0 B13R0.674 CCOC(=O)C(=O)C(Br)C(=O)OCC Amb22755726 [0,0,0,0,0,0|1,0,2]=3 1 B13R0.674 CCOC(=O)C(=O)C(C(=O)OCC)Cl Amb10071926 [0,0,0,0,0,0|1,0,2]=3 2 B13R0.674 CCOC(=O)C(=O)C(F)C(=O)OCC Amb21962136 [0,0,0,0,0,0|1,0,2]=3 3 B13R0.674 CCOC(=O)[C@@H](O)[C@@H](Br)C(=O)OCC Amb22744801 [0,0,0,0,0,0|1,0,0]=1 4 B13R0.674 CCOC(=O)\C(=C(\C(=O)OCC)/[O-])\C Amb16208799 [0,0,0,0,0,0|1,0,3]=4 5 B12R0.69 CCCC(=O)CC(=O)C(=O)OCC Amb1123761 [1,0,0,0,0,0|1,0,2]=4 6 B12R0.69 CCCC(=O)N(C)CC(=O)OCC Amb19059114 [1,0,0,0,0,0|3,0,0]=4 7 B12R0.69 CCOC(=O)C(S)CC(=O)OCC Amb22372038 [1,0,0,0,0,0|0,1,0]=2 8 B12R0.69 CCOC(=O)CC(=C)C(=O)OCC Amb15692707 [1,0,0,0,0,0|1,0,1]=3 9 B12R0.69 CCOC(=O)CC(=O)C(=O)OCC Amb10603616 [1,0,0,0,0,0|0,0,2]=3 10 B12R0.69 CCOC(=O)CC(=O)C(=O)OCC Amb22898981 [1,0,0,0,0,0|0,0,2]=3 11 B12R0.69 CCOC(=O)CC(C(=O)OCC)N Amb17594907 [1,0,0,0,0,0|1,0,0]=2 12 B12R0.69 CCOC(=O)[C@@H](N)CC(=O)OCC Amb22230805 [1,0,0,0,0,0|1,0,0]=2 13 B12R0.69 CCOC(=O)[C@H](N)CC(=O)OCC Amb22230510 [1,0,0,0,0,0|1,0,0]=2 14 B12R0.69 CCOC(=O)\C(\Cl)=C/C(=O)OCC Amb22055090 [1,0,0,0,0,0|1,0,2]=4 15 B12R0.69 CCOC(=O)\C=C(\C(=O)OCC)/O Amb16230916 [1,0,0,0,0,0|0,0,2]=3 16 B12R0.196 CC(C(=O)C(=O)OCC)C(=O)CC Amb20077950 [1,0,0,0,0,0|1,0,2]=4 17 B12R0.196 COC(=O)C(Br)C(Br)C(=O)OCC Amb24095647 [1,0,0,0,0,0|2,0,0]=3 18 B14R0.2722 CCOC(=O)C(=O)C(C(=O)OCC)(C)C Amb17595879 [0,1,0,0,0,0|1,0,2]=4 19 B14R1.3348 CCOC(=O)C(=O)C1CCCOC1=O Amb22499696 [0,0,0,1,0,0|1,0,2]=4 20 B14R1.7241 CCOC(=O)C1CCC1C(=O)OCC Amb22365235 [0,0,0,1,0,0|2,0,0]=3 21 B14R1.18827 CCOC(=O)C1(C)CCCC(=O)C1Cl Amb24728388 [0,0,0,1,0,0|3,0,0]=4 22 B14R0.316 CC(NC(=O)C(=O)OCC)C(=O)OCC Amb22441569 [0,0,0,0,0,1|1,0,2]=4 23 B11R0.5 CCCCC(O)CC(=O)OCC Amb18803977 [2,0,0,0,0,0|1,0,1]=4 24 B11R0.43 CCOC(=O)C(=O)CC(=O)CC Amb1106404 [2,0,0,0,0,0|0,0,2]=4 25 B11R0.62 CCOC(=O)CNC(=O)OCC Amb17868849 [2,0,0,0,0,0|1,0,0]=3 26 B11R0.62 CCOC(=O)N=NC(=O)OCC Amb10807487 [2,0,0,0,0,0|2,0,0]=4 27 B11R0.62 CCOC(=O)\N=C\C(=O)OCC Amb24103456 [2,0,0,0,0,0|1,0,1]=4 28 B11R0.62 CCOC(=S)SCC(=O)OCC Amb10808592 [2,0,0,0,0,0|1,1,0]=4 29 B11R0.187 CCOC(=O)CC(\C(=C\C)\C)O Amb16218121 [2,0,0,0,0,0|1,0,1]=4 30 B11R0.187 CCOC(=O)CN(C)C(=O)CC Amb18794790 [2,0,0,0,0,0|2,0,0]=4 31 B11R0.66 CNC(=O)C(C(C(=O)NC)O)O Amb1144477 [2,0,0,0,0,0|2,0,0]=4 32 B11R0.66 CNC(=O)[C@H](O)[C@@H](O)C(=O)NC Amb25859206 [2,0,0,0,0,0|2,0,0]=4 33 B11R0.66 COC(=O)C(C(C(=O)OC)F)Br Amb10845730 [2,0,0,0,0,0|2,0,0]=4 34 B11R0.66 COC(=O)C(C(C(=O)OC)O)O Amb1781465 [2,0,0,0,0,0|0,0,0]=2 35 B11R0.66 COC(=O)[C@@H](Br)[C@@H](F)C(=O)OC Amb22735469 [2,0,0,0,0,0|2,0,0]=4 36 B11R0.66 COC(=O)[C@@H](O)[C@@H](O)C(=O)OC Amb22747698 [2,0,0,0,0,0|0,0,0]=2 37 B11R0.66 COC(=O)\C(\O)=C(/O)\C(=O)OC Amb20240781 [2,0,0,0,0,0|0,0,2]=4 38 B11R0.177 CCOC(=O)C(C(=O)OCC)O Amb10068673 [2,0,0,0,0,0|0,0,2]=4 39 B13R0.225 CCOC(=O)C(CBr)CC(=O)OCC Amb22752137 [1,1,0,0,0,0|1,0,0]=3 40 B13R0.225 CCOC(=O)CC(C=O)C(=O)OCC Amb17672648 [1,1,0,0,0,0|0,0,1]=3 41 B15R0.4849 OCCNC(=O)C(C(C(=O)NCCO)O)O Amb1147409 [0,2,0,0,0,0|2,0,0]=4 42 B15R0.4560 [2H]C([2H])(C(=O)OCC)C([2H])([2H])C(=O)OCC Amb22353276 [0,2,0,0,0,0|2,0,0]=4 43 B13R1.12 CCOC(=O)C1CCNC(=O)C1O Amb24694182 [1,0,0,1,0,0|1,0,0]=3 44 B13R1.470 CCOC(=O)CC1CCCCC1=O Amb10844666 [1,0,0,1,0,0|2,0,0]=4 45 B13R1.470 CCOC(=O)CC1NCCNC1=O Amb21966095 [1,0,0,1,0,0|2,0,0]=4 46 B13R1.470 CCOC(=O)CC1NCCNC1=O Amb2467168 [1,0,0,1,0,0|2,0,0]=4 47 B13R1.470 CCOC(=O)C[C@@H]1CCCCC1=O Amb24181923 [1,0,0,1,0,0|2,0,0]=4 48 B13R1.690 CC1CC(NC(=O)OCC)C(=O)O1 Amb24657363 [1,0,0,1,0,0|2,0,0]=4 49 B13R1.1462 CCOC(=O)C1CC(=O)CCCC1 Amb21962583 [1,0,0,1,0,0|2,0,0]=4 50 B13R1.1462 CCOC(=O)C1CC(=O)NCCO1 Amb25292317 [1,0,0,1,0,0|1,0,0]=3 51 B13R1.1515 CCOC(=O)[C@@H]1N[C@H]1C(=O)OCC Amb19374706 [1,0,0,1,0,0|1,0,0]=3 52 B13R1.1515 CCOC(=O)[C@H]1C[C@H]1C(=O)OCC Amb22230539 [1,0,0,1,0,0|1,0,0]=3 53 B13R1.4451 CCOC(=O)C1(O)CC(C)OC1C Amb24643161 [1,0,0,1,0,0|1,0,1]=4 54 B13R1.4456 CCOC(=O)C1C(C)NC(=O)C1C Amb25289138 [1,0,0,1,0,0|2,0,0]=4 55 B13R1.4456 CCOC(=O)C=1C(C)OC(=O)C1O Amb24742148 [1,0,0,1,0,0|0,0,2]=4 56 B13R1.4470 CCOC(=O)C1(O)CC(C)OCC1 Amb24732339 [1,0,0,1,0,0|1,0,1]=4 57 B13R1.4563 CCOC(=O)NC1(C)CCOC1=O Amb24520783 [1,0,0,1,0,0|2,0,0]=4 58 B13R1.696 COC(=O)C(O)C1CCCCC1=O Amb21858509 [1,0,0,1,0,0|2,0,0]=4 59 B13R1.4833 CC1OC(O)C(O)C1(O)C(=O)OC Amb25852792 [1,0,0,1,0,0|0,0,2]=4 60 B13R1.4833 C[C@@H]1O[C@H](O)[C@@H](O)[C@@]1(O)C(=O)OC Amb24575563 [1,0,0,1,0,0|0,0,2]=4 61 B13R1.5570 COC(=O)C(O)C1(C)CCCC1=O Amb24354359 [1,0,0,1,0,0|2,0,0]=4 62 B13R1.1546 CCOC(=O)C1(O)CCOCC1C Amb24368266 [1,0,0,1,0,0|1,0,1]=4 63 B13R1.1546 CCOC(=O)[C@@]1(O)CCCC[C@H]1O Amb24612461 [1,0,0,1,0,0|1,0,1]=4 64 B15R1.776 CCOC(=O)C1CCC(N1)C(=O)OCC Amb19958605 [0,0,0,1,0,1|2,0,0]=4 65 B15R1.776 CCOC(=O)C1CCC(N1)C(=O)OCC Amb21962532 [0,0,0,1,0,1|2,0,0]=4 66 B15R1.776 CCOC(=O)C1CCC(N1)C(=O)OCC Amb22493766 [0,0,0,1,0,1|2,0,0]=4 67 B15R1.776 CCOC(=O)C=1CC(ON1)C(=O)OCC Amb23453806 [0,0,0,1,0,1|1,0,1]=4 68 B15R1.10629 CC1OC(=O)C(Br)C(C)C1C(=O)OCC Amb22733737 [0,0,0,1,0,1|2,0,0]=4 69 B15R1.10316 CCOC(=O)C1NCCC1C(=O)OCC Amb22741047 [0,1,0,1,0,0|2,0,0]=4 70 B15R1.10316 CCOC(=O)[C@@H]1CNC[C@@H]1C(=O)OCC Amb13882891 [0,1,0,1,0,0|2,0,0]=4 71 B15R1.10316 CCOC(=O)[C@@H]1CNC[C@H]1C(=O)OCC Amb22747993 [0,1,0,1,0,0|2,0,0]=4 72 B15R1.10316 CCOC(=O)[C@@H]1OCO[C@H]1C(=O)OCC Amb22887645 [0,1,0,1,0,0|0,0,0]=2 73 B13R0.18 CCOC(=O)CCC(C(=O)OCC)N Amb1154233 [1,0,0,0,0,1|1,0,0]=3 74 B13R0.18 CCOC(=O)CCC(O)C(=O)OCC Amb22756241 [1,0,0,0,0,1|0,0,0]=2 75 B13R0.18 CCOC(=O)CC[C@@H](O)C(=O)OCC Amb19132677 [1,0,0,0,0,1|0,0,0]=2 76 B13R0.89 CC(CC(=O)OCC)CC(=O)OCC Amb22735065 [1,0,0,0,0,1|1,0,0]=3 77 B13R0.89 CCOC(=O)CC(CC(=O)OCC)O Amb15692227 [1,0,0,0,0,1|0,0,0]=2