0 B11R0.43 CCOC(=O)C(=O)CC(=O)CC E47029 [0,0,0,0,0,0|0,0,0]=0 1 B10R0.18 CCCCC(=O)CC(=O)OC M47093 [1,0,0,0,0,0|2,0,1]=4 2 B10R0.19 CCCCC(=O)C(=O)OCC E12153 [1,0,0,0,0,0|0,0,1]=2 3 B10R0.19 CCOC=C(C)C(=O)OCC E47098 [1,0,0,0,0,0|2,0,1]=4 4 B10R0.46 C=C(CC(=O)OC)C(=O)OC D69582 [1,0,0,0,0,0|2,0,0]=3 5 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC D38517 [1,0,0,0,0,0|2,0,1]=4 6 B10R0.46 COC(=O)C[C@H](N)C(=O)OC A61977 [1,0,0,0,0,0|2,0,1]=4 7 B10R0.46 COC(=O)C[C@H](N)C(=O)OC D68297 [1,0,0,0,0,0|2,0,1]=4 8 B10R0.108 CCOC(=O)CNC(=O)OC E41521 [1,0,0,0,0,0|2,0,1]=4 9 B12R0.69 CCCC(=O)CC(=O)C(=O)OCC E50443 [0,1,0,0,0,0|0,0,0]=1 10 B12R0.69 CCOC(=O)C[C@@H](N)C(=O)OCC D49576 [0,1,0,0,0,0|1,0,1]=3 11 B12R0.69 CCOC(=O)C[C@H](N)C(=O)OCC A37979 [0,1,0,0,0,0|1,0,1]=3 12 B12R0.69 CCOC(=O)[CH-]C(=O)C(=O)OCC S23572 [0,1,0,0,0,0|0,0,1]=2 13 B12R0.730 CCOC(=O)C(C)(C)CC(=O)CBr E60569 [0,1,0,0,0,0|2,0,1]=4 14 B12R1.17 CCOC(=O)[C@@H]1CC(=O)CCO1 P22839 [0,0,0,1,0,0|0,0,2]=3 15 B12R1.17 CCOC(=O)[C@H]1CCCC(=O)C1 E23119 [0,0,0,1,0,0|1,0,1]=3 16 B12R1.312 CCOC(=O)C1=NC=C(CC)N1 E46983 [0,0,0,1,0,0|3,0,0]=4 17 B12R1.312 CCOC(=O)C1=NOC(CC)=N1 E37223 [0,0,0,1,0,0|2,0,1]=4 18 B10R0.35 CCOC(=O)C(=O)[C@@H](Br)CC E37425 [0,0,0,0,1,0|1,0,1]=3 19 B9R0.34 CCCC(=O)CC(=O)OC M39290 [2,0,0,0,0,0|1,0,1]=4 20 B9R0.34 CCOC(=O)CC(=O)CC E43812 [2,0,0,0,0,0|0,0,0]=2 21 B9R0.34 CCOC(=O)CC(=O)CCl E64939 [2,0,0,0,0,0|1,0,0]=3 22 B9R0.34 CCOC(=O)CC(=O)NN E40373 [2,0,0,0,0,0|2,0,0]=4 23 B9R0.34 CCOC(=O)NC(=O)CCl E62948 [2,0,0,0,0,0|2,0,0]=4 24 B9R0.5 CCC=CCC(=O)OCC E47083 [2,0,0,0,0,0|0,0,2]=4 25 B9R0.5 CCCC=CC(=O)OCC E47082 [2,0,0,0,0,0|0,0,2]=4 26 B9R0.5 CCOC=CC(=O)OCC E43814 [2,0,0,0,0,0|1,0,1]=4 27 B9R0.5 CCO\C=C\C(=O)OCC E43813 [2,0,0,0,0,0|1,0,1]=4 28 B9R0.35 CCCC(=O)C(=O)OCC E43810 [2,0,0,0,0,0|0,0,0]=2 29 B9R0.35 CCC[C@H](C)C(=O)OCC E39445 [2,0,0,0,0,0|1,0,1]=4 30 B9R0.35 CCC[C@H](N)C(=O)OCC N65311 [2,0,0,0,0,0|1,0,1]=4 31 B9R0.35 CCOC(=N)C(=O)OCC E32050 [2,0,0,0,0,0|2,0,0]=4 32 B9R0.48 C=C(C)CCC(=O)OCC E69099 [2,0,0,0,0,0|1,0,1]=4 33 B9R0.48 CCOC(=O)CCC(C)=O E36601 [2,0,0,0,0,0|0,0,1]=3 34 B9R0.48 CCOC(=O)CNC(C)=O E68877 [2,0,0,0,0,0|1,0,1]=4 35 B9R0.24 COC(=O)CCC(=O)CN M68150 [2,0,0,0,0,0|1,0,1]=4 36 B11R0.177 CCOC(=O)C(=O)C(=O)OCC D43741 [1,1,0,0,0,0|1,0,1]=4 37 B11R0.177 CCOC(=O)C(=O)C(=O)OCC D69011 [1,1,0,0,0,0|1,0,1]=4 38 B11R0.186 CCOC(=O)C(=O)CC(C)(C)C D2013 [1,1,0,0,0,0|1,0,1]=4 39 B11R0.62 CCOC(=O)C#CC(=O)OCC D69328 [1,1,0,0,0,0|0,0,2]=4 40 B11R0.62 CCOC(=O)CSC(=S)OCC E43822 [1,1,0,0,0,0|1,1,0]=4 41 B13R0.89 CCOC(=O)CC(=O)CC(=O)OCC D68800 [0,1,0,0,0,1|0,0,0]=2 42 B13R0.18 CCOC(=O)CC[C@@H](N)C(=O)OCC D61462 [0,1,0,0,0,1|1,0,1]=4 43 B13R0.18 CCOC(=O)CC[C@H](O)C(=O)OCC D50526 [0,1,0,0,0,1|0,0,2]=4 44 B13R0.674 CCOC(=O)C(=O)[C@H](C)C(=O)OCC D50455 [0,2,0,0,0,0|0,0,0]=2 45 B13R0.674 CCOC(=O)C(=O)[C@H](Cl)C(=O)OCC D68545 [0,2,0,0,0,0|0,0,0]=2 46 B13R0.674 CCOC(=O)[C@@H](O)[C@H](O)C(=O)OCC D69402 [0,2,0,0,0,0|0,0,2]=4 47 B13R0.674 CCOC(=O)[C@H](O)[C@@H](O)C(=O)OCC D69388 [0,2,0,0,0,0|0,0,2]=4 48 B13R0.258 CCOC(=O)C(=O)CC(=O)C(C)(C)C E53213 [0,2,0,0,0,0|0,0,0]=2 49 B13R0.258 CCOC(=O)C(=O)CC(=O)C(F)(F)F E45944 [0,2,0,0,0,0|1,0,0]=3 50 B11R1.351 CCOC(=O)C(=O)CC1CC1 C2015 [1,0,0,1,0,0|0,0,1]=3 51 B11R1.833 CCOC(=O)C1(C)CC(=O)C1 E14828 [1,0,0,1,0,0|1,0,1]=4 52 B11R1.23 COC(=O)C1=CC(=O)CCC1 M46843 [1,0,0,1,0,0|1,0,1]=4 53 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 O7322 [1,0,0,1,0,0|1,0,1]=4 54 B11R1.23 COC(=O)[C@H]1CCCC(=O)C1 M47023 [1,0,0,1,0,0|1,0,1]=4 55 B13R1.1511 CCOC(=O)[C@@H]1CCC(=O)C=C1C E53099 [0,0,0,1,0,1|1,0,1]=4 56 B13R1.4446 CCOC(=O)C1(C)CCC(=O)CC1 E29671 [0,0,0,1,0,1|1,0,1]=4 57 B13R1.33 CCOC(=O)CC(=O)[C@@H]1CCCO1 E50451 [0,1,0,1,0,0|1,0,1]=4 58 B13R1.1515 CCOC(=O)C1CC1C(=O)OCC C50452 [0,1,0,1,0,0|1,0,1]=4 59 B13R1.1515 CCOC(=O)[C@@H]1C[C@H]1C(=O)OCC D50446 [0,1,0,1,0,0|1,0,1]=4 60 B13R1.1515 CCOC(=O)[C@H]1C[C@H]1C(=O)OCC D1619 [0,1,0,1,0,0|1,0,1]=4 61 B13R2.822 CCOC(=O)C1C2CCC(=O)C21 E37086 [0,0,0,2,0,0|1,0,1]=4 62 B13R2.822 CCOC(=O)[C@@H]1[C@H]2CCC(=O)[C@H]21 E69707 [0,0,0,2,0,0|1,0,1]=4 63 B9R0.6 CCOC(=O)C(=O)[C@H](C)Br B38137 [1,0,0,0,1,0|1,0,1]=4 64 B9R0.6 CCOC(=O)[C@@H](C)C(C)=O E67659 [1,0,0,0,1,0|1,0,1]=4 65 B9R0.6 CCOC(=O)[C@@H](Cl)C(C)=O E69127 [1,0,0,0,1,0|1,0,1]=4 66 B9R0.6 CCOC(=O)[C@@H](N)C(C)=O E38383 [1,0,0,0,1,0|1,0,1]=4 67 B9R0.27 CCC(=O)[C@H](F)C(=O)OC M43406 [1,0,0,0,1,0|1,0,1]=4 68 B11R0.1 CCOC(=O)\C=C(/C)NC(C)=O E47064 [1,0,0,0,0,1|2,0,0]=4