0 B11R1.40 CC(C=O)CC1CCOCC1 Q57822 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.40 CC(CO)CC1CCOCC1 Q57823 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.40 CC(CO)NC1CCCSC1 Q57952 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.40 CC(CO)NC1CCSCC1 Q57912 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.40 COC(=O)CC1CCCNC1 P39389 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.40 COC(=O)CC1CCNCC1 F-4803 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.40 COC(=O)CC1CCOCC1 P40951 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.40 COC(=O)CC1CCSCC1 Q56856 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.40 COC(=O)C[C@@H]1CCCNC1 Q64535 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.40 COC(=O)C[C@H]1CCCNC1 A-199 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.40 NC(CO)CC1CCCCC1 P43163 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.40 NC(CO)CC1CCCCC1 P49922 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.40 N[C@@H](CO)CC1CCCCC1 P39924 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.40 N[C@H](CO)CC1CCCCC1 P34720 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.40 O=CC(Cl)CC1CCNCC1 Q53389 [0,0,0,0,0,0|4,0,0]=4 15 B11R1.40 O=CC(Cl)CC1CCOCC1 Q53392 [0,0,0,0,0,0|4,0,0]=4 16 B11R1.40 O=CC(Cl)CN1CCCCC1 Q53386 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.40 O[C@@H](CCl)CN1CCCCC1 Q62515 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.17 BrCCCC1CCCCC1 P38702 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.17 BrCCCC1CCOCC1 Q61433 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.17 CCCCC1CCNCC1 M23876 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.17 CCCNC1CCOCC1 P40159 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.17 CCCOC1CCNCC1 P35257 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.17 CCOCC1CCCNC1 Q60046 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.17 CCOCC1CCCNC1 S72607 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.17 CNCCC1CCCCC1 P34718 [1,0,0,0,0,0|0,0,0]=1 26 B10R1.17 CNCCC1CCCCC1 P35769 [1,0,0,0,0,0|0,0,0]=1 27 B10R1.17 CNCCN1CCCCC1 P38178 [1,0,0,0,0,0|1,0,0]=2 28 B10R1.17 CNCCN1CCOCC1 P38177 [1,0,0,0,0,0|2,0,0]=3 29 B10R1.17 COCCC1CCNCC1 G-6223 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.17 COCCC1CCNCC1 I-9932 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.17 CONCC1CCCCC1 Q59667 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.17 CONCC1CCOCC1 Q57796 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.17 CONCC1CCOCC1 Q57797 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.17 ICCCC1CCCCC1 P41134 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.17 N#CCCC1CCCCO1 Q57794 [1,0,0,0,0,0|3,0,0]=4 36 B10R1.17 NCCCC1CCCCC1 P34722 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.17 NCCCC1CCOCC1 Q57757 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.17 NCCCC1CCOCC1 Q57758 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.17 NCCCN1CCCCC1 P39451 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.17 NNCCC1CCCCC1 Q59501 [1,0,0,0,0,0|1,0,0]=2 41 B10R1.17 O=CCCC1CCNCC1 Q53388 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.17 O=CCCC1CCOCC1 Q57776 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.17 OCCCC1CCCCC1 P42600 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.17 OCCCC1CCNCC1 P36532 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.17 OCCCC1CCOCC1 Q57775 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.17 OCCCN1CCCCC1 Q55769 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.17 [N-]=[N+]=NCC1CCCCC1 O28238 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.18 CC(=O)CC1CCOCC1 Q57610 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.18 CC(C)CC1CCCNC1 Q59857 [1,0,0,0,0,0|1,0,0]=2 50 B10R1.18 CC(C)CC1CCNCC1 Q59854 [1,0,0,0,0,0|1,0,0]=2 51 B10R1.18 CC(C)C[C@@H]1COCCN1 B-1251 [1,0,0,0,0,0|2,0,0]=3 52 B10R1.18 CC(C)C[C@H]1COCCN1 B-1250 [1,0,0,0,0,0|2,0,0]=3 53 B10R1.18 CC(C)NC1CCOCC1 P39624 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.18 CC(C)OC1CCNCC1 P42674 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.18 CC(N)CC1CCOCC1 Q57760 [1,0,0,0,0,0|1,0,0]=2 56 B10R1.18 CC(N)CC1CCOCC1 Q57761 [1,0,0,0,0,0|1,0,0]=2 57 B10R1.18 CC(N)CN1CCNCC1 P36152 [1,0,0,0,0,0|2,0,0]=3 58 B10R1.18 CC(O)CC1CCNCC1 O29758 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.18 CC(O)CC1CCOCC1 Q57644 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.18 CC(O)CN1CCNCC1 L18638 [1,0,0,0,0,0|3,0,0]=4 61 B10R1.18 CN(C)CC1CCCCN1 O28384 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.18 CN(C)CC1CCCNC1 O28861 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.18 CN(C)CC1CCNCC1 M22688 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.18 CN(C)CC1CNCCO1 O28299 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.18 CN(C)CC1COCCN1 O27852 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.18 CN(C)C[C@@H]1CCCCN1 P42604 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.18 CN(C)C[C@@H]1CCCNC1 P39324 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.18 CN(C)C[C@@H]1CNCCO1 O28126 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.18 CN(C)C[C@H]1CCCCN1 P40318 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.18 CN(C)C[C@H]1CCCNC1 P34943 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.18 CN(C)C[C@H]1CNCCO1 O28247 [1,0,0,0,0,0|3,0,0]=4 72 B10R1.18 FC(F)CC1CCNCC1 Q63396 [1,0,0,0,0,0|3,0,0]=4 73 B10R1.18 NC(=O)CC1CCCCO1 Q57816 [1,0,0,0,0,0|2,0,1]=4 74 B10R1.18 NC(=S)CN1CCCCC1 S72504 [1,0,0,0,0,0|2,0,1]=4 75 B12R1.32 CCNC(=O)CC1CCCCN1 Q57495 [0,1,0,0,0,0|2,0,1]=4 76 B12R1.32 CN(CCN)CC1CCCOC1 Q57781 [0,1,0,0,0,0|3,0,0]=4 77 B12R1.32 CN(CCN)CC1CCCOC1 Q57782 [0,1,0,0,0,0|3,0,0]=4 78 B12R1.32 C[C@@H](CCN)OC1CCCCO1 Q57863 [0,1,0,0,0,0|3,0,0]=4 79 B12R1.32 C[C@H](CCN)OC1CCCCO1 Q57860 [0,1,0,0,0,0|3,0,0]=4 80 B12R1.34 COC(=O)C(Br)C1CCCCC1 P37218 [0,1,0,0,0,0|2,0,1]=4 81 B12R1.34 COC(=O)C(N)C1CCCCC1 P38829 [0,1,0,0,0,0|2,0,1]=4 82 B12R1.34 CON(C)C(=O)C1CCCCC1 L13811 [0,1,0,0,0,0|2,0,1]=4 83 B12R1.43 CC(=O)N(C)CC1CCNCC1 Q65253 [0,1,0,0,0,0|3,0,0]=4 84 B12R1.43 CC(OC1CCCCC1)C(=O)O O30026 [0,1,0,0,0,0|3,0,0]=4 85 B12R1.43 NC(=O)C(N)CC1CCCCC1 P46427 [0,1,0,0,0,0|3,0,0]=4 86 B12R1.43 NC(CC1CCCCC1)C(=O)O P38056 [0,1,0,0,0,0|3,0,0]=4 87 B12R1.43 NC(CC1CCCCC1)C(=O)O P44690 [0,1,0,0,0,0|3,0,0]=4 88 B12R1.43 O=C(O)C(O)CC1CCCCC1 P39330 [0,1,0,0,0,0|3,0,0]=4 89 B12R1.43 O=C(O)[C@@H](O)CC1CCCCC1 P37004 [0,1,0,0,0,0|3,0,0]=4 90 B12R1.43 O=C(O)[C@H](O)CC1CCCCC1 P40940 [0,1,0,0,0,0|3,0,0]=4 91 B12R1.49 CC1CCC(NC(C)CO)CC1 Q59718 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.49 CCC(C)NC1CCN(C)CC1 Q59976 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.49 CCC(O)CN1CCC(N)CC1 Q57540 [0,1,0,0,0,0|3,0,0]=4 94 B12R1.49 CCC(O)CN1CCC(N)CC1 Q57541 [0,1,0,0,0,0|3,0,0]=4 95 B12R1.49 COC(=O)CC1CCC(N)CC1 P38887 [0,1,0,0,0,0|2,0,1]=4 96 B12R1.49 COC(=O)CC1CCC(O)CC1 K12394 [0,1,0,0,0,0|2,0,1]=4 97 B12R1.50 CC1CCCC(NC(C)CO)C1 Q59713 [0,1,0,0,0,0|3,0,0]=4 98 B12R1.118 CCC(CO)NC1CCCSC1 Q57948 [0,1,0,0,0,0|3,0,0]=4 99 B12R1.118 CCC(CO)NC1CCSCC1 Q58008 [0,1,0,0,0,0|3,0,0]=4 100 B12R1.118 NCC(CO)CC1CCCCC1 Q59806 [0,1,0,0,0,0|2,0,0]=3 101 B12R1.118 NCC(CO)CC1CCOCC1 Q57759 [0,1,0,0,0,0|3,0,0]=4 102 B12R1.194 CC(C)(C=O)CN1CCCCC1 P44635 [0,1,0,0,0,0|3,0,0]=4 103 B12R1.194 CC(C)(CN)CC1CCOCC1 Q57658 [0,1,0,0,0,0|3,0,0]=4 104 B12R1.371 CC(CO)NC1CCCCC1C Q59715 [0,1,0,0,0,0|3,0,0]=4 105 B12R1.371 COC(=O)CC1CCCCC1O P45293 [0,1,0,0,0,0|2,0,1]=4 106 B12R1.3524 COC(=O)CC1(N)CCCCC1 P43057 [0,1,0,0,0,0|2,0,1]=4 107 B12R2.24 CC1CN2CCCCC2CN1 Q58045 [0,0,0,1,0,0|1,0,0]=2 108 B12R2.24 CC1CNC2CCCCC2O1 Q58025 [0,0,0,1,0,0|3,0,0]=4 109 B12R2.24 NC1CCC2NCCCC2C1 Q59515 [0,0,0,1,0,0|3,0,0]=4 110 B12R2.24 O=C1CN2CCCCC2CN1 Q59920 [0,0,0,1,0,0|2,0,1]=4 111 B12R2.24 [C@H]12CC[C@H](O)C[C@H]1CCNC2 Q56966 [0,0,0,1,0,0|3,0,0]=4 112 B12R2.29 CNC1C[C@@H]2CCCN(C1)C2 P48269 [0,0,0,1,0,0|1,0,0]=2 113 B12R2.29 [C@H]12CCC[C@H](C[C@@H](C#N)C1)N2 G-6475 [0,0,0,1,0,0|3,0,0]=4 114 B12R2.32 N#CC1CC2CCCCN2C1 Q59249 [0,0,0,1,0,0|3,0,0]=4 115 B12R2.32 [C@@H]12CNCCN1C[C@H](OC)C2 Q57140 [0,0,0,1,0,0|3,0,0]=4 116 B12R2.32 [C@H]12CNCCN1C[C@H](OC)C2 Q57139 [0,0,0,1,0,0|3,0,0]=4 117 B12R2.594 O=C1CC2CCCC(CN1)N2 P49370 [0,0,0,1,0,0|2,0,1]=4 118 B12R2.1772 COC1CC2(CCCNC2)C1 Q63790 [0,0,0,1,0,0|2,0,0]=3 119 B12R2.1772 FCC1CC2(CCNCC2)C1 Q64623 [0,0,0,1,0,0|3,0,0]=4 120 B12R2.1772 N#CC1CC2(CCNCC2)C1 Q62884 [0,0,0,1,0,0|3,0,0]=4 121 B12R2.1772 NCC1CC2(CCNCC2)C1 Q53941 [0,0,0,1,0,0|3,0,0]=4 122 B12R2.1772 NCC1CC2(CCOCC2)C1 I-9066 [0,0,0,1,0,0|3,0,0]=4 123 B12R2.1772 NCC1CC2(CCOCC2)C1 Q57103 [0,0,0,1,0,0|3,0,0]=4 124 B12R2.1772 NNC1CC2(CCOCC2)C1 Q55829 [0,0,0,1,0,0|2,0,0]=3 125 B12R2.1772 O=CC1CC2(CCOCC2)C1 Q61460 [0,0,0,1,0,0|3,0,0]=4 126 B12R2.1772 OCC1CC2(CCNCC2)C1 Q64621 [0,0,0,1,0,0|3,0,0]=4 127 B12R2.1772 OCC1CC2(CCOCC2)C1 Q61461 [0,0,0,1,0,0|3,0,0]=4 128 B12R2.2058 C1CC(CN2CCNCC2)C1 P35540 [0,0,0,1,0,0|3,0,0]=4 129 B12R2.2058 C1CC(NC2CCOCC2)C1 P35449 [0,0,0,1,0,0|3,0,0]=4 130 B12R2.2799 CN1C(=O)CC12CCNCC2 Q63838 [0,0,0,1,0,0|2,0,1]=4 131 B12R2.2918 CN1CCC2(CCCCN2)C1 Q55082 [0,0,0,1,0,0|3,0,0]=4 132 B12R2.2918 CN1CCC2(CCCNC2)C1 P44418 [0,0,0,1,0,0|3,0,0]=4 133 B12R2.2918 CN1CCC2(CCNCC2)C1 Q55074 [0,0,0,1,0,0|3,0,0]=4 134 B12R2.2918 FC1CCC2(CCNCC2)C1 Q63482 [0,0,0,1,0,0|3,0,0]=4 135 B12R2.2918 O=C1CC2(CCCNC2)CN1 P44330 [0,0,0,1,0,0|2,0,1]=4 136 B12R2.2918 O=C1CC2(CCNCC2)CN1 C-3479 [0,0,0,1,0,0|2,0,1]=4 137 B12R2.2918 O=C1CC2(CCNCC2)CN1 L22504 [0,0,0,1,0,0|2,0,1]=4 138 B12R2.2918 O=C1CC2(CCOCC2)CN1 G-5754 [0,0,0,1,0,0|2,0,1]=4 139 B12R2.2918 O=C1NCC2(CCCCC2)O1 Q59561 [0,0,0,1,0,0|2,0,1]=4 140 B10R1.15 C#CC(N)C1CCCCC1 Q59586 [0,0,0,0,1,0|2,0,1]=4 141 B10R1.15 C#CC(O)C1CCCCC1 O29914 [0,0,0,0,1,0|2,0,1]=4 142 B10R1.15 CC(CN)C1CCCCC1 Q59743 [0,0,0,0,1,0|2,0,0]=3 143 B10R1.15 CC(NN)C1CCCCC1 L20938 [0,0,0,0,1,0|1,0,0]=2 144 B10R1.15 CCC(N)C1CCCCC1 P45080 [0,0,0,0,1,0|2,0,0]=3 145 B10R1.15 CCC(N)C1CCOCC1 Q57647 [0,0,0,0,1,0|3,0,0]=4 146 B10R1.15 CNC(=O)C1CCCCN1 O28556 [0,0,0,0,1,0|2,0,1]=4 147 B10R1.15 CNC(=O)C1CCCNC1 O28821 [0,0,0,0,1,0|2,0,1]=4 148 B10R1.15 CNC(=O)C1CCNCC1 O28891 [0,0,0,0,1,0|2,0,1]=4 149 B10R1.15 CNC(=O)[C@@H]1CCCCN1 P39879 [0,0,0,0,1,0|2,0,1]=4 150 B10R1.15 CNC(=O)[C@@H]1CCCNC1 L14635 [0,0,0,0,1,0|2,0,1]=4 151 B10R1.15 CNC(=O)[C@H]1CCCCN1 P39159 [0,0,0,0,1,0|2,0,1]=4 152 B10R1.15 CNC(=O)[C@H]1CCCNC1 P42603 [0,0,0,0,1,0|2,0,1]=4 153 B10R1.15 CNC(C)C1CCCCC1 O32069 [0,0,0,0,1,0|0,0,0]=1 154 B10R1.15 NC(CO)C1CCCCC1 P34733 [0,0,0,0,1,0|3,0,0]=4 155 B10R1.15 NCC(O)C1CCCCC1 P45451 [0,0,0,0,1,0|3,0,0]=4 156 B10R1.15 N[C@@H](CO)C1CCCCC1 P35745 [0,0,0,0,1,0|3,0,0]=4 157 B10R1.15 N[C@H](CO)C1CCCCC1 P35847 [0,0,0,0,1,0|3,0,0]=4 158 B10R1.15 [C@@H]1([C@H](C)CC)COCCN1 B-1253 [0,0,0,0,1,0|3,0,0]=4 159 B10R1.15 [C@H]1([C@@H](C)CC)COCCN1 B-1252 [0,0,0,0,1,0|3,0,0]=4 160 B10R1.27 COC(=O)CC1CCCC1 P39146 [0,0,0,0,1,0|2,0,1]=4 161 B12R1.27 CC(CO)NCC1CCCCC1 Q59710 [0,0,0,0,0,1|2,0,0]=3 162 B12R1.27 CC(CO)NCC1CCOCC1 Q57752 [0,0,0,0,0,1|3,0,0]=4 163 B12R1.27 CCC(N)CCC1CCCCC1 Q59705 [0,0,0,0,0,1|2,0,0]=3 164 B9R0.18 CCCCC(N)CCCC M15282 [1,0,1,0,0,0|2,0,0]=4 165 B9R1.8 BrCCC1CCCCC1 P40749 [2,0,0,0,0,0|1,0,0]=3 166 B9R1.8 BrCCC1CCOCC1 P37969 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.8 CCCC1CCCNC1 Q59858 [2,0,0,0,0,0|1,0,0]=3 168 B9R1.8 CCCC1CCNCC1 M22635 [2,0,0,0,0,0|1,0,0]=3 169 B9R1.8 CCC[C@@H]1CCCCN1 Q54719 [2,0,0,0,0,0|1,0,0]=3 170 B9R1.8 CCNC1CCOCC1 M15174 [2,0,0,0,0,0|2,0,0]=4 171 B9R1.8 CCOC1CCCNC1 P42499 [2,0,0,0,0,0|2,0,0]=4 172 B9R1.8 CCOC1CCNCC1 P42609 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.8 CNCC1CCCCC1 P39298 [2,0,0,0,0,0|0,0,0]=2 174 B9R1.8 CNCC1CCCCC1 Q59474 [2,0,0,0,0,0|0,0,0]=2 175 B9R1.8 CNCC1CCCOC1 L14590 [2,0,0,0,0,0|1,0,0]=3 176 B9R1.8 CNCC1CCOCC1 I-9263 [2,0,0,0,0,0|1,0,0]=3 177 B9R1.8 CNCC1COCCO1 Q70163 [2,0,0,0,0,0|2,0,0]=4 178 B9R1.8 CNC[C@@H]1COCCO1 P44854 [2,0,0,0,0,0|2,0,0]=4 179 B9R1.8 CNC[C@H]1COCCO1 P46411 [2,0,0,0,0,0|2,0,0]=4 180 B9R1.8 COCC1CCCCN1 O28609 [2,0,0,0,0,0|2,0,0]=4 181 B9R1.8 COCC1CCCCN1 Q60043 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.8 COCC1CCCNC1 O28836 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.8 COCC1CCNCC1 L21390 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.8 COC[C@@H]1CCCNC1 P35700 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.8 COC[C@H]1CCCNC1 P35650 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.8 ClCCC1CCOCC1 Q57792 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.8 FCCC1CCCNC1 Q57445 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.8 FCCC1CCNCC1 Q57446 [2,0,0,0,0,0|2,0,0]=4 189 B9R1.8 FCCC1CCNCC1 Q57447 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.8 ICCC1CCOCC1 O29698 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.8 N#CCC1CCCCC1 P38061 [2,0,0,0,0,0|0,0,2]=4 192 B9R1.8 NCCC1CCCCC1 P34723 [2,0,0,0,0,0|0,0,0]=2 193 B9R1.8 NCCC1CCCCO1 P38225 [2,0,0,0,0,0|1,0,0]=3 194 B9R1.8 NCCC1CCCOC1 S72503 [2,0,0,0,0,0|1,0,0]=3 195 B9R1.8 NCCC1CCOCC1 G-5344 [2,0,0,0,0,0|1,0,0]=3 196 B9R1.8 NCCC1CCSCC1 Q56858 [2,0,0,0,0,0|1,0,0]=3 197 B9R1.8 NCCC1COCCN1 O27851 [2,0,0,0,0,0|2,0,0]=4 198 B9R1.8 NNCC1CCCCC1 P44365 [2,0,0,0,0,0|1,0,0]=3 199 B9R1.8 NNCC1CCCCO1 L20946 [2,0,0,0,0,0|2,0,0]=4 200 B9R1.8 NNCC1CCCCO1 Q57605 [2,0,0,0,0,0|2,0,0]=4 201 B9R1.8 NNCC1CCCOC1 Q52421 [2,0,0,0,0,0|2,0,0]=4 202 B9R1.8 NNCC1CCOCC1 L20783 [2,0,0,0,0,0|2,0,0]=4 203 B9R1.8 O=CCC1CCCCC1 P34717 [2,0,0,0,0,0|1,0,1]=4 204 B9R1.8 OCCC1CCCCC1 P44676 [2,0,0,0,0,0|1,0,0]=3 205 B9R1.8 OCCC1CCCCO1 P38380 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.8 OCCC1CCCNC1 P36369 [2,0,0,0,0,0|2,0,0]=4 207 B9R1.8 OCCC1CCNCC1 P45391 [2,0,0,0,0,0|2,0,0]=4 208 B9R1.8 OCCC1CCOCC1 C-3414 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.8 OCCC1CCSCC1 Q56857 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.8 OCC[C@@H]1CCCCN1 O33566 [2,0,0,0,0,0|2,0,0]=4 211 B9R1.8 OCC[C@@H]1CCCCO1 Q53045 [2,0,0,0,0,0|2,0,0]=4 212 B11R0.4 CCCCCCCN(C)CCO Q66065 [0,1,1,0,0,0|2,0,0]=4 213 B11R1.1 COCCN1CCC(O)CC1 L14928 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.24 COCCN1CCCC(N)C1 Q54960 [1,1,0,0,0,0|2,0,0]=4 215 B11R1.24 COCCN1CCC[C@@H](N)C1 Q54961 [1,1,0,0,0,0|2,0,0]=4 216 B11R1.24 COCCN1CCC[C@H](N)C1 Q54962 [1,1,0,0,0,0|2,0,0]=4 217 B11R1.28 BrCCCCC1CCOCC1 Q61434 [1,1,0,0,0,0|2,0,0]=4 218 B11R1.28 CCCCNC1CCCSC1 Q57936 [1,1,0,0,0,0|2,0,0]=4 219 B11R1.28 CNCCCC1CCCCC1 P37923 [1,1,0,0,0,0|0,0,0]=2 220 B11R1.28 CNCCCC1CCCCC1 P40072 [1,1,0,0,0,0|0,0,0]=2 221 B11R1.28 CNCCCN1CCOCC1 P34750 [1,1,0,0,0,0|2,0,0]=4 222 B11R1.28 NCCCCN1CCCCC1 P36333 [1,1,0,0,0,0|2,0,0]=4 223 B11R1.91 CC(C)CCC1CCCCN1 Q59855 [1,1,0,0,0,0|2,0,0]=4 224 B11R1.91 CC(C)CCC1CCCNC1 Q59856 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.91 CC(C)CCC1CCNCC1 Q59853 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.20 CC(C)OC1CCC(=O)CC1 P45305 [1,1,0,0,0,0|1,0,1]=4 227 B11R1.20 CC(C)OC1CCC(N)CC1 10139 [1,1,0,0,0,0|1,0,0]=3 228 B11R1.20 CC(F)CN1CCC(N)CC1 O32450 [1,1,0,0,0,0|2,0,0]=4 229 B11R1.20 CN(C)CC1CCN(C)CC1 O32167 [1,1,0,0,0,0|2,0,0]=4 230 B11R1.20 CN(C)C[C@H]1CC[C@H](N)CC1 P45046 [1,1,0,0,0,0|1,0,0]=3 231 B11R1.20 CN(C)C[C@H]1CC[C@H](N)CC1 P48624 [1,1,0,0,0,0|1,0,0]=3 232 B11R1.20 CN(C)C[C@H]1CC[C@H](N)CC1 P48625 [1,1,0,0,0,0|1,0,0]=3 233 B11R1.20 CN(C)C[C@H]1CC[C@H](N)CC1 P50888 [1,1,0,0,0,0|1,0,0]=3 234 B11R1.36 CC(C)N(C)C1CCNCC1 Q57478 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.36 C[C@@H](N)C(=O)N1CCCCC1 P36436 [1,1,0,0,0,0|1,0,1]=4 236 B11R1.36 C[C@H](N)C(=O)N1CCCCC1 P35104 [1,1,0,0,0,0|1,0,1]=4 237 B11R1.86 CC(C)OC1CCCCC1N P49135 [1,1,0,0,0,0|1,0,0]=3 238 B11R1.86 CC(C)O[C@@H]1CCCC[C@@H]1N P45278 [1,1,0,0,0,0|1,0,0]=3 239 B11R1.86 CC(C)O[C@H]1CCCC[C@H]1N P45209 [1,1,0,0,0,0|1,0,0]=3 240 B11R1.86 CC(C)SC1CCCCC1O Q59607 [1,1,0,0,0,0|1,0,0]=3 241 B11R1.86 CN(C)CC1CCCCC1=O 10756 [1,1,0,0,0,0|1,0,1]=4 242 B11R1.157 CC(C)CC1CC(N)CCO1 Q57695 [1,1,0,0,0,0|1,0,0]=3 243 B11R1.509 CC(C)(C)OC1CCNCC1 Q59865 [1,1,0,0,0,0|2,0,0]=4 244 B11R1.509 CC(C)(O)CN1CCNCC1 H-8942 [1,1,0,0,0,0|2,0,0]=4 245 B11R1.928 CC(C)CC1(N)CCOCC1 Q61446 [1,1,0,0,0,0|1,0,0]=3 246 B11R1.928 CN(C)CC1(F)CCNCC1 Q63388 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.928 CN(C)CC1(F)CCNCC1 Q63389 [1,1,0,0,0,0|2,0,0]=4 248 B11R1.928 CN(C)CC1(F)CCNCC1 Q63390 [1,1,0,0,0,0|2,0,0]=4 249 B11R1.7 CC(C)(C#N)C1CCCCC1 Q59605 [0,1,0,0,1,0|2,0,0]=4 250 B11R1.7 CC(C)(CN)C1CCCCC1 Q59542 [0,1,0,0,1,0|2,0,0]=4 251 B11R1.23 CNC(=O)C1CCCC(N)C1 Q59684 [0,1,0,0,1,0|1,0,1]=4 252 B13R1.11 CC(CO)NC(C)C1CCCCC1 Q59741 [0,1,0,0,0,1|2,0,0]=4 253 B13R1.14 CCC(C)CNC1CCN(C)CC1 Q57501 [0,1,0,0,0,1|2,0,0]=4 254 B13R1.135 CNC(=O)C(N)CC1CCCCC1 P46833 [0,1,0,0,0,1|1,0,1]=4 255 B13R1.254 CC(C)(CO)NCC1CCCCC1 Q59677 [0,1,0,0,0,1|2,0,0]=4 256 B13R1.254 CCC(C)(C)NCC1CCOCC1 Q57742 [0,1,0,0,0,1|2,0,0]=4 257 B13R1.417 CCC(CO)NCC1CCCCC1 Q59637 [0,1,0,0,0,1|1,0,0]=3 258 B13R1.417 CCC(CO)NCC1CCOCC1 Q57750 [0,1,0,0,0,1|2,0,0]=4 259 B13R1.528 CCC(C)CNC1CCCCC1O Q59813 [0,1,0,0,0,1|1,0,0]=3 260 B13R1.2045 CCC(C)NCC1(O)CCCCC1 Q59757 [0,1,0,0,0,1|1,0,0]=3 261 B13R1.19 CCCC(C)NC1CCC(O)CC1 Q59697 [0,2,0,0,0,0|2,0,0]=4 262 B13R1.19 COCC(C)NC1CCC(O)CC1 Q59820 [0,2,0,0,0,0|2,0,0]=4 263 B13R1.470 CCCC(C)NC1CCCCC1O Q59672 [0,2,0,0,0,0|2,0,0]=4 264 B13R1.470 COCC(C)NC1CCCCC1O Q59673 [0,2,0,0,0,0|2,0,0]=4 265 B13R1.133 CC(C)C(C)NC1CCC(O)CC1 Q59695 [0,2,0,0,0,0|2,0,0]=4 266 B13R1.202 CC(C)C(C)NC1CCCCC1O Q59674 [0,2,0,0,0,0|2,0,0]=4 267 B13R1.145 CCC(CO)NC1CCC(C)CC1 Q59634 [0,2,0,0,0,0|2,0,0]=4 268 B11R1.189 COC1CCCC(CCN)C1 P49886 [0,0,1,1,0,0|2,0,0]=4 269 B11R2.1 CN1CCC2CCNCC21 L21754 [1,0,0,1,0,0|1,0,0]=3 270 B11R2.1 CN1CCC2CCNCC21 Q55712 [1,0,0,1,0,0|1,0,0]=3 271 B11R2.1 CN1CCC2CCNCC21 Q55713 [1,0,0,1,0,0|1,0,0]=3 272 B11R2.1 CN1CCC2CNCCC21 L14401 [1,0,0,1,0,0|1,0,0]=3 273 B11R2.1 CN1CCC2CNCCC21 Q55710 [1,0,0,1,0,0|1,0,0]=3 274 B11R2.1 CN1CCC2NCCCC21 Q55706 [1,0,0,1,0,0|1,0,0]=3 275 B11R2.1 CN1CCC2NCCCC21 Q55707 [1,0,0,1,0,0|1,0,0]=3 276 B11R2.12 CN1CCC12CCCNC2 Q55075 [1,0,0,1,0,0|1,0,0]=3 277 B11R2.12 CN1CCC12CCNCC2 O33136 [1,0,0,1,0,0|1,0,0]=3 278 B11R2.12 NC1CCC12CCCCC2 Q55999 [1,0,0,1,0,0|2,0,0]=4 279 B11R2.12 O=C1CCC12CCCCC2 P45800 [1,0,0,1,0,0|2,0,0]=4 280 B11R2.12 OC1CCC12CCCCC2 P45421 [1,0,0,1,0,0|2,0,0]=4 281 B11R2.20 C1CCN2CCNCC2C1 P38065 [1,0,0,1,0,0|1,0,0]=3 282 B11R2.20 C1CCN2CCNC[C@@H]2C1 L18360 [1,0,0,1,0,0|1,0,0]=3 283 B11R2.20 C1CCN2CCNC[C@H]2C1 L18243 [1,0,0,1,0,0|1,0,0]=3 284 B11R2.20 C1CCN2CCNC[C@H]2C1 L22240 [1,0,0,1,0,0|1,0,0]=3 285 B11R2.20 C1CN2CCOCC2CN1 G-7469 [1,0,0,1,0,0|2,0,0]=4 286 B11R2.20 C1CN2CCOCC2CN1 Q61064 [1,0,0,1,0,0|2,0,0]=4 287 B11R2.20 C1CN2CCOC[C@@H]2CN1 Q52053 [1,0,0,1,0,0|2,0,0]=4 288 B11R2.20 C1CN2CCOC[C@H]2CN1 Q52054 [1,0,0,1,0,0|2,0,0]=4 289 B11R2.20 C1CNC2CCOCC2C1 Q57318 [1,0,0,1,0,0|2,0,0]=4 290 B11R2.20 C1CNC2CCOCC2C1 Q57319 [1,0,0,1,0,0|2,0,0]=4 291 B11R2.20 C1CNC2COCCC2C1 Q57866 [1,0,0,1,0,0|2,0,0]=4 292 B11R2.20 C1CNC2COCCC2C1 Q57867 [1,0,0,1,0,0|2,0,0]=4 293 B11R2.20 C1CN[C@H]2COCC[C@H]2C1 Q57868 [1,0,0,1,0,0|2,0,0]=4 294 B11R2.20 C1CN[C@H]2COCC[C@H]2C1 Q57869 [1,0,0,1,0,0|2,0,0]=4 295 B11R2.20 C1COC2CCNCC2C1 Q57315 [1,0,0,1,0,0|1,0,0]=3 296 B11R2.20 [C@@H]12CCCCN1CCNC2 M22780 [1,0,0,1,0,0|1,0,0]=3 297 B11R2.20 [C@@H]12CCCCN1CCNC2 P40413 [1,0,0,1,0,0|1,0,0]=3 298 B11R2.20 [C@@H]12CCCN[C@@H]1CNCC2 G-5079 [1,0,0,1,0,0|1,0,0]=3 299 B11R2.20 [C@@H]12CCCN[C@@H]1CNCC2 Q56472 [1,0,0,1,0,0|1,0,0]=3 300 B11R2.20 [C@@H]12CCCN[C@H]1CNCC2 Q55799 [1,0,0,1,0,0|1,0,0]=3 301 B11R2.20 [C@@H]12CNCCN1CCOC2 G-7645 [1,0,0,1,0,0|2,0,0]=4 302 B11R2.20 [C@H]12CCCCN1CCNC2 M23154 [1,0,0,1,0,0|1,0,0]=3 303 B11R2.20 [C@H]12CNCCN1CCOC2 G-7646 [1,0,0,1,0,0|2,0,0]=4 304 B11R2.163 CNC1CN2CCCC1C2 P48285 [1,0,0,1,0,0|1,0,0]=3 305 B11R2.164 CN[C@@H]1CN2CCC1CC2 Q53413 [1,0,0,1,0,0|1,0,0]=3 306 B11R2.164 CN[C@@H]1CN2CCC1CC2 Q53414 [1,0,0,1,0,0|1,0,0]=3 307 B11R2.164 CN[C@H]1CN2CCC1CC2 Q53415 [1,0,0,1,0,0|1,0,0]=3 308 B11R2.164 CN[C@H]1CN2CCC1CC2 Q53416 [1,0,0,1,0,0|1,0,0]=3 309 B11R2.164 N#CC1CC2CCC1CC2 P45306 [1,0,0,1,0,0|2,0,0]=4 310 B11R2.164 NCC1CC2CCC1CC2 F-4875 [1,0,0,1,0,0|2,0,0]=4 311 B11R2.239 C1CC(C2CCCNC2)C1 L19808 [1,0,0,1,0,0|2,0,0]=4 312 B11R2.239 C1CC(C2COC2)CCN1 G-6293 [1,0,0,1,0,0|2,0,0]=4 313 B11R2.239 C1CCN(C2CNC2)CC1 M22674 [1,0,0,1,0,0|1,0,0]=3 314 B11R2.239 C1CN(C2CNC2)CCO1 D-2501 [1,0,0,1,0,0|2,0,0]=4 315 B11R2.239 C1CN(C2CNC2)CCO1 L21599 [1,0,0,1,0,0|2,0,0]=4 316 B11R2.239 C1CN(C2CNC2)CCO1 Q51810 [1,0,0,1,0,0|2,0,0]=4 317 B11R2.1261 C1CC2(CCN1)CCNC2 Q57270 [1,0,0,1,0,0|1,0,0]=3 318 B11R2.1261 C1CC2(CCN1)CCNC2 Q57271 [1,0,0,1,0,0|1,0,0]=3 319 B11R2.1261 C1CC2(CCN1)CCOC2 10018 [1,0,0,1,0,0|2,0,0]=4 320 B11R2.1261 C1CC2(CCN1)CCOC2 10023 [1,0,0,1,0,0|2,0,0]=4 321 B11R2.1261 C1CC2(CCN1)CCOC2 L13666 [1,0,0,1,0,0|2,0,0]=4 322 B11R2.1261 C1CC2(CCN1)CCSC2 Q59448 [1,0,0,1,0,0|2,0,0]=4 323 B11R2.1261 C1CC2(CCOCC2)CN1 C-3456 [1,0,0,1,0,0|1,0,0]=3 324 B11R2.1261 C1CC2(CCOCC2)CN1 G-5028 [1,0,0,1,0,0|1,0,0]=3 325 B11R2.1261 C1CC2(CCOCC2)CN1 G-5029 [1,0,0,1,0,0|1,0,0]=3 326 B11R2.1261 C1CC2(CCOCC2)CN1 Q51911 [1,0,0,1,0,0|1,0,0]=3 327 B11R2.1261 C1CCC2(C1)CCCNC2 Q53928 [1,0,0,1,0,0|2,0,0]=4 328 B11R2.1261 C1CCC2(C1)CCCNC2 Q53929 [1,0,0,1,0,0|2,0,0]=4 329 B11R2.1261 C1CCC2(C1)CCNCC2 10048 [1,0,0,1,0,0|2,0,0]=4 330 B11R2.1261 C1CCC2(C1)CCNCC2 F-4557 [1,0,0,1,0,0|2,0,0]=4 331 B11R2.1261 C1CCC2(CC1)CCCN2 Q54145 [1,0,0,1,0,0|2,0,0]=4 332 B11R2.1261 C1CCC2(CC1)CCNC2 L18075 [1,0,0,1,0,0|0,0,0]=2 333 B11R2.1261 C1CCC2(CCNC2)NC1 Q53989 [1,0,0,1,0,0|1,0,0]=3 334 B11R2.1261 C1CCC2(CCNC2)NC1 Q53990 [1,0,0,1,0,0|1,0,0]=3 335 B11R2.1261 C1CCC2(CCNC2)OC1 Q53891 [1,0,0,1,0,0|1,0,0]=3 336 B11R2.1261 C1CCC2(CCNC2)OC1 Q53892 [1,0,0,1,0,0|1,0,0]=3 337 B11R2.1261 C1CCC2(CCOC2)NC1 Q63347 [1,0,0,1,0,0|2,0,0]=4 338 B11R2.1261 C1CNCC2(C1)CCNC2 Q54003 [1,0,0,1,0,0|1,0,0]=3 339 B11R2.1261 C1CNCC2(C1)CCNC2 Q54004 [1,0,0,1,0,0|1,0,0]=3 340 B11R2.1261 C1CNCC2(C1)CCOC2 Q52341 [1,0,0,1,0,0|2,0,0]=4 341 B11R2.1261 C1CNCC2(C1)CCOC2 Q52342 [1,0,0,1,0,0|2,0,0]=4 342 B11R2.1261 C1CNCC2(C1)CCSC2 Q59458 [1,0,0,1,0,0|2,0,0]=4 343 B11R2.1261 C1COCC2(C1)CCNC2 I-9449 [1,0,0,1,0,0|1,0,0]=3 344 B11R2.1261 C1COCC2(C1)CCNC2 Q62213 [1,0,0,1,0,0|1,0,0]=3 345 B11R2.10 CN1CC2CCCNC2C1 Q52604 [1,0,0,1,0,0|2,0,0]=4 346 B11R2.10 CN1CC2CCNCC2C1 H-8698 [1,0,0,1,0,0|2,0,0]=4 347 B11R2.10 CN1CC2CCNCC2C1 L18068 [1,0,0,1,0,0|2,0,0]=4 348 B11R2.10 CN1C[C@H]2CCCN[C@H]2C1 Q59230 [1,0,0,1,0,0|2,0,0]=4 349 B11R2.10 NC1CC2CCCCN2C1 Q59235 [1,0,0,1,0,0|1,0,0]=3 350 B11R2.10 OC1CC2CCCCN2C1 Q59335 [1,0,0,1,0,0|2,0,0]=4 351 B11R2.10 O[C@@H]1C[C@@H]2CNCC[C@@H]2C1 Q56909 [1,0,0,1,0,0|2,0,0]=4 352 B11R2.10 O[C@H]1C[C@@H]2CNCC[C@@H]2C1 Q56910 [1,0,0,1,0,0|2,0,0]=4 353 B11R2.433 NC1CC2CCN(CC2)C1 P44116 [1,0,0,1,0,0|1,0,0]=3 354 B11R2.433 O=C1CC2CCC(CC2)N1 P45473 [1,0,0,1,0,0|1,0,1]=4 355 B11R2.508 CC1(N)CN2CCC1CC2 P46168 [1,0,0,1,0,0|1,0,0]=3 356 B11R2.678 CN1CC2CCCC(C1)N2 P44899 [1,0,0,1,0,0|2,0,0]=4 357 B11R2.678 FC1CC2CCCC(C1)N2 P48045 [1,0,0,1,0,0|2,0,0]=4 358 B11R2.678 F[C@@H]1C[C@@H]2CCC[C@H](C1)N2 P50328 [1,0,0,1,0,0|2,0,0]=4 359 B11R2.678 F[C@H]1C[C@@H]2CCC[C@H](C1)N2 P50332 [1,0,0,1,0,0|2,0,0]=4 360 B11R2.678 NC1C[C@@H]2CCCN(C1)C2 P48270 [1,0,0,1,0,0|1,0,0]=3 361 B11R2.678 N[C@@H]1C[C@H]2CCC[C@H](C2)C1 F-4876 [1,0,0,1,0,0|0,0,0]=2 362 B11R2.678 OC1CC2CCCC(C1)N2 A-972 [1,0,0,1,0,0|2,0,0]=4 363 B11R2.678 OC1CC2CNCC(C1)C2 P44066 [1,0,0,1,0,0|2,0,0]=4 364 B11R2.678 OC1CC2CNCC(C1)C2 P46536 [1,0,0,1,0,0|2,0,0]=4 365 B11R2.678 OC1C[C@@H]2CCCN(C1)C2 P48268 [1,0,0,1,0,0|2,0,0]=4 366 B11R2.678 O[C@@H]1CC2CCC[C@H](C1)N2 I-9251 [1,0,0,1,0,0|2,0,0]=4 367 B11R2.678 O[C@@H]1C[C@@H]2CCC[C@H](C1)N2 P45547 [1,0,0,1,0,0|2,0,0]=4 368 B11R2.678 O[C@H]1CC2CCC[C@H](C1)N2 I-9187 [1,0,0,1,0,0|2,0,0]=4 369 B11R2.678 O[C@H]1C[C@@H]2CCC[C@H](C1)N2 P45861 [1,0,0,1,0,0|2,0,0]=4 370 B11R2.703 CC1CC2(CCNCC2)C1 Q54786 [1,0,0,1,0,0|1,0,0]=3 371 B11R2.703 CN1CC2(CCCCN2)C1 Q55080 [1,0,0,1,0,0|2,0,0]=4 372 B11R2.703 CN1CC2(CCCNC2)C1 Q63645 [1,0,0,1,0,0|2,0,0]=4 373 B11R2.703 CN1CC2(CCNCC2)C1 O33465 [1,0,0,1,0,0|2,0,0]=4 374 B11R2.703 FC1CC2(CCCCN2)C1 Q63477 [1,0,0,1,0,0|2,0,0]=4 375 B11R2.703 FC1CC2(CCCNC2)C1 Q63476 [1,0,0,1,0,0|2,0,0]=4 376 B11R2.703 NC1CC2(CCCCC2)C1 Q54787 [1,0,0,1,0,0|0,0,0]=2 377 B11R2.703 NC1CC2(CCNCC2)C1 Q53942 [1,0,0,1,0,0|1,0,0]=3 378 B11R2.703 NC1CC2(CCOCC2)C1 Q61462 [1,0,0,1,0,0|1,0,0]=3 379 B11R2.703 O=C1CC2(CCCCC2)C1 P45799 [1,0,0,1,0,0|1,0,1]=4 380 B11R2.703 OC1CC2(CCCNC2)C1 Q63789 [1,0,0,1,0,0|2,0,0]=4 381 B11R2.703 OC1CC2(CCNCC2)C1 L14291 [1,0,0,1,0,0|2,0,0]=4 382 B11R2.703 OC1C[N+]2(CCCCC2)C1 Q55781 [1,0,0,1,0,0|2,0,0]=4 383 B11R2.853 CN(C)C[C@@]12CNCC1C2 Q57078 [1,0,0,1,0,0|2,0,0]=4 384 B11R2.853 CN(C)C[C@]12CNCC1C2 Q57079 [1,0,0,1,0,0|2,0,0]=4 385 B11R2.40 NC1(C2CCCCC2)CC1 P45665 [0,0,0,1,1,0|2,0,0]=4 386 B11R2.8 CC1CC2CNCC2N1C Q61873 [0,0,0,1,1,0|1,0,0]=3 387 B11R2.15 [C@@H]12CNC[C@@H]1C[C@H](OC)C2 Q64409 [0,0,0,1,1,0|2,0,0]=4 388 B11R2.16 COC1CC2CCC(C1)N2 L20971 [0,0,0,1,1,0|2,0,0]=4 389 B11R2.16 CO[C@@H]1C[C@@H]2CC[C@H](C1)N2 P44147 [0,0,0,1,1,0|2,0,0]=4 390 B11R2.16 CO[C@H]1C[C@@H]2CC[C@H](C1)N2 P47387 [0,0,0,1,1,0|2,0,0]=4 391 B11R2.16 [C@H]12CC[C@H](C[C@H](OC)C1)N2 L13695 [0,0,0,1,1,0|2,0,0]=4 392 B11R2.985 COC1CC2(CCNC2)C1 Q63786 [0,0,0,1,1,0|2,0,0]=4 393 B13R2.10 NC1CCN(C2CCCCC2)C1 P37994 [0,0,0,1,0,1|2,0,0]=4 394 B13R2.32 CN1C(=O)CO[C@@H]2CCCC[C@H]21 Q51802 [0,0,0,1,0,1|1,0,1]=4 395 B13R2.57 CCC1CN2CCCCC2CN1 Q58047 [0,0,0,1,0,1|2,0,0]=4 396 B13R2.99 CCC1(O)CCC12CCCCC2 Q55994 [0,0,0,1,0,1|2,0,0]=4 397 B13R2.5037 O=C1CNC2(CCCCC2)CN1 Q61920 [0,0,0,1,0,1|1,0,1]=4 398 B13R2.6482 N#CC1CC2(CCCCC2)CN1 F-4685 [0,0,0,1,0,1|2,0,0]=4 399 B13R2.64 C1CC(CN2CCOCC2)CN1 P42189 [0,1,0,1,0,0|2,0,0]=4 400 B13R2.64 C1CCN(CC2CCCN2)CC1 P42192 [0,1,0,1,0,0|1,0,0]=3 401 B13R2.64 C1CCN(CC2CCNC2)CC1 Q66251 [0,1,0,1,0,0|1,0,0]=3 402 B13R2.64 C1CCN(C[C@@H]2CCCN2)CC1 P39712 [0,1,0,1,0,0|1,0,0]=3 403 B13R2.64 C1CCN(C[C@H]2CCCN2)CC1 P37305 [0,1,0,1,0,0|1,0,0]=3 404 B13R2.64 C1CNC(CN2CCOCC2)C1 P39715 [0,1,0,1,0,0|2,0,0]=4 405 B13R2.64 C1CN[C@@H](CN2CCOCC2)C1 P37740 [0,1,0,1,0,0|2,0,0]=4 406 B13R2.64 C1CN[C@H](CN2CCOCC2)C1 P35092 [0,1,0,1,0,0|2,0,0]=4 407 B13R2.4014 C[C@H]1C[C@@H](N)C2(CCNCC2)C1 Q53360 [0,1,0,1,0,0|2,0,0]=4 408 B13R2.11128 CN1CCNC2(CCCCC2)C1 Q58046 [0,1,0,1,0,0|2,0,0]=4 409 B13R2.11128 NC1CCNC2(CCCCC2)C1 Q53945 [0,1,0,1,0,0|2,0,0]=4 410 B13R2.11128 NC1CCOC2(CCCCC2)C1 Q57654 [0,1,0,1,0,0|2,0,0]=4 411 B13R2.11128 OC1CCNC2(CCCCC2)C1 Q54144 [0,1,0,1,0,0|2,0,0]=4 412 B13R2.12396 COCC1CC2(CCNCC2)C1 Q64622 [0,1,0,1,0,0|2,0,0]=4 413 B13R2.13968 O=C(O)C1CC2(CCCCC2)C1 Q58153 [0,1,0,1,0,0|2,0,0]=4 414 B13R2.5120 CC1NCC2(CCN(C)CC2)S1 Q64532 [0,1,0,1,0,0|2,0,0]=4 415 B13R2.5120 NC1CCC2(CC1)CNC(=O)C2 Q63373 [0,1,0,1,0,0|1,0,1]=4 416 B13R2.5120 O=C1CC2(CCC(O)CC2)CN1 Q63457 [0,1,0,1,0,0|1,0,1]=4 417 B13R2.6859 CCC(C)NC1CC2CCC1C2 P49121 [0,1,0,1,0,0|2,0,0]=4 418 B13R2.11462 CC1(C)CC2(CCNCC2)CO1 10017 [0,1,0,1,0,0|2,0,0]=4 419 B13R3.1921 C1NC2CC3CC1CC(C3)C2 P45908 [0,0,0,2,0,0|0,0,0]=2 420 B13R3.1921 C1NC2CC3CC1CC(C3)C2 P45923 [0,0,0,2,0,0|0,0,0]=2 421 B13R3.3861 CN1C2CC3CC1CC(C2)N3 P45663 [0,0,0,2,0,0|1,0,0]=3 422 B9R1.12 BrCCCC1CCCC1 P38703 [1,0,0,0,1,0|2,0,0]=4 423 B9R1.12 CNCCC1CCCC1 P35273 [1,0,0,0,1,0|0,0,0]=2 424 B9R1.12 CNCCC1CCCC1 P35770 [1,0,0,0,1,0|0,0,0]=2 425 B9R1.12 CNCCN1CCCC1 L19572 [1,0,0,0,1,0|1,0,0]=3 426 B9R1.12 COCCC1CCCN1 G-7743 [1,0,0,0,1,0|2,0,0]=4 427 B9R1.12 ICCCC1CCCC1 P42787 [1,0,0,0,1,0|2,0,0]=4 428 B9R1.12 NCCCC1CCCC1 O33622 [1,0,0,0,1,0|2,0,0]=4 429 B9R1.12 NCCCC1CCCC1 P37126 [1,0,0,0,1,0|2,0,0]=4 430 B9R1.12 OCCCC1CCCC1 P36172 [1,0,0,0,1,0|2,0,0]=4 431 B9R1.6 CC(=O)C1CCCCC1 I-9265 [1,0,0,0,1,0|1,0,1]=4 432 B9R1.6 CC(C)C1CCNCC1 P43343 [1,0,0,0,1,0|1,0,0]=3 433 B9R1.6 CC(C)C1CNCCN1 P35854 [1,0,0,0,1,0|2,0,0]=4 434 B9R1.6 CC(C)C1CNCCO1 B-1072 [1,0,0,0,1,0|2,0,0]=4 435 B9R1.6 CC(C)C1COCCN1 F-4067 [1,0,0,0,1,0|2,0,0]=4 436 B9R1.6 CC(C)N1CCNCC1 I-9312 [1,0,0,0,1,0|2,0,0]=4 437 B9R1.6 CC(C)N1CCOCC1 O30279 [1,0,0,0,1,0|2,0,0]=4 438 B9R1.6 CC(C)[C@@H]1CNCCO1 B-1074 [1,0,0,0,1,0|2,0,0]=4 439 B9R1.6 CC(C)[C@@H]1COCCN1 B-1067 [1,0,0,0,1,0|2,0,0]=4 440 B9R1.6 CC(C)[C@@H]1COCCN1 O28330 [1,0,0,0,1,0|2,0,0]=4 441 B9R1.6 CC(C)[C@H]1CNCCO1 B-1073 [1,0,0,0,1,0|2,0,0]=4 442 B9R1.6 CC(C)[C@H]1COCCN1 B-1068 [1,0,0,0,1,0|2,0,0]=4 443 B9R1.6 CC(C)[C@H]1COCCN1 O28323 [1,0,0,0,1,0|2,0,0]=4 444 B9R1.6 CC(N)C1CCCCC1 M23210 [1,0,0,0,1,0|0,0,0]=2 445 B9R1.6 CC(N)C1CCCCO1 Q57678 [1,0,0,0,1,0|1,0,0]=3 446 B9R1.6 CC(N)C1CCCOC1 Q57833 [1,0,0,0,1,0|1,0,0]=3 447 B9R1.6 CC(N)C1CCCOC1 Q57834 [1,0,0,0,1,0|1,0,0]=3 448 B9R1.6 CC(N)C1CCOCC1 Q66046 [1,0,0,0,1,0|1,0,0]=3 449 B9R1.6 CC(O)C1CCCCC1 P42370 [1,0,0,0,1,0|1,0,0]=3 450 B9R1.6 CN(C)C1CCCNC1 10066 [1,0,0,0,1,0|2,0,0]=4 451 B9R1.6 CN(C)C1CCCNC1 O28829 [1,0,0,0,1,0|2,0,0]=4 452 B9R1.6 CN(C)[C@H]1CCCNC1 Q53267 [1,0,0,0,1,0|2,0,0]=4 453 B9R1.6 C[C@@H](N)C1CCCCO1 Q57872 [1,0,0,0,1,0|1,0,0]=3 454 B9R1.6 C[C@@H](N)C1CCCCO1 Q57873 [1,0,0,0,1,0|1,0,0]=3 455 B9R1.6 C[C@@H](N)C1CCOCC1 Q63002 [1,0,0,0,1,0|1,0,0]=3 456 B9R1.6 C[C@@H](N)C1CCOCC1 Q63003 [1,0,0,0,1,0|1,0,0]=3 457 B9R1.6 C[C@@H](O)C1CCOCC1 Q54596 [1,0,0,0,1,0|2,0,0]=4 458 B9R1.6 C[C@H](N)C1CCCOC1 Q57835 [1,0,0,0,1,0|1,0,0]=3 459 B9R1.6 C[C@H](N)C1CCOCC1 Q63000 [1,0,0,0,1,0|1,0,0]=3 460 B9R1.6 C[C@H](N)C1CCOCC1 Q63001 [1,0,0,0,1,0|1,0,0]=3 461 B9R1.6 C[C@H](O)C1CCOCC1 Q54595 [1,0,0,0,1,0|2,0,0]=4 462 B9R1.13 CC(C)CC1CCNC1 S72560 [1,0,0,0,1,0|1,0,0]=3 463 B9R1.13 CC(C)OC1CCNC1 P42194 [1,0,0,0,1,0|2,0,0]=4 464 B9R1.13 CC(C)OC1CCNC1 Q61982 [1,0,0,0,1,0|2,0,0]=4 465 B9R1.13 CC(C)O[C@@H]1CCNC1 P42399 [1,0,0,0,1,0|2,0,0]=4 466 B9R1.13 CC(C)O[C@@H]1CCNC1 Q61983 [1,0,0,0,1,0|2,0,0]=4 467 B9R1.13 CC(C)O[C@H]1CCNC1 P43058 [1,0,0,0,1,0|2,0,0]=4 468 B9R1.13 CC(N)CN1CCCC1 P37759 [1,0,0,0,1,0|1,0,0]=3 469 B9R1.13 CC(O)CC1CCCN1 Q59227 [1,0,0,0,1,0|2,0,0]=4 470 B9R1.13 CN(C)CC1CCCN1 O28921 [1,0,0,0,1,0|2,0,0]=4 471 B9R1.13 CN(C)CC1CCNC1 G-7735 [1,0,0,0,1,0|2,0,0]=4 472 B9R1.13 CN(C)CC1CCNC1 S72463 [1,0,0,0,1,0|2,0,0]=4 473 B9R1.13 CN(C)C[C@@H]1CCCN1 L22126 [1,0,0,0,1,0|2,0,0]=4 474 B9R1.13 CN(C)C[C@@H]1CCNC1 O33410 [1,0,0,0,1,0|2,0,0]=4 475 B9R1.13 CN(C)C[C@@H]1CCNC1 Q61712 [1,0,0,0,1,0|2,0,0]=4 476 B9R1.13 CN(C)C[C@H]1CCCN1 I-9768 [1,0,0,0,1,0|2,0,0]=4 477 B9R1.13 CN(C)C[C@H]1CCNC1 O33414 [1,0,0,0,1,0|2,0,0]=4 478 B9R1.13 CN(C)C[C@H]1CCNC1 Q61711 [1,0,0,0,1,0|2,0,0]=4