0 B9R0.7 C(C(=O)O)NC(=O)C(=O)O AB07678 [0,0,0,0,0,0|2,0,1]=3 1 B9R0.7 CC(C)CC[C@@H](C(=O)O)N AB15913 [0,0,0,0,0,0|2,0,1]=3 2 B9R0.7 CC(C)CC[C@H](C(=O)O)N AB29542 [0,0,0,0,0,0|2,0,1]=3 3 B10R0.92 CS(=O)(=O)CCC(C(=O)N)N MB08215 [0,1,0,0,0,0|2,0,1]=4 4 B10R0.92 CS(=O)(=O)CCC(C(=O)O)N AB01460 [0,1,0,0,0,0|1,0,1]=3 5 B10R1.13 C1C(NCC(=O)N1)C(=O)O AB61601 [0,0,0,1,0,0|2,0,0]=3 6 B10R1.13 C1CC(=O)CCC1C(=O)O PB10093 [0,0,0,1,0,0|2,0,0]=3 7 B10R1.13 C1CC(=O)NCC1C(=O)O PB30997 [0,0,0,1,0,0|2,0,0]=3 8 B10R1.13 C1C[C@H](NC[C@H]1O)C(=O)O PB18272 [0,0,0,1,0,0|1,0,1]=3 9 B10R1.13 C1[C@@H](NCC(=O)N1)C(=O)O AB61607 [0,0,0,1,0,0|2,0,0]=3 10 B10R1.13 C1[C@H](NCC(=O)N1)C(=O)O AB61603 [0,0,0,1,0,0|2,0,0]=3 11 B10R1.83 CC1(C(CC1N)C(=O)O)C PB35717 [0,0,0,1,0,0|2,0,1]=4 12 B10R1.83 CC1([C@@H](C[C@@H]1N)C(=O)O)C PB36525 [0,0,0,1,0,0|2,0,1]=4 13 B10R1.83 CC1([C@H](C[C@@H]1N)C(=O)O)C PB39190 [0,0,0,1,0,0|2,0,1]=4 14 B10R1.359 C1CS(=O)(=O)NC1C(=O)O PB30895 [0,0,0,1,0,0|1,0,1]=3 15 B8R0.23 CC(CC(=O)C)C(=O)O PB27433 [0,0,0,0,1,0|2,0,0]=3 16 B10R0.98 CC(=O)OCC[C@@H](C(=O)O)N AB30649 [0,0,0,0,0,1|1,0,0]=2 17 B7R0.5 CCC[C@@H](C(=O)O)N AB02603 [2,0,0,0,0,0|0,0,1]=3 18 B7R0.5 CCC[C@H](C(=O)O)N AB00929 [2,0,0,0,0,0|0,0,1]=3 19 B7R0.5 CNC[C@@H](C(=O)O)N CB10181 [2,0,0,0,0,0|1,0,1]=4 20 B7R0.5 CNC[C@@H](C(=O)O)N CB11070 [2,0,0,0,0,0|1,0,1]=4 21 B9R0.51 C[C@@](CCSC)(C(=O)O)N AB76492 [1,1,0,0,0,0|2,0,0]=4 22 B9R0.51 C[C@](CCSC)(C(=O)O)N AB76378 [1,1,0,0,0,0|2,0,0]=4 23 B9R0.56 C(CC(=O)O)CS(=O)(=O)N AB08121 [1,1,0,0,0,0|1,0,1]=4 24 B9R0.11 C[C@@](CC(=O)O)(C(=O)O)N AB04906 [0,1,0,0,1,0|0,0,0]=2 25 B9R0.11 C[C@](CC(=O)O)(C(=O)O)N AB03942 [0,1,0,0,1,0|0,0,0]=2 26 B9R0.79 [C@@H]([C@H](C(=O)O)O)(C(=O)O)O AB14268 [0,1,0,0,1,0|1,0,0]=3 27 B9R0.79 [C@H]([C@@H](C(=O)O)O)(C(=O)O)O AB31283 [0,1,0,0,1,0|1,0,0]=3 28 B11R0.120 COC(=O)CCC(=C)C(=O)OC MB05430 [0,2,0,0,0,0|1,0,1]=4 29 B9R1.6 C1CC(COC1)C(=O)O PB24847 [1,0,0,1,0,0|1,0,1]=4 30 B9R1.6 C1CCN[C@@H](C1)C(=O)O AB00554 [1,0,0,1,0,0|1,0,1]=4 31 B9R1.6 C1CCN[C@H](C1)C(=O)O AB07110 [1,0,0,1,0,0|1,0,1]=4 32 B9R1.6 C1C[C@@H](CC=C1)C(=O)O PB18863 [1,0,0,1,0,0|2,0,0]=4 33 B9R1.6 C1C[C@H](CC=C1)C(=O)O PB29511 [1,0,0,1,0,0|2,0,0]=4 34 B9R1.35 C1CC(=O)C=C1C(=O)O CB11482 [1,0,0,1,0,0|1,0,1]=4 35 B9R1.35 C1CC(=O)CC1C(=O)O PB17215 [1,0,0,1,0,0|1,0,0]=3 36 B9R1.35 C1CC(=O)C[C@@H]1C(=O)O PB28806 [1,0,0,1,0,0|1,0,0]=3 37 B9R1.35 C1CC(=O)C[C@H]1C(=O)O PB15404 [1,0,0,1,0,0|1,0,0]=3 38 B9R1.35 C1[C@H](NCC1=O)C(=O)O AB31269 [1,0,0,1,0,0|2,0,0]=4 39 B9R1.35 C1[C@H](NCC1=O)C(=O)O CB11605 [1,0,0,1,0,0|2,0,0]=4 40 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O AB76265 [1,0,0,1,0,0|1,0,1]=4 41 B9R1.35 C[C@H]1CC[C@H](N1)C(=O)O AB76261 [1,0,0,1,0,0|1,0,1]=4 42 B9R1.69 C1CC(=O)NC(=O)C1N PB14928 [1,0,0,1,0,0|1,0,0]=3 43 B9R1.95 C1C(CC1C(=O)O)CO PB10714 [1,0,0,1,0,0|1,0,1]=4 44 B9R1.110 C1C(CO1)C(C(=O)O)N PB11723 [1,0,0,1,0,0|2,0,0]=4 45 B9R1.110 C1C(CO1)[C@@H](C(=O)O)N PB38610 [1,0,0,1,0,0|2,0,0]=4 46 B9R1.110 C1C(CO1)[C@H](C(=O)O)N PB36253 [1,0,0,1,0,0|2,0,0]=4 47 B9R1.110 C1CC(C1)C(C(=O)O)N PB17607 [1,0,0,1,0,0|1,0,1]=4 48 B9R1.110 C1CC(C1)[C@@H](C(=O)O)N PB16030 [1,0,0,1,0,0|1,0,1]=4 49 B9R1.110 C1CC(C1)[C@H](C(=O)O)N PB27915 [1,0,0,1,0,0|1,0,1]=4 50 B9R1.112 C1CC1C[C@@H](C(=O)O)N AB16716 [1,0,0,1,0,0|1,0,1]=4 51 B9R1.163 C1C=CCC1(C(=O)O)N AB14600 [1,0,0,1,0,0|1,0,1]=4 52 B9R1.163 C1CNCC1(C(=O)O)N AB43590 [1,0,0,1,0,0|2,0,0]=4 53 B9R1.163 C1COCC1(C(=O)O)N PB18879 [1,0,0,1,0,0|2,0,0]=4 54 B9R1.163 CC1(CCCO1)C(=O)O CB10966 [1,0,0,1,0,0|1,0,1]=4 55 B9R1.1 C1CC(=O)CCC1C=O AB21200 [1,0,0,1,0,0|2,0,0]=4 56 B9R1.152 CC1(CC(=O)C1)C(=O)O PB12182 [0,0,0,1,1,0|2,0,0]=4 57 B11R1.20 C1C(NCC(=O)N1)CC(=O)O AB61630 [0,0,0,1,0,1|2,0,0]=4 58 B11R1.20 C1[C@@H](NCC(=O)N1)CC(=O)O AB61635 [0,0,0,1,0,1|2,0,0]=4 59 B11R1.20 C1[C@H](NCC(=O)N1)CC(=O)O AB61634 [0,0,0,1,0,1|2,0,0]=4 60 B11R1.710 C1CS(=O)(=O)NC1CC(=O)O PB25767 [0,0,0,1,0,1|1,0,1]=4 61 B11R1.22 COC(=O)C1CCC(=O)NC1 PB22855 [0,1,0,1,0,0|2,0,0]=4 62 B11R1.22 COC(=O)[C@@H]1CC[C@@H](CN1)O PB13872 [0,1,0,1,0,0|1,0,1]=4 63 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 AB66815 [0,1,0,1,0,0|2,0,0]=4 64 B7R0.2 CCC(CC(=O)O)N AB01525 [1,0,0,0,1,0|1,0,1]=4 65 B9R0.4 CCCCC(CC(=O)O)N AB08231 [1,0,0,0,0,1|1,0,1]=4