0 B8R0.6 CNCCCC(=O)OC H-8710 [0,0,0,0,0,0|1,0,0]=1 1 B8R0.6 COC(=O)CCCCN P38983 [0,0,0,0,0,0|1,0,0]=1 2 B7R0.1 COCCOCCN P38878 [1,0,0,0,0,0|2,0,1]=4 3 B7R0.3 CCCNC(=O)CN P36648 [1,0,0,0,0,0|3,0,0]=4 4 B7R0.3 CC\C=C\C(=O)OC Q70108 [1,0,0,0,0,0|0,0,2]=3 5 B7R0.3 CNC(=O)CCCN P40550 [1,0,0,0,0,0|2,0,0]=3 6 B7R0.3 CNCCC(=O)NC P37767 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.3 CNCCC(=O)OC P36826 [1,0,0,0,0,0|1,0,0]=2 8 B7R0.3 COC(=O)CN=[N+]=[N-] P40367 [1,0,0,0,0,0|3,0,0]=4 9 B7R0.4 C#CCNCC(=O)O L20673 [1,0,0,0,0,0|1,0,2]=4 10 B7R0.4 C#CCOCC(=O)O O29707 [1,0,0,0,0,0|1,0,2]=4 11 B7R0.4 C=CCOCC(=O)O P39548 [1,0,0,0,0,0|1,0,2]=4 12 B7R0.4 CC(=O)NCCCN P38199 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.4 CNCCNC(C)=O P41559 [1,0,0,0,0,0|2,0,0]=3 14 B7R0.4 COCCCC(=O)O P39031 [1,0,0,0,0,0|1,0,0]=2 15 B7R0.4 NCCNCC(=O)O O28634 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.4 NCCOCC(=O)O P35961 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.4 [N-]=[N+]=NCCC(=O)O 10071 [1,0,0,0,0,0|3,0,0]=4 18 B9R0.5 CCCCCC(O)CCO O28430 [0,1,0,0,0,0|1,0,2]=4 19 B9R0.5 CCCCCN(C)CCO Q66064 [0,1,0,0,0,0|3,0,0]=4 20 B9R0.5 CCCCNC(=O)CC#N P38337 [0,1,0,0,0,0|2,0,1]=4 21 B9R0.8 CCCCC(N)C(=O)OC M23165 [0,1,0,0,0,0|0,0,0]=1 22 B9R0.46 CCOCCOC(=O)CCl O30319 [0,1,0,0,0,0|3,0,0]=4 23 B9R0.46 COC(=O)CCCN=[N+]=[N-] P35568 [0,1,0,0,0,0|2,0,0]=3 24 B9R1.1 C#CC1CCC(=O)CC1 Q53472 [0,0,0,1,0,0|1,0,2]=4 25 B9R1.1 CCC1CCC(Br)CC1 Q59703 [0,0,0,1,0,0|2,0,1]=4 26 B9R1.1 CNC1CCC(=O)CC1 P41929 [0,0,0,1,0,0|2,0,0]=3 27 B9R1.1 CNC1CCS(=O)CC1 Q57925 [0,0,0,1,0,0|3,0,0]=4 28 B9R1.1 CNC1CCS(=O)CC1 Q57926 [0,0,0,1,0,0|3,0,0]=4 29 B9R1.1 COC1CCC(=O)CC1 P34719 [0,0,0,1,0,0|2,0,0]=3 30 B9R1.1 N#CC1CCC(=O)CC1 O33986 [0,0,0,1,0,0|2,0,1]=4 31 B9R1.1 NCC1CCC(=O)NC1 F-4482 [0,0,0,1,0,0|2,0,0]=3 32 B9R1.1 O=C1CCC(CBr)CN1 L20956 [0,0,0,1,0,0|2,0,0]=3 33 B9R1.1 O=C1CCC(CO)CC1 O32541 [0,0,0,1,0,0|2,0,0]=3 34 B9R1.1 O=C1CCC(CO)CN1 H-8442 [0,0,0,1,0,0|2,0,0]=3 35 B9R1.1 O=C1CO[C@@H](CO)CN1 Q65251 [0,0,0,1,0,0|3,0,0]=4 36 B9R1.1 O=C1CO[C@H](CO)CN1 Q65252 [0,0,0,1,0,0|3,0,0]=4 37 B9R1.2 COC1CCCC(O)C1 L21478 [0,0,0,1,0,0|2,0,1]=4 38 B9R1.2 CO[C@@H]1CCC[C@@H](N)C1 P49873 [0,0,0,1,0,0|2,0,1]=4 39 B9R1.2 CO[C@@H]1CCC[C@@H](O)C1 P46941 [0,0,0,1,0,0|2,0,1]=4 40 B9R1.2 CO[C@@H]1CCC[C@H](O)C1 P46930 [0,0,0,1,0,0|2,0,1]=4 41 B9R1.2 CO[C@@H]1CCC[C@H](O)C1 P47713 [0,0,0,1,0,0|2,0,1]=4 42 B9R1.2 CO[C@@H]1CCN[C@H](C)C1 K10846 [0,0,0,1,0,0|2,0,1]=4 43 B9R1.2 CO[C@H]1CCC[C@@H](O)C1 P46929 [0,0,0,1,0,0|2,0,1]=4 44 B9R1.2 CO[C@H]1CCC[C@H](O)C1 P45107 [0,0,0,1,0,0|2,0,1]=4 45 B9R1.2 CO[C@H]1CCC[C@H](O)C1 P46656 [0,0,0,1,0,0|2,0,1]=4 46 B9R1.2 CO[C@H]1CCN[C@@H](C)C1 K10845 [0,0,0,1,0,0|2,0,1]=4 47 B9R1.2 CO[C@H]1CCN[C@H](C)C1 Q61363 [0,0,0,1,0,0|2,0,1]=4 48 B9R1.3 CC1CCCC(=O)C1C Q59611 [0,0,0,1,0,0|1,0,0]=2 49 B9R1.3 C[C@@H]1CNCC(=O)N1C K13421 [0,0,0,1,0,0|2,0,0]=3 50 B9R1.3 O=C1CCCC(Br)C1=O P45897 [0,0,0,1,0,0|3,0,0]=4 51 B9R1.5 CN1CCCNCC1=O G-7681 [0,0,0,1,0,0|2,0,0]=3 52 B9R1.5 CN1CCCNCC1=O O34334 [0,0,0,1,0,0|2,0,0]=3 53 B9R1.5 N[C@@H]1CCCCNC1=O O34511 [0,0,0,1,0,0|3,0,0]=4 54 B9R1.5 N[C@H]1CCCCNC1=O F-4004 [0,0,0,1,0,0|3,0,0]=4 55 B9R1.5 N[C@H]1CCCCNC1=O O34512 [0,0,0,1,0,0|3,0,0]=4 56 B9R1.11 C#CC(=O)N1CCCC1 L19199 [0,0,0,1,0,0|2,0,1]=4 57 B9R1.11 CNC(=O)C1CCCN1 O28788 [0,0,0,1,0,0|2,0,0]=3 58 B9R1.11 CNC(=O)C1CCNC1 O28288 [0,0,0,1,0,0|2,0,0]=3 59 B9R1.11 CNC(=O)[C@@H]1CCCN1 P38764 [0,0,0,1,0,0|2,0,0]=3 60 B9R1.11 CNC(=O)[C@H]1CCCN1 O28766 [0,0,0,1,0,0|2,0,0]=3 61 B9R1.11 COC(=O)C1CCNC1 G-5251 [0,0,0,1,0,0|1,0,0]=2 62 B9R1.11 COC(=O)C1CCOC1 G-5350 [0,0,0,1,0,0|1,0,0]=2 63 B9R1.11 COC(=O)[C@@H]1CCNC1 G-5253 [0,0,0,1,0,0|1,0,0]=2 64 B9R1.11 COC(=O)[C@@H]1CCNC1 L13624 [0,0,0,1,0,0|1,0,0]=2 65 B9R1.11 COC(=O)[C@@H]1CCOC1 I-9185 [0,0,0,1,0,0|1,0,0]=2 66 B9R1.11 COC(=O)[C@H]1CCNC1 G-5252 [0,0,0,1,0,0|1,0,0]=2 67 B9R1.11 COC(=O)[C@H]1CCNC1 G-6750 [0,0,0,1,0,0|1,0,0]=2 68 B9R1.11 COC(=O)[C@H]1CCOC1 L18447 [0,0,0,1,0,0|1,0,0]=2 69 B9R1.11 NCC(=O)C1CCCC1 L19802 [0,0,0,1,0,0|2,0,0]=3 70 B9R1.11 NCC(=O)N1CCCC1 10067 [0,0,0,1,0,0|3,0,0]=4 71 B9R1.11 NCC(=O)N1CCCC1 P38567 [0,0,0,1,0,0|3,0,0]=4 72 B9R1.11 O=C(NO)C1CCCN1 Q59359 [0,0,0,1,0,0|3,0,0]=4 73 B9R1.49 CN1CCNC(=O)CC1 O34314 [0,0,0,1,0,0|3,0,0]=4 74 B9R1.79 CCC(=O)NC1CNC1 P47079 [0,0,0,1,0,0|3,0,0]=4 75 B9R1.79 CNC(=O)NC1CNC1 P47041 [0,0,0,1,0,0|3,0,0]=4 76 B9R1.79 CNC(=O)NC1CNC1 P49948 [0,0,0,1,0,0|3,0,0]=4 77 B9R1.79 CNC(=O)OC1CNC1 P49999 [0,0,0,1,0,0|3,0,0]=4 78 B9R1.79 COC(=O)C=C1CCC1 P48215 [0,0,0,1,0,0|0,0,2]=3 79 B9R1.79 COC(=O)C=C1CNC1 P48502 [0,0,0,1,0,0|1,0,2]=4 80 B9R1.79 COC(=O)C=C1COC1 C-2214 [0,0,0,1,0,0|1,0,2]=4 81 B9R1.79 COC(=O)CC1CCC1 O28770 [0,0,0,1,0,0|0,0,0]=1 82 B9R1.79 COC(=O)CC1CNC1 C-3312 [0,0,0,1,0,0|1,0,0]=2 83 B9R1.79 COC(=O)CC1CNC1 C-3312-1 [0,0,0,1,0,0|1,0,0]=2 84 B9R1.79 COC(=O)CC1CNC1 P34702 [0,0,0,1,0,0|1,0,0]=2 85 B9R1.79 COC(=O)CC1COC1 G-5284 [0,0,0,1,0,0|1,0,0]=2 86 B9R1.79 COC(=O)NC1CNC1 P47019 [0,0,0,1,0,0|2,0,0]=3 87 B9R1.79 COC(=O)NC1CNC1 P48973 [0,0,0,1,0,0|2,0,0]=3 88 B9R1.79 O=C(CBr)CC1CCC1 P47346 [0,0,0,1,0,0|2,0,0]=3 89 B9R1.80 COC(=O)CNC1CC1 L20586 [0,0,0,1,0,0|1,0,0]=2 90 B9R1.80 COC(=O)CNC1CC1 P36966 [0,0,0,1,0,0|1,0,0]=2 91 B9R1.80 COC(=O)\C=C\C1CC1 O29404 [0,0,0,1,0,0|0,0,2]=3 92 B9R1.80 O=C(CCl)NCC1CC1 M23153 [0,0,0,1,0,0|3,0,0]=4 93 B9R1.81 COC(=O)C1CCC1N P48812 [0,0,0,1,0,0|1,0,0]=2 94 B9R1.81 COC(=O)C1CCN1C P45741 [0,0,0,1,0,0|1,0,0]=2 95 B9R1.81 COC(=O)C1CNC1C L14496 [0,0,0,1,0,0|1,0,0]=2 96 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N F-4529 [0,0,0,1,0,0|1,0,0]=2 97 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N G-6951 [0,0,0,1,0,0|1,0,0]=2 98 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N K12006 [0,0,0,1,0,0|1,0,0]=2 99 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N P48655 [0,0,0,1,0,0|1,0,0]=2 100 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N P50299 [0,0,0,1,0,0|1,0,0]=2 101 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N P47008 [0,0,0,1,0,0|1,0,0]=2 102 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N Q56097 [0,0,0,1,0,0|1,0,0]=2 103 B9R1.81 COC(=O)[C@@H]1CN[C@H]1C P50301 [0,0,0,1,0,0|1,0,0]=2 104 B9R1.81 COC(=O)[C@H]1CC[C@H]1N P48086 [0,0,0,1,0,0|1,0,0]=2 105 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Q52809 [0,0,0,1,0,0|1,0,0]=2 106 B9R1.88 COC(=O)C1CC1CN I-9340 [0,0,0,1,0,0|1,0,0]=2 107 B9R1.88 COC(=O)[C@H]1C[C@@H]1CO Q54349 [0,0,0,1,0,0|1,0,0]=2 108 B9R1.89 COC1CCCNCC1 C-2753 [0,0,0,1,0,0|2,0,1]=4 109 B9R1.89 COC1CCCNCC1 C-2753-1 [0,0,0,1,0,0|2,0,1]=4 110 B9R1.118 CCC1(N)CCCCC1 Q59746 [0,0,0,1,0,0|2,0,1]=4 111 B9R1.118 COC1(C)CCNCC1 O28390 [0,0,0,1,0,0|2,0,1]=4 112 B9R1.132 CN1C(=O)CCC1CBr L20735 [0,0,0,1,0,0|2,0,0]=3 113 B9R1.132 CN1C(=O)CCC1CO M23749 [0,0,0,1,0,0|2,0,0]=3 114 B9R1.132 CN1C(=O)CC[C@@H]1CN Q64631 [0,0,0,1,0,0|2,0,0]=3 115 B9R1.132 CN1C(=O)CC[C@@H]1CO Q64630 [0,0,0,1,0,0|2,0,0]=3 116 B9R1.132 CN1C(=O)CC[C@H]1CO Q64629 [0,0,0,1,0,0|2,0,0]=3 117 B6R0.6 CNCCCCN L19491 [2,0,0,0,0,0|2,0,0]=4 118 B6R0.6 CNCCCOC P37437 [2,0,0,0,0,0|1,0,0]=3 119 B6R0.6 COCCCCN O29739 [2,0,0,0,0,0|1,0,0]=3 120 B6R0.1 CCNC(=O)NC M15284 [2,0,0,0,0,0|2,0,0]=4 121 B6R0.1 CNC(=O)CCCl P38167 [2,0,0,0,0,0|2,0,0]=4 122 B6R0.1 CNC(=O)CCN P37692 [2,0,0,0,0,0|2,0,0]=4 123 B6R0.1 CNCC(=O)NC P37691 [2,0,0,0,0,0|2,0,0]=4 124 B6R0.1 CNCC(=O)NC P38046 [2,0,0,0,0,0|2,0,0]=4 125 B6R0.4 CCNCC(=O)O P37534 [2,0,0,0,0,0|1,0,0]=3 126 B6R0.4 CCNCC(N)=O P36580 [2,0,0,0,0,0|2,0,0]=4 127 B6R0.4 CNCCC(=O)O P36779 [2,0,0,0,0,0|1,0,0]=3 128 B6R0.4 CNCCC(=O)O P39205 [2,0,0,0,0,0|1,0,0]=3 129 B6R0.4 CNCCC(N)=O P37896 [2,0,0,0,0,0|2,0,0]=4 130 B8R0.3 C#CC[C@@H](N)C(=O)OC Q65834 [1,1,0,0,0,0|0,0,2]=4 131 B8R0.3 C#CC[C@H](N)C(=O)OC P40730 [1,1,0,0,0,0|0,0,2]=4 132 B8R0.3 CCCC(N)C(=O)OC P43113 [1,1,0,0,0,0|0,0,0]=2 133 B8R0.8 CNCCC(=O)N(C)C P40566 [1,1,0,0,0,0|2,0,0]=4 134 B8R0.9 COC(=O)CNC(C)=O P42621 [1,1,0,0,0,0|1,0,1]=4 135 B8R0.5 C=CC[C@@H](N)CC(=O)O Q69101 [1,1,0,0,0,0|0,0,2]=4 136 B8R0.5 CCCC(=O)CC(C)=O O29704 [1,1,0,0,0,0|0,0,1]=3 137 B8R0.5 COCC(O)CC(=O)O F-4460 [1,1,0,0,0,0|1,0,0]=3 138 B8R0.21 CCCCCS(N)(=O)=O P44483 [1,1,0,0,0,0|1,0,1]=4 139 B8R0.28 CC(=O)\C=C\CC(C)C O31440 [1,1,0,0,0,0|0,0,2]=4 140 B8R0.28 CC(C)CNCC(=O)O P38861 [1,1,0,0,0,0|1,0,0]=3 141 B10R0.3 CCOC(=O)CCCC(C)=O K13405 [0,2,0,0,0,0|0,0,1]=3 142 B10R0.44 COC(=O)C[C@@H](N)CC(C)C Q68971 [0,2,0,0,0,0|0,0,0]=2 143 B10R0.1 CCOC(=O)CCCN=[N+]=[N-] P37717 [0,2,0,0,0,0|2,0,0]=4 144 B10R0.1 CCOC(=O)CNCCC#N P51415 [0,2,0,0,0,0|1,0,1]=4 145 B10R0.2 CCOC(=O)CC(=O)COC P36738 [0,2,0,0,0,0|1,0,1]=4 146 B10R0.108 CCOC(=O)CCC(=O)CBr O30317 [0,2,0,0,0,0|1,0,1]=4 147 B10R0.74 COC(=O)CCCCCCBr P37550 [0,2,0,0,0,0|0,0,0]=2 148 B10R0.74 COC(=O)CCCCCCN P40404 [0,2,0,0,0,0|0,0,0]=2 149 B10R0.74 COC(=O)CCCCN=[N+]=[N-] P41832 [0,2,0,0,0,0|1,0,0]=3 150 B8R1.2 BrCC1CCCOC1 G-6343 [1,0,0,1,0,0|1,0,1]=4 151 B8R1.2 BrC[C@@H]1CCCOC1 Q62734 [1,0,0,1,0,0|1,0,1]=4 152 B8R1.2 BrC[C@H]1CCCOC1 Q62735 [1,0,0,1,0,0|1,0,1]=4 153 B8R1.2 CCC1CCNCC1 P41021 [1,0,0,1,0,0|2,0,0]=4 154 B8R1.2 CCC1COCCN1 B-1066 [1,0,0,1,0,0|1,0,1]=4 155 B8R1.2 CC[C@@H]1CCCNC1 Q61422 [1,0,0,1,0,0|1,0,1]=4 156 B8R1.2 CC[C@@H]1COCCN1 B-1064 [1,0,0,1,0,0|1,0,1]=4 157 B8R1.2 CC[C@H]1CCCNC1 Q61421 [1,0,0,1,0,0|1,0,1]=4 158 B8R1.2 CC[C@H]1COCCN1 B-1065 [1,0,0,1,0,0|1,0,1]=4 159 B8R1.2 CN[C@@H]1CCCOC1 Q55431 [1,0,0,1,0,0|1,0,1]=4 160 B8R1.2 CN[C@H]1CCCOC1 Q55432 [1,0,0,1,0,0|1,0,1]=4 161 B8R1.2 COC1=CCOCC1 G-7495 [1,0,0,1,0,0|1,0,1]=4 162 B8R1.2 COC1CCCNC1 C-3504 [1,0,0,1,0,0|1,0,1]=4 163 B8R1.2 COC1CCCNC1 M22805 [1,0,0,1,0,0|1,0,1]=4 164 B8R1.2 COC1CCNCC1 C-2394 [1,0,0,1,0,0|1,0,1]=4 165 B8R1.2 COC1CCNCC1 C-3203 [1,0,0,1,0,0|1,0,1]=4 166 B8R1.2 CON1CCNCC1 H-8599 [1,0,0,1,0,0|2,0,0]=4 167 B8R1.2 CO[C@@H]1CCCNC1 G-7538 [1,0,0,1,0,0|1,0,1]=4 168 B8R1.2 CO[C@@H]1CCCNC1 L13637 [1,0,0,1,0,0|1,0,1]=4 169 B8R1.2 CO[C@H]1CCCNC1 G-5239 [1,0,0,1,0,0|1,0,1]=4 170 B8R1.2 CO[C@H]1CCCNC1 L21633 [1,0,0,1,0,0|1,0,1]=4 171 B8R1.2 NCC1CC=CCC1 P39320 [1,0,0,1,0,0|2,0,0]=4 172 B8R1.2 NCC1CCCOC1 L21850 [1,0,0,1,0,0|1,0,1]=4 173 B8R1.2 NC[C@@H]1CCCOC1 L18118 [1,0,0,1,0,0|1,0,1]=4 174 B8R1.2 NC[C@@H]1CCCOC1 Q56432 [1,0,0,1,0,0|1,0,1]=4 175 B8R1.2 NC[C@H]1CCCOC1 L18117 [1,0,0,1,0,0|1,0,1]=4 176 B8R1.2 NC[C@H]1CCCOC1 Q56431 [1,0,0,1,0,0|1,0,1]=4 177 B8R1.2 OCC1CCCOC1 F-4498 [1,0,0,1,0,0|1,0,1]=4 178 B8R1.2 OC[C@@H]1CCCOC1 P43927 [1,0,0,1,0,0|1,0,1]=4 179 B8R1.2 OC[C@H]1CCCOC1 P43926 [1,0,0,1,0,0|1,0,1]=4 180 B8R1.5 C[C@@H]1CCCN[C@@H]1C P45337 [1,0,0,1,0,0|2,0,0]=4 181 B8R1.5 C[C@@H]1CCCN[C@@H]1C Q61336 [1,0,0,1,0,0|2,0,0]=4 182 B8R1.8 CCNC1CCOC1 L13931 [1,0,0,1,0,0|1,0,1]=4 183 B8R1.8 CNCC1CCCC1 P38031 [1,0,0,1,0,0|1,0,1]=4 184 B8R1.8 CNCC1CCOC1 L14905 [1,0,0,1,0,0|1,0,1]=4 185 B8R1.8 COCC1CCCN1 O28849 [1,0,0,1,0,0|1,0,1]=4 186 B8R1.8 COCC1CCNC1 L18134 [1,0,0,1,0,0|1,0,1]=4 187 B8R1.8 COCC1CCNC1 L18135 [1,0,0,1,0,0|1,0,1]=4 188 B8R1.8 COC[C@@H]1CCCN1 L14013 [1,0,0,1,0,0|1,0,1]=4 189 B8R1.8 COC[C@@H]1CCNC1 L22515 [1,0,0,1,0,0|1,0,1]=4 190 B8R1.8 COC[C@@H]1CCNC1 S72614 [1,0,0,1,0,0|1,0,1]=4 191 B8R1.8 COC[C@H]1CCCN1 P35868 [1,0,0,1,0,0|1,0,1]=4 192 B8R1.8 COC[C@H]1CCNC1 L22047 [1,0,0,1,0,0|1,0,1]=4 193 B8R1.10 CC=CCN1CCC1 P45310 [1,0,0,1,0,0|2,0,0]=4 194 B8R1.10 CCNCC1CCC1 P45276 [1,0,0,1,0,0|2,0,0]=4 195 B8R1.10 CCNCC1CCC1 P45868 [1,0,0,1,0,0|2,0,0]=4 196 B8R1.10 CNCCC1CCC1 P34701 [1,0,0,1,0,0|1,0,1]=4 197 B8R1.10 COCCC1CNC1 P44773 [1,0,0,1,0,0|1,0,1]=4 198 B8R1.10 COCCC1CNC1 P44774 [1,0,0,1,0,0|1,0,1]=4 199 B8R1.10 OCCCC1COC1 Q54775 [1,0,0,1,0,0|1,0,1]=4 200 B8R1.11 COC1CCCC1N Q59137 [1,0,0,1,0,0|1,0,1]=4 201 B8R1.11 COC1CCCC1N Q59138 [1,0,0,1,0,0|1,0,1]=4 202 B8R1.11 CO[C@@H]1CCC[C@@H]1N Q52259 [1,0,0,1,0,0|1,0,1]=4 203 B8R1.11 CO[C@@H]1CCC[C@@H]1N Q52260 [1,0,0,1,0,0|1,0,1]=4 204 B8R1.11 CO[C@@H]1CCC[C@H]1N Q56991 [1,0,0,1,0,0|1,0,1]=4 205 B8R1.11 CO[C@@H]1CCN[C@H]1C Q61887 [1,0,0,1,0,0|1,0,1]=4 206 B8R1.11 CO[C@H]1CCC[C@@H]1N Q52257 [1,0,0,1,0,0|1,0,1]=4 207 B8R1.11 CO[C@H]1CCC[C@@H]1N Q56990 [1,0,0,1,0,0|1,0,1]=4 208 B8R1.12 COC1CCC1CN P44996 [1,0,0,1,0,0|1,0,1]=4 209 B8R1.12 COC1CCC1CO P50853 [1,0,0,1,0,0|1,0,1]=4 210 B8R1.12 CO[C@@H]1CC[C@@H]1CO P50822 [1,0,0,1,0,0|1,0,1]=4 211 B8R1.12 CO[C@@H]1CC[C@H]1CO P50819 [1,0,0,1,0,0|1,0,1]=4 212 B8R1.13 COCC1CCC1N P47021 [1,0,0,1,0,0|1,0,1]=4 213 B8R1.13 COCC1CCC1N P47931 [1,0,0,1,0,0|1,0,1]=4 214 B8R1.13 COC[C@H]1CC[C@@H]1N P46988 [1,0,0,1,0,0|1,0,1]=4 215 B8R1.13 COC[C@H]1CC[C@@H]1N P46994 [1,0,0,1,0,0|1,0,1]=4 216 B8R1.13 COC[C@H]1CC[C@H]1N P46962 [1,0,0,1,0,0|1,0,1]=4 217 B8R1.13 COC[C@H]1CC[C@H]1N P46995 [1,0,0,1,0,0|1,0,1]=4 218 B8R1.1 C=CC1COC(=O)C1 F-4407 [1,0,0,1,0,0|0,0,2]=4 219 B8R1.1 CNC1CNC(=O)C1 L19088 [1,0,0,1,0,0|2,0,0]=4 220 B8R1.1 CN[C@H]1CNC(=O)C1 Q61671 [1,0,0,1,0,0|2,0,0]=4 221 B8R1.1 NCC1CNC(=O)C1 G-5016 [1,0,0,1,0,0|2,0,0]=4 222 B8R1.1 NCC1CNC(=O)C1 G-5352 [1,0,0,1,0,0|2,0,0]=4 223 B8R1.1 NCC1COC(=O)N1 L13942 [1,0,0,1,0,0|2,0,0]=4 224 B8R1.1 NC[C@@H]1CNC(=O)C1 I-9821 [1,0,0,1,0,0|2,0,0]=4 225 B8R1.1 NC[C@@H]1CNC(=O)C1 L13273 [1,0,0,1,0,0|2,0,0]=4 226 B8R1.1 NC[C@H]1CNC(=O)C1 I-9497 [1,0,0,1,0,0|2,0,0]=4 227 B8R1.1 NC[C@H]1CNC(=O)C1 L13364 [1,0,0,1,0,0|2,0,0]=4 228 B8R1.1 O=C1CC(CO)CN1 M22864 [1,0,0,1,0,0|2,0,0]=4 229 B8R1.1 O=C1CC(CO)CO1 H-8701 [1,0,0,1,0,0|1,0,0]=3 230 B8R1.1 O=C1CCC(CO)C1 Q62791 [1,0,0,1,0,0|2,0,0]=4 231 B8R1.1 O=C1CC[C@@H](CBr)C1 Q64130 [1,0,0,1,0,0|2,0,0]=4 232 B8R1.1 O=C1CC[C@@H](CO)C1 Q62794 [1,0,0,1,0,0|2,0,0]=4 233 B8R1.1 O=C1CC[C@H](CBr)C1 Q64129 [1,0,0,1,0,0|2,0,0]=4 234 B8R1.1 O=C1CC[C@H](CO)C1 Q62792 [1,0,0,1,0,0|2,0,0]=4 235 B8R1.1 O=C1N[C@@H](CI)CO1 10034 [1,0,0,1,0,0|2,0,0]=4 236 B8R1.1 O=C1N[C@@H](CO)CO1 10001 [1,0,0,1,0,0|2,0,0]=4 237 B8R1.1 O=C1N[C@H](CO)CO1 10026 [1,0,0,1,0,0|2,0,0]=4 238 B8R1.3 CC1C=CC(=O)CC1 K12331 [1,0,0,1,0,0|1,0,1]=4 239 B8R1.3 CC1CCC(=O)NC1 L13409 [1,0,0,1,0,0|1,0,0]=3 240 B8R1.3 CC1CNC(=O)CN1 P35228 [1,0,0,1,0,0|2,0,0]=4 241 B8R1.3 C[C@@H]1CCC(=O)CN1 Q56751 [1,0,0,1,0,0|2,0,0]=4 242 B8R1.3 C[C@@H]1CCC(=O)CN1 Q56752 [1,0,0,1,0,0|2,0,0]=4 243 B8R1.3 C[C@@H]1CNC(=O)CN1 L14453 [1,0,0,1,0,0|2,0,0]=4 244 B8R1.3 C[C@H]1CCC(=O)CN1 Q56753 [1,0,0,1,0,0|2,0,0]=4 245 B8R1.3 C[C@H]1CCC(=O)CN1 Q56754 [1,0,0,1,0,0|2,0,0]=4 246 B8R1.3 C[C@H]1CNC(=O)CN1 L13879 [1,0,0,1,0,0|2,0,0]=4 247 B8R1.3 NC1CCC(=O)CC1 P36686 [1,0,0,1,0,0|2,0,0]=4 248 B8R1.3 NC1CCC(=O)NC1 C-3401 [1,0,0,1,0,0|2,0,0]=4 249 B8R1.3 N[C@@H]1CCC(=O)NC1 L21492 [1,0,0,1,0,0|2,0,0]=4 250 B8R1.3 N[C@H]1CCC(=O)NC1 L21629 [1,0,0,1,0,0|2,0,0]=4 251 B8R1.3 O=C1CCC(=O)OC1 K12424 [1,0,0,1,0,0|1,0,1]=4 252 B8R1.3 O=C1CCC(Br)CC1 P39565 [1,0,0,1,0,0|2,0,0]=4 253 B8R1.3 O=C1CCC(F)CC1 L21631 [1,0,0,1,0,0|2,0,0]=4 254 B8R1.3 O=C1CCC(F)CN1 Q54421 [1,0,0,1,0,0|2,0,0]=4 255 B8R1.3 O=C1CC[C@H](O)CN1 Q52728 [1,0,0,1,0,0|2,0,0]=4 256 B8R1.38 CCC(=O)C1CCC1 P45339 [1,0,0,1,0,0|1,0,0]=3 257 B8R1.38 CCC(=O)C1COC1 Q56142 [1,0,0,1,0,0|2,0,0]=4 258 B8R1.38 CNC(=O)C1CCC1 P49094 [1,0,0,1,0,0|1,0,0]=3 259 B8R1.38 CNC(=O)C1CNC1 P45048 [1,0,0,1,0,0|2,0,0]=4 260 B8R1.38 CNC(=O)C1CNC1 P45049 [1,0,0,1,0,0|2,0,0]=4 261 B8R1.38 COC(=O)C1C=CC1 P47818 [1,0,0,1,0,0|0,0,2]=4 262 B8R1.38 COC(=O)C1CCC1 P45206 [1,0,0,1,0,0|0,0,0]=2 263 B8R1.38 COC(=O)C1CCN1 F-4237 [1,0,0,1,0,0|1,0,0]=3 264 B8R1.38 COC(=O)C1CNC1 A-420 [1,0,0,1,0,0|1,0,0]=3 265 B8R1.38 COC(=O)C1CNC1 F-4426 [1,0,0,1,0,0|1,0,0]=3 266 B8R1.38 COC(=O)C1COC1 L13768 [1,0,0,1,0,0|1,0,0]=3 267 B8R1.38 COC(=O)[C@@H]1CCN1 G-7134 [1,0,0,1,0,0|1,0,0]=3 268 B8R1.38 COC(=O)[C@H]1CCN1 G-7965 [1,0,0,1,0,0|1,0,0]=3 269 B8R1.38 NCC(=O)C1CCC1 L19863 [1,0,0,1,0,0|2,0,0]=4 270 B8R1.38 NNC(=O)C1CCC1 P44614 [1,0,0,1,0,0|2,0,0]=4 271 B8R1.38 O=C(CBr)C1CCC1 P44370 [1,0,0,1,0,0|2,0,0]=4 272 B8R1.38 O=C(CCl)C1CCC1 P45495 [1,0,0,1,0,0|2,0,0]=4 273 B8R1.38 O=C(CO)C1CCC1 P45459 [1,0,0,1,0,0|2,0,0]=4 274 B8R1.38 O=C(NO)C1CCC1 P45195 [1,0,0,1,0,0|2,0,0]=4 275 B8R1.40 COC(=O)C=C1CC1 H-8420 [1,0,0,1,0,0|0,0,2]=4 276 B8R1.40 COC(=O)CC1CC1 G-7131 [1,0,0,1,0,0|0,0,0]=2 277 B8R1.50 CC1C(=O)CCN1C Q52697 [1,0,0,1,0,0|2,0,0]=4 278 B8R1.4 C=C1CCOC(C)C1 Q54980 [1,0,0,1,0,0|2,0,0]=4 279 B8R1.4 CC1=CCCC(=O)C1 O32064 [1,0,0,1,0,0|0,0,2]=4 280 B8R1.4 CC1CC(=O)CCN1 D-2514 [1,0,0,1,0,0|1,0,0]=3 281 B8R1.4 CC1CC(=O)CCO1 A-836 [1,0,0,1,0,0|1,0,0]=3 282 B8R1.4 CC1CCNC(=O)C1 L13355 [1,0,0,1,0,0|1,0,0]=3 283 B8R1.4 CN1CCOC(=O)C1 Q54674 [1,0,0,1,0,0|2,0,0]=4 284 B8R1.4 C[C@@H]1CC(=O)CCN1 G-7641 [1,0,0,1,0,0|1,0,0]=3 285 B8R1.4 C[C@@H]1CC(=O)CCO1 H-8404 [1,0,0,1,0,0|1,0,0]=3 286 B8R1.4 C[C@@H]1CCC[C@@H](C)N1 Q65231 [1,0,0,1,0,0|1,0,1]=4 287 B8R1.4 C[C@@H]1CCC[C@@H](C)N1 Q65232 [1,0,0,1,0,0|1,0,1]=4 288 B8R1.4 C[C@@H]1CCC[C@@H](N)C1 P49440 [1,0,0,1,0,0|1,0,1]=4 289 B8R1.4 C[C@@H]1CCC[C@@H](O)C1 P45249 [1,0,0,1,0,0|0,0,2]=4 290 B8R1.4 C[C@@H]1CCC[C@@H](O)C1 P45891 [1,0,0,1,0,0|0,0,2]=4 291 B8R1.4 C[C@@H]1CCC[C@H](N)C1 P45362 [1,0,0,1,0,0|1,0,1]=4 292 B8R1.4 C[C@@H]1CCC[C@H](N)C1 P49441 [1,0,0,1,0,0|1,0,1]=4 293 B8R1.4 C[C@@H]1CCC[C@H](O)C1 P45486 [1,0,0,1,0,0|0,0,2]=4 294 B8R1.4 C[C@@H]1CCC[C@H](O)C1 P45892 [1,0,0,1,0,0|0,0,2]=4 295 B8R1.4 C[C@@H]1CNCC(=O)N1 L13903 [1,0,0,1,0,0|2,0,0]=4 296 B8R1.4 C[C@H]1CC(=O)CCN1 G-6964 [1,0,0,1,0,0|1,0,0]=3 297 B8R1.4 C[C@H]1CC(=O)CCN1 G-7640 [1,0,0,1,0,0|1,0,0]=3 298 B8R1.4 C[C@H]1CC(=O)CCN1 Q61425 [1,0,0,1,0,0|1,0,0]=3 299 B8R1.4 C[C@H]1CC(=O)CCO1 A-837 [1,0,0,1,0,0|1,0,0]=3 300 B8R1.4 C[C@H]1CCC[C@@H](N)C1 P45360 [1,0,0,1,0,0|1,0,1]=4 301 B8R1.4 C[C@H]1CCC[C@@H](O)C1 P45893 [1,0,0,1,0,0|0,0,2]=4 302 B8R1.4 C[C@H]1CCC[C@H](C)N1 Q65229 [1,0,0,1,0,0|1,0,1]=4 303 B8R1.4 C[C@H]1CCC[C@H](C)N1 Q65230 [1,0,0,1,0,0|1,0,1]=4 304 B8R1.4 C[C@H]1CCC[C@H](N)C1 P45361 [1,0,0,1,0,0|1,0,1]=4 305 B8R1.4 C[C@H]1CCC[C@H](O)C1 P45546 [1,0,0,1,0,0|0,0,2]=4 306 B8R1.4 C[C@H]1CNCC(=O)N1 G-7098 [1,0,0,1,0,0|2,0,0]=4 307 B8R1.4 C[C@H]1CNCC(=O)N1 H-8010 [1,0,0,1,0,0|2,0,0]=4 308 B8R1.4 NC1CCCC(=O)C1 P48005 [1,0,0,1,0,0|1,0,0]=3 309 B8R1.4 NC1CCNC(=O)C1 C-2485 [1,0,0,1,0,0|2,0,0]=4 310 B8R1.4 NC1COCC(=O)C1 P46448 [1,0,0,1,0,0|2,0,0]=4 311 B8R1.4 NC1COCC(=O)C1 Q61511 [1,0,0,1,0,0|2,0,0]=4 312 B8R1.4 O=C1CC(F)CCN1 Q54422 [1,0,0,1,0,0|2,0,0]=4 313 B8R1.4 O=C1CCCC(=O)C1 P44675 [1,0,0,1,0,0|1,0,1]=4 314 B8R1.4 O=C1CCCC(Br)C1 P45384 [1,0,0,1,0,0|1,0,0]=3 315 B8R1.4 O=C1CCCC(F)C1 P43987 [1,0,0,1,0,0|1,0,0]=3 316 B8R1.4 O=C1CCCC(O)C1 L18346 [1,0,0,1,0,0|1,0,0]=3 317 B8R1.4 O=C1CCC[C@H](O)C1 P47405 [1,0,0,1,0,0|1,0,0]=3 318 B8R1.4 O=C1COCC(F)C1 Q54617 [1,0,0,1,0,0|2,0,0]=4 319 B8R1.4 O=C1COCC(O)C1 Q54616 [1,0,0,1,0,0|2,0,0]=4 320 B8R1.4 O=S1CCCC(Br)C1 Q57991 [1,0,0,1,0,0|2,0,0]=4 321 B8R1.6 CCCC1CC(=O)C1 P45457 [1,0,0,1,0,0|0,0,0]=2 322 B8R1.6 CCOC1CC(=O)C1 P45782 [1,0,0,1,0,0|1,0,0]=3 323 B8R1.6 COCC1CC(=O)C1 P42770 [1,0,0,1,0,0|1,0,0]=3 324 B8R1.6 N#CCC1CC(=O)C1 L18034 [1,0,0,1,0,0|1,0,1]=4 325 B8R1.7 CC(=O)C1CCCN1 P37169 [1,0,0,1,0,0|1,0,0]=3 326 B8R1.7 CC(=O)C1CCCN1 Q61985 [1,0,0,1,0,0|1,0,0]=3 327 B8R1.7 CC(=O)C1CCNC1 O31491 [1,0,0,1,0,0|1,0,0]=3 328 B8R1.7 CC(=O)C1NCCS1 M15825 [1,0,0,1,0,0|2,0,0]=4 329 B8R1.7 CC(=O)[C@@H]1CCCN1 Q61986 [1,0,0,1,0,0|1,0,0]=3 330 B8R1.7 CC(=O)[C@@H]1CCCN1 Q62844 [1,0,0,1,0,0|1,0,0]=3 331 B8R1.7 CC(=O)[C@H]1CCCN1 Q62845 [1,0,0,1,0,0|1,0,0]=3 332 B8R1.7 CC(N)C1CCCC1 O30449 [1,0,0,1,0,0|1,0,1]=4 333 B8R1.7 CC(N)C1CCCC1 O33618 [1,0,0,1,0,0|1,0,1]=4 334 B8R1.7 C[C@H](N)C1CCCC1 Q59148 [1,0,0,1,0,0|1,0,1]=4 335 B8R1.7 C[C@H](O)C1CCCC1 Q59154 [1,0,0,1,0,0|0,0,2]=4 336 B8R1.7 NC(=O)C1CCCC1 P38833 [1,0,0,1,0,0|1,0,0]=3 337 B8R1.7 NC(=O)C1CCCN1 P39079 [1,0,0,1,0,0|2,0,0]=4 338 B8R1.7 NC(=O)C1CCCN1 P42514 [1,0,0,1,0,0|2,0,0]=4 339 B8R1.7 NC(=O)C1CCNC1 G-5260 [1,0,0,1,0,0|2,0,0]=4 340 B8R1.7 NC(=O)C1CCOC1 G-6625 [1,0,0,1,0,0|2,0,0]=4 341 B8R1.7 NC(=O)[C@@H]1CCCN1 I-9393 [1,0,0,1,0,0|2,0,0]=4 342 B8R1.7 NC(=O)[C@@H]1CCCN1 P45231 [1,0,0,1,0,0|2,0,0]=4 343 B8R1.7 NC(=O)[C@@H]1CCNC1 G-5262 [1,0,0,1,0,0|2,0,0]=4 344 B8R1.7 NC(=O)[C@@H]1CCNC1 G-7539 [1,0,0,1,0,0|2,0,0]=4 345 B8R1.7 NC(=O)[C@H]1CCNC1 G-5261 [1,0,0,1,0,0|2,0,0]=4 346 B8R1.7 NC(=O)[C@H]1CCNC1 Q51836 [1,0,0,1,0,0|2,0,0]=4 347 B8R1.7 O=C(O)C1CC=CC1 G-6381 [1,0,0,1,0,0|0,0,2]=4 348 B8R1.7 O=C(O)C1CCNC1 G-5249 [1,0,0,1,0,0|1,0,0]=3 349 B8R1.7 O=C(O)C1CCOC1 C-3386 [1,0,0,1,0,0|1,0,0]=3 350 B8R1.7 O=C(O)C1SCCS1 L19481 [1,0,0,1,0,0|2,0,0]=4 351 B8R1.7 O=C(O)[C@@H]1CCCN1 L13796 [1,0,0,1,0,0|1,0,0]=3 352 B8R1.7 O=C(O)[C@@H]1CCNC1 L18435 [1,0,0,1,0,0|1,0,0]=3 353 B8R1.7 O=C(O)[C@@H]1CCNC1 Q51834 [1,0,0,1,0,0|1,0,0]=3 354 B8R1.7 O=C(O)[C@@H]1CCOC1 C-2786 [1,0,0,1,0,0|1,0,0]=3 355 B8R1.7 O=C(O)[C@H]1CCNC1 G-5250 [1,0,0,1,0,0|1,0,0]=3 356 B8R1.7 O=C(O)[C@H]1CCNC1 P45277 [1,0,0,1,0,0|1,0,0]=3 357 B8R1.7 O=C(O)[C@H]1CCOC1 C-2785 [1,0,0,1,0,0|1,0,0]=3 358 B8R1.20 CC1CC1CC(=O)O O29360 [1,0,0,1,0,0|0,0,0]=2 359 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C P50610 [1,0,0,1,0,0|0,0,0]=2 360 B8R1.31 CC(=O)[C@H]1CC[C@H]1C P45662 [1,0,0,1,0,0|0,0,0]=2 361 B8R1.31 CC1CCC1C(=O)O P45629 [1,0,0,1,0,0|0,0,0]=2 362 B8R1.31 CC1NCC1C(=O)O L22133 [1,0,0,1,0,0|1,0,0]=3 363 B8R1.31 CN1CCC1C(=O)O P49637 [1,0,0,1,0,0|1,0,0]=3 364 B8R1.31 CN1CC[C@@H]1C(=O)O H-8820 [1,0,0,1,0,0|1,0,0]=3 365 B8R1.31 CN1CC[C@H]1C(=O)O H-8821 [1,0,0,1,0,0|1,0,0]=3 366 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O L14485 [1,0,0,1,0,0|1,0,0]=3 367 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O P50093 [1,0,0,1,0,0|1,0,0]=3 368 B8R1.31 C[C@H]1NC[C@@H]1C(=O)O K13449 [1,0,0,1,0,0|1,0,0]=3 369 B8R1.31 NC(=O)C1CCC1N F-4228 [1,0,0,1,0,0|2,0,0]=4 370 B8R1.31 NC1CCC1C(=O)O P47809 [1,0,0,1,0,0|1,0,0]=3 371 B8R1.31 NC1COC1C(=O)O Q56135 [1,0,0,1,0,0|2,0,0]=4 372 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O P45363 [1,0,0,1,0,0|1,0,0]=3 373 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O L13901 [1,0,0,1,0,0|1,0,0]=3 374 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O P44744 [1,0,0,1,0,0|1,0,0]=3 375 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O P45102 [1,0,0,1,0,0|1,0,0]=3 376 B8R1.31 N[C@@H]1CO[C@@H]1C(=O)O Q52861 [1,0,0,1,0,0|2,0,0]=4 377 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Q52863 [1,0,0,1,0,0|2,0,0]=4 378 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Q54778 [1,0,0,1,0,0|2,0,0]=4 379 B8R1.31 N[C@H]1CC[C@H]1C(=O)O L21391 [1,0,0,1,0,0|1,0,0]=3 380 B8R1.31 N[C@H]1CC[C@H]1C(=O)O P45103 [1,0,0,1,0,0|1,0,0]=3 381 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Q53487 [1,0,0,1,0,0|1,0,0]=3 382 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Q52864 [1,0,0,1,0,0|2,0,0]=4 383 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Q52862 [1,0,0,1,0,0|2,0,0]=4 384 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Q54777 [1,0,0,1,0,0|2,0,0]=4 385 B8R1.31 O=C(O)C1CCC1F P47126 [1,0,0,1,0,0|1,0,0]=3 386 B8R1.31 O=C(O)C1CCC1O P49194 [1,0,0,1,0,0|1,0,0]=3 387 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O P48368 [1,0,0,1,0,0|1,0,0]=3 388 B8R1.34 CC(=O)CC1CCC1 P48892 [1,0,0,1,0,0|0,0,0]=2 389 B8R1.34 CC(=O)NC1CNC1 G-5840 [1,0,0,1,0,0|2,0,0]=4 390 B8R1.34 CC(=O)NC1CNC1 P44173 [1,0,0,1,0,0|2,0,0]=4 391 B8R1.34 CC(=O)OC1CNC1 P42388 [1,0,0,1,0,0|2,0,0]=4 392 B8R1.34 CC(=O)SC1CNC1 C-3406 [1,0,0,1,0,0|2,0,0]=4 393 B8R1.34 CC(=O)SC1CNC1 P50614 [1,0,0,1,0,0|2,0,0]=4 394 B8R1.34 N=C(N)CC1CCC1 P48135 [1,0,0,1,0,0|2,0,0]=4 395 B8R1.34 NC(=O)CC1CNC1 P47102 [1,0,0,1,0,0|2,0,0]=4 396 B8R1.34 NC(=O)CC1CNC1 P48716 [1,0,0,1,0,0|2,0,0]=4 397 B8R1.34 NC(=O)NC1CCC1 P45216 [1,0,0,1,0,0|2,0,0]=4 398 B8R1.34 O=C(O)C=C1CCC1 G-6914 [1,0,0,1,0,0|0,0,2]=4 399 B8R1.34 O=C(O)CC1CCC1 P44572 [1,0,0,1,0,0|0,0,0]=2 400 B8R1.34 O=C(O)CC1CCN1 P44826 [1,0,0,1,0,0|1,0,0]=3 401 B8R1.34 O=C(O)CC1CCO1 F-4762 [1,0,0,1,0,0|1,0,0]=3 402 B8R1.34 O=C(O)CC1CNC1 G-7532 [1,0,0,1,0,0|1,0,0]=3 403 B8R1.34 O=C(O)CC1CNC1 M22650 [1,0,0,1,0,0|1,0,0]=3 404 B8R1.34 O=C(O)CC1CNC1 P46867 [1,0,0,1,0,0|1,0,0]=3 405 B8R1.34 O=C(O)CC1COC1 F-4181 [1,0,0,1,0,0|1,0,0]=3 406 B8R1.34 O=C(O)CN1CCC1 H-8105 [1,0,0,1,0,0|1,0,0]=3 407 B8R1.34 O=C(O)C[C@@H]1CCO1 Q56144 [1,0,0,1,0,0|1,0,0]=3 408 B8R1.34 O=C(O)C[C@H]1CCO1 Q56143 [1,0,0,1,0,0|1,0,0]=3 409 B8R1.35 O=C(O)CCC1CC1 P37405 [1,0,0,1,0,0|0,0,0]=2 410 B8R1.35 O=C(O)\C=C\C1CC1 L14104 [1,0,0,1,0,0|0,0,2]=4 411 B8R1.43 N#CC1CC1C(=O)O P43783 [1,0,0,1,0,0|1,0,1]=4 412 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O L14217 [1,0,0,1,0,0|1,0,1]=4 413 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O L22404 [1,0,0,1,0,0|1,0,1]=4 414 B8R1.43 NCC1CC1C(=O)O Q52566 [1,0,0,1,0,0|1,0,0]=3 415 B10R1.13 CN(C)C1CCC(=O)CC1 O33983 [0,1,0,1,0,0|2,0,0]=4 416 B10R1.14 CCC(=O)N1CCC(O)C1 Q59265 [0,1,0,1,0,0|2,0,0]=4 417 B10R1.14 CNC(=O)[C@@H]1CC[C@@H](N)C1 K13472 [0,1,0,1,0,0|1,0,0]=3 418 B10R1.14 COC(=O)C1CC(O)CN1 Q59355 [0,1,0,1,0,0|1,0,0]=3 419 B10R1.14 COC(=O)C1CCC(=O)C1 G-6549 [0,1,0,1,0,0|0,0,1]=3 420 B10R1.14 COC(=O)C1CCC(Br)C1 Q57113 [0,1,0,1,0,0|0,0,0]=2 421 B10R1.14 COC(=O)C1CCC(F)C1 Q56994 [0,1,0,1,0,0|0,0,0]=2 422 B10R1.14 COC(=O)C1CCC(N)C1 Q52413 [0,1,0,1,0,0|0,0,0]=2 423 B10R1.14 COC(=O)C1CCC(O)C1 Q52112 [0,1,0,1,0,0|0,0,0]=2 424 B10R1.14 COC(=O)C1CCN(C)C1 P38659 [0,1,0,1,0,0|1,0,0]=3 425 B10R1.14 COC(=O)C1CNC(=O)C1 G-7599 [0,1,0,1,0,0|1,0,1]=4 426 B10R1.14 COC(=O)N1CCC(N)C1 Q59181 [0,1,0,1,0,0|1,0,0]=3 427 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 L13047 [0,1,0,1,0,0|0,0,1]=3 428 B10R1.14 COC(=O)[C@@H]1CCC(=O)N1 G-6978 [0,1,0,1,0,0|1,0,1]=4 429 B10R1.14 COC(=O)[C@@H]1CC[C@@H](F)C1 Q52909 [0,1,0,1,0,0|0,0,0]=2 430 B10R1.14 COC(=O)[C@@H]1CC[C@@H](N)C1 L18149 [0,1,0,1,0,0|0,0,0]=2 431 B10R1.14 COC(=O)[C@@H]1CC[C@@H](O)C1 L22418 [0,1,0,1,0,0|0,0,0]=2 432 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 L13341 [0,1,0,1,0,0|0,0,0]=2 433 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 I-9853 [0,1,0,1,0,0|0,0,0]=2 434 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 Q56974 [0,1,0,1,0,0|0,0,0]=2 435 B10R1.14 COC(=O)[C@@H]1CNC(=O)C1 Q55618 [0,1,0,1,0,0|1,0,1]=4 436 B10R1.14 COC(=O)[C@@H]1C[C@@H](S)CN1 P50858 [0,1,0,1,0,0|1,0,0]=3 437 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 G-7740 [0,1,0,1,0,0|1,0,0]=3 438 B10R1.14 COC(=O)[C@@H]1C[C@H](O)CN1 P38268 [0,1,0,1,0,0|1,0,0]=3 439 B10R1.14 COC(=O)[C@H]1C=C[C@@H](N)C1 L14980 [0,1,0,1,0,0|0,0,2]=4 440 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 L13046 [0,1,0,1,0,0|0,0,1]=3 441 B10R1.14 COC(=O)[C@H]1CC[C@@H](Br)C1 Q56993 [0,1,0,1,0,0|0,0,0]=2 442 B10R1.14 COC(=O)[C@H]1CC[C@@H](F)C1 Q52908 [0,1,0,1,0,0|0,0,0]=2 443 B10R1.14 COC(=O)[C@H]1CC[C@@H](N)C1 K12005 [0,1,0,1,0,0|0,0,0]=2 444 B10R1.14 COC(=O)[C@H]1CC[C@@H](O)C1 Q56975 [0,1,0,1,0,0|0,0,0]=2 445 B10R1.14 COC(=O)[C@H]1CC[C@H](Br)C1 L21293 [0,1,0,1,0,0|0,0,0]=2 446 B10R1.14 COC(=O)[C@H]1CC[C@H](N)C1 L21260 [0,1,0,1,0,0|0,0,0]=2 447 B10R1.14 COC(=O)[C@H]1CNC(=O)C1 Q55617 [0,1,0,1,0,0|1,0,1]=4 448 B10R1.14 COC(=O)[C@H]1C[C@@H](F)CN1 L13088 [0,1,0,1,0,0|1,0,0]=3 449 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 G-7666 [0,1,0,1,0,0|1,0,0]=3 450 B10R1.14 COC(=O)[C@H]1C[C@H](O)CN1 O31897 [0,1,0,1,0,0|1,0,0]=3 451 B10R1.14 COC(=O)[C@H]1C[C@H](S)CN1 Q53263 [0,1,0,1,0,0|1,0,0]=3 452 B10R1.54 CC(C)C[C@@H]1COC(=O)N1 Q70109 [0,1,0,1,0,0|1,0,0]=3 453 B10R1.150 COC(=O)CC1CC(=O)C1 L13153 [0,1,0,1,0,0|0,0,1]=3 454 B10R1.150 COC(=O)CC1CC(N)C1 P46199 [0,1,0,1,0,0|0,0,0]=2 455 B10R1.150 COC(=O)CC1CC(O)C1 P44044 [0,1,0,1,0,0|0,0,0]=2 456 B10R1.150 COC(=O)CC1CN(C)C1 H-8143 [0,1,0,1,0,0|1,0,0]=3 457 B10R1.150 COC(=O)C[C@H]1C[C@@H](O)C1 P44034 [0,1,0,1,0,0|0,0,0]=2 458 B10R1.150 COC(=O)C[C@H]1C[C@H](O)C1 P49732 [0,1,0,1,0,0|0,0,0]=2 459 B10R1.197 O=C1CCC(CO)CCN1 L19235 [0,1,0,1,0,0|2,0,0]=4 460 B10R1.408 COC(=O)C1CC1C(=O)O L21970 [0,1,0,1,0,0|1,0,1]=4 461 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(=O)O L14730 [0,1,0,1,0,0|1,0,1]=4 462 B10R1.408 COC(=O)[C@@H]1C[C@H]1C(=O)O L22356 [0,1,0,1,0,0|1,0,1]=4 463 B10R1.416 COC(=O)C1CCC1(C)C P45624 [0,1,0,1,0,0|0,0,0]=2 464 B10R1.416 COC(=O)C1OCC1(C)C Q52358 [0,1,0,1,0,0|1,0,0]=3 465 B10R1.10 CCCC1CC(=O)CCO1 Q57712 [0,1,0,1,0,0|1,0,0]=3 466 B10R1.11 CCOC(=O)C1CCNC1 P35998 [0,1,0,1,0,0|1,0,0]=3 467 B10R1.11 CCOC(=O)[C@@H]1CCNC1 P47011 [0,1,0,1,0,0|1,0,0]=3 468 B10R1.11 CCOC(=O)[C@H]1CCNC1 P47010 [0,1,0,1,0,0|1,0,0]=3 469 B10R1.11 N#CCC(=O)C1CCCC1 G-7566 [0,1,0,1,0,0|1,0,1]=4 470 B10R1.11 NCCC(=O)N1CCCC1 P36713 [0,1,0,1,0,0|2,0,0]=4 471 B10R1.11 O=C(CCCl)N1CCCC1 P36937 [0,1,0,1,0,0|2,0,0]=4 472 B10R1.25 CCC1CNC(=O)CC1=O Q56346 [0,1,0,1,0,0|1,0,1]=4 473 B10R1.135 CCOC(=O)C1CC1C#N L22365 [0,1,0,1,0,0|1,0,1]=4 474 B10R1.135 CCOC(=O)C1CC1CO L14731 [0,1,0,1,0,0|1,0,0]=3 475 B10R1.135 CCOC(=O)[C@@H]1C[C@@H]1C#N L14845 [0,1,0,1,0,0|1,0,1]=4 476 B10R1.135 CCOC(=O)[C@@H]1C[C@H]1C#N L22329 [0,1,0,1,0,0|1,0,1]=4 477 B10R1.137 CCOC(=O)C=C1CCC1 P39116 [0,1,0,1,0,0|0,0,2]=4 478 B10R1.137 CCOC(=O)CC1CCC1 O32497 [0,1,0,1,0,0|0,0,0]=2 479 B10R1.137 CCOC(=O)CC1CNC1 P36470 [0,1,0,1,0,0|1,0,0]=3 480 B10R1.137 CCOC(=O)CC1COC1 P42298 [0,1,0,1,0,0|1,0,0]=3 481 B10R1.137 COCC(=O)NC1CNC1 P47051 [0,1,0,1,0,0|2,0,0]=4 482 B10R1.138 CCOC(=O)\C=C\C1CC1 P37267 [0,1,0,1,0,0|0,0,2]=4 483 B10R1.260 CCOC1CC(=O)C1OC P48136 [0,1,0,1,0,0|1,0,0]=3 484 B10R1.260 CCO[C@@H]1CC(=O)[C@H]1OC P48968 [0,1,0,1,0,0|1,0,0]=3 485 B10R1.15 C=CC(=O)N1CCCCC1 Q59960 [0,1,0,1,0,0|1,0,1]=4 486 B10R1.15 CCC(=O)N1CCNCC1 P36186 [0,1,0,1,0,0|2,0,0]=4 487 B10R1.15 CCC(=O)N1CCOCC1 P38920 [0,1,0,1,0,0|2,0,0]=4 488 B10R1.15 CNC(=O)C1CCCCN1 O28556 [0,1,0,1,0,0|1,0,0]=3 489 B10R1.15 CNC(=O)C1CCCNC1 O28821 [0,1,0,1,0,0|1,0,0]=3 490 B10R1.15 CNC(=O)C1CCNCC1 O28891 [0,1,0,1,0,0|1,0,0]=3 491 B10R1.15 CNC(=O)[C@@H]1CCCCN1 P39879 [0,1,0,1,0,0|1,0,0]=3 492 B10R1.15 CNC(=O)[C@@H]1CCCNC1 L14635 [0,1,0,1,0,0|1,0,0]=3 493 B10R1.15 CNC(=O)[C@H]1CCCCN1 P39159 [0,1,0,1,0,0|1,0,0]=3 494 B10R1.15 CNC(=O)[C@H]1CCCNC1 P42603 [0,1,0,1,0,0|1,0,0]=3 495 B10R1.15 COC(=O)C1=CCOCC1 G-6683 [0,1,0,1,0,0|0,0,2]=4 496 B10R1.15 COC(=O)C1=CNCCC1 L14471 [0,1,0,1,0,0|0,0,2]=4 497 B10R1.15 COC(=O)C1CCCCS1 Q57984 [0,1,0,1,0,0|0,0,0]=2 498 B10R1.15 COC(=O)C1CCCOC1 C-3572 [0,1,0,1,0,0|0,0,0]=2 499 B10R1.15 COC(=O)C1CCOCC1 G-5345 [0,1,0,1,0,0|0,0,0]=2 500 B10R1.15 COC(=O)C1CCSCC1 L13577 [0,1,0,1,0,0|0,0,0]=2 501 B10R1.15 COC(=O)C1CNCCO1 B-1081 [0,1,0,1,0,0|1,0,0]=3 502 B10R1.15 COC(=O)C1COCCN1 B-1084 [0,1,0,1,0,0|1,0,0]=3 503 B10R1.15 COC(=O)[C@@H]1CC=CCC1 P44079 [0,1,0,1,0,0|0,0,1]=3 504 B10R1.15 COC(=O)[C@@H]1CC=CCN1 Q56720 [0,1,0,1,0,0|0,0,2]=4 505 B10R1.15 COC(=O)[C@@H]1CCCNC1 I-9692 [0,1,0,1,0,0|0,0,0]=2 506 B10R1.15 COC(=O)[C@@H]1CCCNC1 M23016 [0,1,0,1,0,0|0,0,0]=2 507 B10R1.15 COC(=O)[C@@H]1CNCCO1 B-1083 [0,1,0,1,0,0|1,0,0]=3 508 B10R1.15 COC(=O)[C@@H]1COCCN1 B-1086 [0,1,0,1,0,0|1,0,0]=3 509 B10R1.15 COC(=O)[C@H]1CC=CCC1 P44077 [0,1,0,1,0,0|0,0,1]=3 510 B10R1.15 COC(=O)[C@H]1CCCCN1 P40267 [0,1,0,1,0,0|0,0,0]=2 511 B10R1.15 COC(=O)[C@H]1CCCNC1 I-9239 [0,1,0,1,0,0|0,0,0]=2 512 B10R1.15 COC(=O)[C@H]1CNCCN1 L18183 [0,1,0,1,0,0|1,0,0]=3 513 B10R1.15 COC(=O)[C@H]1CNCCO1 B-1082 [0,1,0,1,0,0|1,0,0]=3 514 B10R1.15 COC(=O)[C@H]1COCCN1 B-1085 [0,1,0,1,0,0|1,0,0]=3 515 B10R1.15 NCC(=O)C1CCCCC1 G-7089 [0,1,0,1,0,0|2,0,0]=4 516 B10R1.15 NCC(=O)N1CCCCC1 P37527 [0,1,0,1,0,0|2,0,0]=4 517 B10R1.15 NNC(=O)C1CCCOC1 L22371 [0,1,0,1,0,0|2,0,0]=4 518 B10R1.15 NNC(=O)C1CCOCC1 M23034 [0,1,0,1,0,0|2,0,0]=4 519 B10R1.15 O=C(CBr)C1CCCCC1 P44539 [0,1,0,1,0,0|2,0,0]=4 520 B10R1.15 O=C(CBr)C1CCOCC1 I-9777 [0,1,0,1,0,0|2,0,0]=4 521 B10R1.15 O=C(CCl)N1CCCCC1 P41242 [0,1,0,1,0,0|2,0,0]=4 522 B10R1.169 C#CC1CC(C(=O)OC)C1 P46541 [0,1,0,1,0,0|0,0,2]=4 523 B10R1.169 C(=O)C1CC(C(=O)OC)C1 P47146 [0,1,0,1,0,0|1,0,1]=4 524 B10R1.169 C(=O)[C@H]1C[C@@H](C(=O)OC)C1 P48347 [0,1,0,1,0,0|1,0,1]=4 525 B10R1.169 C(=O)[C@H]1C[C@H](C(=O)OC)C1 P48348 [0,1,0,1,0,0|1,0,1]=4 526 B10R1.169 CN[C@H]1C[C@@H](C(=O)OC)C1 P46473 [0,1,0,1,0,0|1,0,0]=3 527 B10R1.169 CN[C@H]1C[C@H](C(=O)OC)C1 P50282 [0,1,0,1,0,0|1,0,0]=3 528 B10R1.169 COC(=O)C1CC(C#N)C1 P43787 [0,1,0,1,0,0|1,0,1]=4 529 B10R1.169 COC(=O)C1CC(CBr)C1 P44074 [0,1,0,1,0,0|1,0,0]=3 530 B10R1.169 COC(=O)C1CC(CN)C1 I-9773 [0,1,0,1,0,0|1,0,0]=3 531 B10R1.169 COC(=O)C1CC(CN)C1 P47716 [0,1,0,1,0,0|1,0,0]=3 532 B10R1.169 COC(=O)C1CC(CO)C1 L14794 [0,1,0,1,0,0|1,0,0]=3 533 B10R1.169 COC(=O)N1CC(CN)C1 P45073 [0,1,0,1,0,0|2,0,0]=4 534 B10R1.169 COC(=O)[C@H]1C[C@@H](CN)C1 P47157 [0,1,0,1,0,0|1,0,0]=3 535 B10R1.169 COC(=O)[C@H]1C[C@@H](CN)C1 P50536 [0,1,0,1,0,0|1,0,0]=3 536 B10R1.169 COC(=O)[C@H]1C[C@@H](CO)C1 P45913 [0,1,0,1,0,0|1,0,0]=3 537 B10R1.169 COC(=O)[C@H]1C[C@H](CN)C1 P47246 [0,1,0,1,0,0|1,0,0]=3 538 B10R1.169 COC(=O)[C@H]1C[C@H](CN)C1 P50532 [0,1,0,1,0,0|1,0,0]=3 539 B10R1.169 COC(=O)[C@H]1C[C@H](CO)C1 P47220 [0,1,0,1,0,0|1,0,0]=3 540 B10R1.176 CCC1CCC(=O)C(N)C1 Q59795 [0,1,0,1,0,0|1,0,0]=3 541 B10R1.176 CN1CC(CN)CCC1=O Q52160 [0,1,0,1,0,0|2,0,0]=4 542 B10R1.182 COC(=O)C(C)C1CNC1 P50127 [0,1,0,1,0,0|1,0,0]=3 543 B10R1.182 COC(=O)C(N)C1CCC1 P41049 [0,1,0,1,0,0|0,0,0]=2 544 B10R1.182 COC(=O)C(N)C1COC1 G-7245 [0,1,0,1,0,0|1,0,0]=3 545 B10R1.182 COC(=O)C(N)C1COC1 Q52416 [0,1,0,1,0,0|1,0,0]=3 546 B10R1.182 COC(=O)[C@@H](N)C1COC1 Q62632 [0,1,0,1,0,0|1,0,0]=3 547 B10R1.182 COC(=O)[C@H](N)C1COC1 Q62631 [0,1,0,1,0,0|1,0,0]=3 548 B10R1.184 CNC(=O)C(N)CC1CC1 P50524 [0,1,0,1,0,0|1,0,0]=3 549 B10R1.184 COC(=O)C(N)CC1CC1 M23285 [0,1,0,1,0,0|0,0,0]=2 550 B10R1.184 COC(=O)[C@@H](N)CC1CC1 P39887 [0,1,0,1,0,0|0,0,0]=2 551 B10R1.411 COC(=O)C1(C)CCCN1 P37748 [0,1,0,1,0,0|1,0,0]=3 552 B10R1.411 COC(=O)C1(C)CCCO1 H-8024 [0,1,0,1,0,0|1,0,0]=3 553 B10R1.411 COC(=O)C1(C)CCNC1 L14194 [0,1,0,1,0,0|1,0,0]=3 554 B10R1.411 COC(=O)C1(C)CCOC1 L22406 [0,1,0,1,0,0|1,0,0]=3 555 B10R1.411 COC(=O)C1(F)CCCC1 Q57008 [0,1,0,1,0,0|0,0,0]=2 556 B10R1.411 COC(=O)C1(F)CCNC1 Q55446 [0,1,0,1,0,0|1,0,0]=3 557 B10R1.411 COC(=O)C1(N)CCCC1 Q56244 [0,1,0,1,0,0|0,0,0]=2 558 B10R1.411 COC(=O)C1(N)CCOC1 L13645 [0,1,0,1,0,0|1,0,0]=3 559 B10R1.411 COC(=O)C1(O)CCNC1 Q55445 [0,1,0,1,0,0|1,0,0]=3 560 B10R1.411 COC(=O)[C@@]1(C)CCCN1 L13688 [0,1,0,1,0,0|1,0,0]=3 561 B10R1.411 COC(=O)[C@@]1(F)CCNC1 Q64582 [0,1,0,1,0,0|1,0,0]=3 562 B10R1.411 COC(=O)[C@]1(C)CCCN1 I-9040 [0,1,0,1,0,0|1,0,0]=3 563 B10R1.411 COC(=O)[C@]1(F)CCNC1 Q64581 [0,1,0,1,0,0|1,0,0]=3 564 B10R1.3 CCC1CCC(C=O)CC1 O32042 [0,1,0,1,0,0|1,0,1]=4 565 B10R1.151 CNC(=O)COC1CNC1 P48452 [0,1,0,1,0,0|2,0,0]=4 566 B10R1.151 CNC(=O)COC1CNC1 P48728 [0,1,0,1,0,0|2,0,0]=4 567 B10R1.151 COC(=O)C=CC1CNC1 P46272 [0,1,0,1,0,0|0,0,2]=4 568 B10R1.151 COC(=O)CCC1CCC1 P47751 [0,1,0,1,0,0|0,0,0]=2 569 B10R1.151 COC(=O)COC1CCC1 P49175 [0,1,0,1,0,0|0,0,0]=2 570 B10R1.151 COC(=O)CSC1CNC1 P46829 [0,1,0,1,0,0|1,0,0]=3 571 B10R1.151 COC(=O)CSC1CNC1 P48718 [0,1,0,1,0,0|1,0,0]=3 572 B10R1.151 O=C(CCl)NCC1CCC1 P49813 [0,1,0,1,0,0|2,0,0]=4 573 B10R1.473 CCC1(N)CCC(=O)CC1 P48981 [0,1,0,1,0,0|1,0,0]=3 574 B10R1.473 CC[N+]1(C)CCC(=O)CC1 P36113 [0,1,0,1,0,0|2,0,0]=4 575 B10R1.27 C#CC(=O)NC1CCCC1 L19428 [0,1,0,1,0,0|1,0,1]=4 576 B10R1.27 CCC(=O)NC1CCNC1 Q59387 [0,1,0,1,0,0|2,0,0]=4 577 B10R1.27 COC(=O)CC1CCCC1 P39146 [0,1,0,1,0,0|0,0,0]=2 578 B10R1.27 COC(=O)CC1CCCN1 L19174 [0,1,0,1,0,0|0,0,0]=2 579 B10R1.27 COC(=O)CC1CCNC1 P42598 [0,1,0,1,0,0|0,0,0]=2 580 B10R1.27 COC(=O)C[C@@H]1CCNC1 Q53700 [0,1,0,1,0,0|0,0,0]=2 581 B10R1.27 COC(=O)C[C@H]1CCCN1 P38713 [0,1,0,1,0,0|0,0,0]=2 582 B10R1.27 COC(=O)C[C@H]1CCNC1 Q53699 [0,1,0,1,0,0|0,0,0]=2 583 B10R1.27 COC(=O)NC1CCNC1 Q59390 [0,1,0,1,0,0|1,0,0]=3 584 B10R1.27 NNC(=O)CC1CCCO1 O32391 [0,1,0,1,0,0|2,0,0]=4 585 B10R1.149 C=CC(=O)N1CCCC1C Q59261 [0,1,0,1,0,0|1,0,1]=4 586 B10R1.149 COC(=O)C1CCCC1N Q59156 [0,1,0,1,0,0|0,0,0]=2 587 B10R1.149 COC(=O)C1CCNC1=O Q62098 [0,1,0,1,0,0|1,0,1]=4 588 B10R1.149 COC(=O)C1CCOC1=O F-4241 [0,1,0,1,0,0|1,0,1]=4 589 B10R1.149 COC(=O)C1COCC1=O C-2979 [0,1,0,1,0,0|1,0,1]=4 590 B10R1.149 COC(=O)C1CSCC1=O Q61747 [0,1,0,1,0,0|1,0,1]=4 591 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N I-9886 [0,1,0,1,0,0|0,0,0]=2 592 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N Q53695 [0,1,0,1,0,0|0,0,0]=2 593 B10R1.149 COC(=O)[C@@H]1CNC[C@@H]1O Q53675 [0,1,0,1,0,0|1,0,0]=3 594 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C Q61693 [0,1,0,1,0,0|0,0,0]=2 595 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C Q61694 [0,1,0,1,0,0|0,0,0]=2 596 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1O Q53247 [0,1,0,1,0,0|1,0,0]=3 597 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1O Q53248 [0,1,0,1,0,0|1,0,0]=3 598 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O I-9987 [0,1,0,1,0,0|1,0,0]=3 599 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O Q52004 [0,1,0,1,0,0|1,0,0]=3 600 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O Q54361 [0,1,0,1,0,0|1,0,0]=3 601 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O L22224 [0,1,0,1,0,0|1,0,0]=3 602 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O Q52268 [0,1,0,1,0,0|1,0,0]=3 603 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N Q53693 [0,1,0,1,0,0|0,0,0]=2 604 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N Q53694 [0,1,0,1,0,0|0,0,0]=2 605 B10R1.149 COC(=O)[C@H]1CCN[C@H]1C Q62185 [0,1,0,1,0,0|0,0,0]=2 606 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C L21772 [0,1,0,1,0,0|0,0,0]=2 607 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C Q61695 [0,1,0,1,0,0|0,0,0]=2 608 B10R1.149 COC(=O)[C@H]1COC[C@H]1N L22030 [0,1,0,1,0,0|1,0,0]=3 609 B10R1.149 COC(=O)[C@H]1COC[C@H]1N Q55570 [0,1,0,1,0,0|1,0,0]=3 610 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O L22267 [0,1,0,1,0,0|1,0,0]=3 611 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O Q54360 [0,1,0,1,0,0|1,0,0]=3 612 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O Q56536 [0,1,0,1,0,0|1,0,0]=3 613 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O Q56537 [0,1,0,1,0,0|1,0,0]=3 614 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O Q56538 [0,1,0,1,0,0|1,0,0]=3 615 B10R1.429 COC(=O)CC1(N)CCC1 L20482 [0,1,0,1,0,0|0,0,0]=2 616 B10R1.429 COC(=O)CC1(N)CCC1 P49414 [0,1,0,1,0,0|0,0,0]=2 617 B10R1.429 COC(=O)CC1(O)CCC1 P47367 [0,1,0,1,0,0|0,0,0]=2 618 B10R1.429 COC(=O)CC1(O)COC1 Q55878 [0,1,0,1,0,0|1,0,0]=3 619 B10R1.1 CCCN1CC=C(Br)CC1 M23759 [0,1,0,1,0,0|2,0,0]=4 620 B10R1.1 COCC1CCC(=O)CC1 P47304 [0,1,0,1,0,0|1,0,0]=3 621 B10R1.1 NCCN1CCC(=O)CC1 Q65035 [0,1,0,1,0,0|2,0,0]=4 622 B10R1.1 NCCN1CCC(=O)CC1 Q65036 [0,1,0,1,0,0|2,0,0]=4 623 B10R1.1 O=C1CCC(CCO)CC1 P44558 [0,1,0,1,0,0|1,0,0]=3 624 B10R1.2 CN1C(=O)CCCC1CN H-8666 [0,1,0,1,0,0|1,0,0]=3 625 B10R1.2 CN1C(=O)CCCC1CN L13186 [0,1,0,1,0,0|1,0,0]=3 626 B10R1.2 CN1C(=O)CCCC1CO Q65296 [0,1,0,1,0,0|1,0,0]=3 627 B10R1.16 COCCN1CCC(=O)C1 Q59377 [0,1,0,1,0,0|2,0,0]=4 628 B10R1.172 COC1CCCC(CO)C1 P35681 [0,1,0,1,0,0|1,0,1]=4 629 B10R1.175 COC(=O)C1=C(CO)CC1 P45726 [0,1,0,1,0,0|0,0,2]=4 630 B10R1.175 COC(=O)C1CCC1C#N P45748 [0,1,0,1,0,0|0,0,1]=3 631 B10R1.175 COC(=O)C1CCC1CN P47646 [0,1,0,1,0,0|0,0,0]=2 632 B10R1.175 COC(=O)[C@@H]1CC[C@@H]1C#N P49624 [0,1,0,1,0,0|0,0,1]=3 633 B10R1.175 COC(=O)[C@@H]1CC[C@H]1C#N P45366 [0,1,0,1,0,0|0,0,1]=3 634 B10R1.23 CC(N)C(=O)N1CCCC1 P37392 [0,1,0,1,0,0|2,0,0]=4 635 B10R1.23 CC(N)C(=O)N1CCCC1 P39438 [0,1,0,1,0,0|2,0,0]=4 636 B10R1.23 CN(C)C(=O)C1CCCN1 O28787 [0,1,0,1,0,0|2,0,0]=4 637 B10R1.23 CN(C)C(=O)C1CCNC1 O28287 [0,1,0,1,0,0|2,0,0]=4 638 B10R1.23 CN(C)C(=O)[C@@H]1CCCN1 O28837 [0,1,0,1,0,0|2,0,0]=4 639 B10R1.23 CN(C)C(=O)[C@@H]1CCNC1 P41716 [0,1,0,1,0,0|2,0,0]=4 640 B10R1.23 CN(C)C(=O)[C@H]1CCCN1 L18083 [0,1,0,1,0,0|2,0,0]=4 641 B10R1.23 CN(C)C(=O)[C@H]1CCNC1 P41715 [0,1,0,1,0,0|2,0,0]=4 642 B10R1.23 C[C@@H](N)C(=O)N1CCCC1 P41343 [0,1,0,1,0,0|2,0,0]=4 643 B10R1.23 C[C@@H](N)C(=O)N1CCCC1 P42525 [0,1,0,1,0,0|2,0,0]=4 644 B10R1.23 C[C@H](N)C(=O)N1CCCC1 P37393 [0,1,0,1,0,0|2,0,0]=4 645 B10R1.204 C[C@H](N)C(=O)OC1CCC1 P35735 [0,1,0,1,0,0|2,0,0]=4 646 B10R1.262 CCOC1CC(=O)C1(C)C F-4713 [0,1,0,1,0,0|2,0,0]=4 647 B10R1.487 COC1(CN)CCCCC1 Q59802 [0,1,0,1,0,0|1,0,1]=4 648 B10R2.178 O=C1CCC2CCC1N2 L18137 [0,0,0,2,0,0|2,0,0]=4 649 B10R2.178 O=C1CCC2CCC1N2 P43913 [0,0,0,2,0,0|2,0,0]=4 650 B10R2.178 O=C1CCN2CCC1C2 P47280 [0,0,0,2,0,0|2,0,0]=4 651 B10R2.178 O=C1NCC2CCC1N2 L13321 [0,0,0,2,0,0|2,0,0]=4 652 B10R2.178 O=C1NCC2CCC1N2 P45933 [0,0,0,2,0,0|2,0,0]=4 653 B10R2.335 O=C1CCC2(CC1)CC2 Q57064 [0,0,0,2,0,0|1,0,0]=3 654 B10R2.335 O=C1CNC2(CC2)CN1 Q52273 [0,0,0,2,0,0|2,0,0]=4 655 B10R2.335 O=C1COC2(CC2)CN1 L13905 [0,0,0,2,0,0|2,0,0]=4 656 B10R2.61 O=C1CC2CCCC1N2 P46614 [0,0,0,2,0,0|2,0,0]=4 657 B10R2.61 O=C1CC2CCCC1N2 P50750 [0,0,0,2,0,0|2,0,0]=4 658 B10R2.61 O=C1CN2CCCC1C2 P45592 [0,0,0,2,0,0|2,0,0]=4 659 B10R2.61 O=C1NC2CCCC1C2 K16106 [0,0,0,2,0,0|2,0,0]=4 660 B10R2.179 CC12CCCC(=O)C1C2 Q52396 [0,0,0,2,0,0|1,0,0]=3 661 B10R2.2 O=C1CC2CCOC2O1 Q59460 [0,0,0,2,0,0|1,0,0]=3 662 B10R2.2 O=C1CC2CNCC2N1 Q55263 [0,0,0,2,0,0|2,0,0]=4 663 B10R2.2 O=C1CC2CSCC2C1 G-7777 [0,0,0,2,0,0|2,0,0]=4 664 B10R2.2 O=C1C[C@@H]2COC[C@@H]2C1 Q64138 [0,0,0,2,0,0|2,0,0]=4 665 B10R2.2 O=C1C[C@@H]2COC[C@H]2C1 Q64139 [0,0,0,2,0,0|2,0,0]=4 666 B10R2.2 O=C1C[C@H]2CCC[C@H]2N1 Q61894 [0,0,0,2,0,0|1,0,0]=3 667 B10R2.2 [C@@H]12CNC[C@@H]1CC(=O)C2 I-9320 [0,0,0,2,0,0|2,0,0]=4 668 B10R2.2 [C@@H]12CNC[C@@H]1CC(=O)C2 L14391 [0,0,0,2,0,0|2,0,0]=4 669 B10R2.2 [C@H]12CNC[C@H]1NC(=O)C2 Q52185 [0,0,0,2,0,0|2,0,0]=4 670 B10R2.32 O=C1CCN2CCCC12 Q59293 [0,0,0,2,0,0|2,0,0]=4 671 B10R2.32 [C@@H]12CCN[C@@H]1C(=O)NC2 G-7863 [0,0,0,2,0,0|2,0,0]=4 672 B10R2.32 [C@@H]12CNC(=O)[C@@H]1COC2 Q61922 [0,0,0,2,0,0|2,0,0]=4 673 B10R2.32 [C@@H]12CNC[C@@H]1CNC2=O P50760 [0,0,0,2,0,0|2,0,0]=4 674 B10R2.32 [C@@H]12CNC[C@@H]1CNC2=O Q55529 [0,0,0,2,0,0|2,0,0]=4 675 B10R2.332 O=C1CC2(CN1)COC2 F-4760 [0,0,0,2,0,0|2,0,0]=4 676 B10R2.332 O=C1CC2(CNC2)CN1 O33406 [0,0,0,2,0,0|2,0,0]=4 677 B10R2.332 O=C1CC2(CNC2)CN1 P47831 [0,0,0,2,0,0|2,0,0]=4 678 B10R2.332 O=C1CC2(CNC2)CN1 Q53873 [0,0,0,2,0,0|2,0,0]=4 679 B10R2.332 O=C1CCC2(COC2)C1 Q64137 [0,0,0,2,0,0|2,0,0]=4 680 B10R2.332 O=C1COC2(CCC2)C1 Q55884 [0,0,0,2,0,0|2,0,0]=4 681 B10R2.332 O=C1NCC2(CCC2)O1 G-6938 [0,0,0,2,0,0|2,0,0]=4 682 B10R2.320 O=C1N[C@@H]2CCCC[C@H]12 Q58792 [0,0,0,2,0,0|1,0,0]=3