,0,0]=4 346 B10R1.95 CCNC1CCS(=O)(=O)C1 DY602767 [0,1,0,1,0,0|2,0,0]=4 347 B10R1.27 COC(=O)CC1CCCC1 DY455676 [0,1,0,1,0,0|1,0,0]=3 348 B10R1.27 COC(=O)C[C@@H]1CCCN1 NO16363 [0,1,0,1,0,0|1,0,0]=3 349 B10R1.27 NCC(=O)NC1CCCC1 DY585768 [0,1,0,1,0,0|1,0,0]=3 350 B10R1.134 COC(=O)CC(=O)C1CC1 NO18976 [0,1,0,1,0,0|1,0,1]=4 351 B10R1.149 COC(=O)[C@@H]1CCCN1C DY628401 [0,1,0,1,0,0|1,0,0]=3 352 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N DY585601 [0,1,0,1,0,0|1,0,0]=3 353 B10R1.149 COC(=O)[C@@H]1CCC[C@H]1N DY620118 [0,1,0,1,0,0|1,0,0]=3 354 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C DY585383 [0,1,0,1,0,0|1,0,0]=3 355 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O DY534423 [0,1,0,1,0,0|2,0,0]=4 356 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N DY620346 [0,1,0,1,0,0|1,0,0]=3 357 B10R1.1 CCCC1CCC(N)CC1 DY685650 [0,1,0,1,0,0|1,0,1]=4 358 B10R1.1 CCCC1CCC(O)CN1 DY639396 [0,1,0,1,0,0|0,0,2]=4 359 B10R1.1 CCCN1CC=C(Br)CC1 DY458159 [0,1,0,1,0,0|1,0,1]=4 360 B10R1.1 CCCN1CCC(=O)CC1 DY543021 [0,1,0,1,0,0|0,0,0]=2 361 B10R1.1 COC[C@H]1CC[C@H](N)CC1 DY103330 [0,1,0,1,0,0|1,0,1]=4 362 B10R1.2 CCN1CCC[C@@H](O)C1=O DY586207 [0,1,0,1,0,0|2,0,0]=4 363 B10R1.175 COC(=O)C1CCC1C#N DY548823 [0,1,0,1,0,0|1,0,1]=4 364 B10R1.23 CN(C)C(=O)[C@H]1CCCN1 DY560829 [0,1,0,1,0,0|2,0,0]=4 365 B10R1.23 CN(C)C(=O)[C@H]1CCCN1 DY608478 [0,1,0,1,0,0|2,0,0]=4 366 B10R1.348 CC(C)C1CCCCCN1 DY743413 [0,1,0,1,0,0|1,0,1]=4 367 B10R2.178 O=C1NCC2CCC1N2 DY105362 [0,0,0,2,0,0|2,0,0]=4 368 B10R2.14 O=C1CC[C@@H](C2CC2)N1 DY586260 [0,0,0,2,0,0|1,0,0]=3 369 B10R2.32 N[C@H]1CC[C@@H]2CCC[C@H]12 DY606861 [0,0,0,2,0,0|1,0,1]=4 370 B10R2.32 O=C1CCC2CNCC12 DY686041 [0,0,0,2,0,0|1,0,0]=3 371 B10R2.332 O=C1CC2(CNC2)CN1 NO17396 [0,0,0,2,0,0|2,0,0]=4 372 B10R2.332 O=C1CCC2(CNC2)N1 DY529329 [0,0,0,2,0,0|2,0,0]=4 373 B10R2.320 O=C1NC2CCCCC12 DY685758 [0,0,0,2,0,0|1,0,0]=3 374 B10R2.320 O=C1N[C@@H]2CCCC[C@H]12 DY741919 [0,0,0,2,0,0|1,0,0]=3