0 B12R0.694 OC(=O)C(CC(=O)O)(CC(=O)O)O 1P001J7Y [0,0,0,0,0,0|0,0,0]=0 1 B12R0.694 OC(=O)C(CC(=O)O)(CC(=O)O)O 1P0039HV [0,0,0,0,0,0|0,0,0]=0 2 B12R0.694 OC(=O)C(CC(=O)O)(CC(=O)O)O 1P00IC8J [0,0,0,0,0,0|0,0,0]=0 3 B12R0.694 OC(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P003Q81 [0,0,0,0,0,0|0,0,2]=2 4 B12R0.694 OC(=O)CC(C(=O)O)(CC(=O)O)O 1P009AT7 [0,0,0,0,0,0|0,0,0]=0 5 B12R0.694 [O-]C(=O)C(CC(=O)O)(CC(=O)O)O 1P008FQG [0,0,0,0,0,0|0,0,1]=1 6 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P0037JM [0,0,0,0,0,0|0,0,3]=3 7 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P003OBQ [0,0,0,0,0,0|0,0,3]=3 8 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P003OUW [0,0,0,0,0,0|0,0,3]=3 9 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P003P4F [0,0,0,0,0,0|0,0,3]=3 10 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P003RIH [0,0,0,0,0,0|0,0,3]=3 11 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P003RQ2 [0,0,0,0,0,0|0,0,3]=3 12 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P003UCP [0,0,0,0,0,0|0,0,3]=3 13 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P003VUH [0,0,0,0,0,0|0,0,3]=3 14 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P004TTH [0,0,0,0,0,0|0,0,3]=3 15 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P005A3P [0,0,0,0,0,0|0,0,3]=3 16 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P007FU6 [0,0,0,0,0,0|0,0,3]=3 17 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P00IB7S [0,0,0,0,0,0|0,0,3]=3 18 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P00IBAZ [0,0,0,0,0,0|0,0,3]=3 19 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P00IKVJ [0,0,0,0,0,0|0,0,3]=3 20 B12R0.694 [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O 1P00IMTP [0,0,0,0,0,0|0,0,3]=3 21 B12R0.694 [O-]C(=O)CC(C(=O)O)(CC(=O)O)O 1P0025C0 [0,0,0,0,0,0|0,0,1]=1 22 B12R0.694 [O-]C(=O)CC(C(=O)O)(CC(=O)O)O 1P002EO4 [0,0,0,0,0,0|0,0,1]=1 23 B12R0.694 [O-]C(=O)CC(C(=O)O)(CC(=O)O)O 1P01BV52 [0,0,0,0,0,0|0,0,1]=1 24 B12R0.694 [O-]C(=O)CC(C(=O)[O-])(CC(=O)O)O 1P001J80 [0,0,0,0,0,0|0,0,2]=2 25 B12R0.694 [O-]C(=O)CC(C(=O)[O-])(CC(=O)O)O 1P003OB9 [0,0,0,0,0,0|0,0,2]=2 26 B12R0.694 [O-]C(=O)CC(C(=O)[O-])(CC(=O)[O-])O 1P003PCB [0,0,0,0,0,0|0,0,3]=3 27 B11R0.32 CC(C(CC(=O)O)CC(=O)O)C 1P00CZIA [1,0,0,0,0,0|2,0,1]=4 28 B11R0.32 CC(CC(C(=O)O)CC(=O)O)C 1P00EFMQ [1,0,0,0,0,0|2,0,1]=4 29 B11R0.32 NC(=N)N[C@H](C(=O)O)CC(=O)O 1P0035G1 [1,0,0,0,0,0|3,0,0]=4 30 B11R0.32 NC(=O)C[C@H](C(=O)O)NC(=O)C 1P00I5FQ [1,0,0,0,0,0|3,0,0]=4 31 B11R0.32 OC(=O)C(CC(=O)O)CC(=O)O 1P006PUM [1,0,0,0,0,0|0,0,0]=1 32 B11R0.32 OC(=O)CC(=CC(=O)O)C(=O)O 1P00DC5J [1,0,0,0,0,0|0,0,2]=3 33 B11R0.32 OC(=O)CC(C(=O)O)NC(=O)C 1P003T5E [1,0,0,0,0,0|2,0,0]=3 34 B11R0.32 OC(=O)CC(C(=O)O)NC(=O)N 1P0067YA [1,0,0,0,0,0|2,0,0]=3 35 B11R0.32 OC(=O)C[C@@H](C(=O)N)NC(=O)C 1P00EH76 [1,0,0,0,0,0|3,0,0]=4 36 B11R0.32 OC(=O)C[C@@H](C(=O)O)NC(=O)C 1P0036Q0 [1,0,0,0,0,0|2,0,0]=3 37 B11R0.32 OC(=O)C[C@@H](C(=O)O)NC(=O)N 1P009CJD [1,0,0,0,0,0|2,0,0]=3 38 B11R0.32 OC(=O)C\C(=C/C(=O)O)\C(=O)O 1P003VFC [1,0,0,0,0,0|0,0,2]=3 39 B11R0.32 OC(=O)C\C(=C\C(=O)O)\C(=O)O 1P003PGH [1,0,0,0,0,0|0,0,2]=3 40 B11R0.210 CCC(CC(=O)O)(CC(=O)O)C 1P003JV2 [1,0,0,0,0,0|2,0,1]=4 41 B13R0.1420 OC(=O)CC(C(C(=O)O)C)(C(=O)O)O 1P00ECBD [0,1,0,0,0,0|0,0,0]=1 42 B13R0.1420 OC(=O)CC(C(C(=O)O)O)(C(=O)O)O 1P00IBFG [0,1,0,0,0,0|0,0,0]=1 43 B13R0.2110 C([2H])(C(CC(=O)O)(CC(=O)O)O)([2H])[2H] 1P00ECCC [0,1,0,0,0,0|2,0,1]=4 44 B13R1.5889 OC(=O)CC1(CCC(=O)O1)C(=O)O 1P00GVA0 [0,0,0,1,0,0|3,0,0]=4 45 B11R0.427 OC(=O)CC(C(=O)O)(C(C)C)O 1P003HYI [0,0,0,0,1,0|2,0,1]=4 46 B13R0.1419 [O-]C(=O)CC(CC(=O)[O-])(CC(=O)[O-])O 1P028U5V [0,0,0,0,0,1|0,0,3]=4 47 B10R0.23 CCCC(C(=O)O)CC(=O)O 1P00EBGC [2,0,0,0,0,0|1,0,1]=4 48 B10R0.70 O=NN(CC(=O)O)CC(=O)O 1P002QVY [2,0,0,0,0,0|2,0,0]=4 49 B10R0.119 CCC(C(=O)O)(CC(=O)O)C 1P00EBF8 [2,0,0,0,0,0|1,0,1]=4 50 B10R0.119 NCC(C(=O)O)(CC(=O)O)C 1P00VW4V [2,0,0,0,0,0|2,0,0]=4 51 B10R0.165 OC(=O)CC(CC(=O)O)(C)C 1P003IU6 [2,0,0,0,0,0|1,0,1]=4 52 B10R0.165 OC(=O)CC(CC(=O)O)(F)F 1P00CMHW [2,0,0,0,0,0|2,0,0]=4 53 B10R0.165 OC(=O)CC(CC(=O)O)(O)C 1P00I9HM [2,0,0,0,0,0|0,0,1]=3 54 B10R0.165 OC(=O)CS(=O)(=O)CC(=O)O 1P000KDU [2,0,0,0,0,0|1,0,1]=4 55 B12R0.43 OC(=O)CC(C(C(=O)O)O)C(=O)O 1P001USX [1,1,0,0,0,0|0,0,0]=2 56 B12R0.151 C=CC(=O)NC(C(=O)O)CC(=O)O 1P01BSH9 [1,1,0,0,0,0|2,0,0]=4 57 B12R0.151 COC(=O)C[C@@H](C(=O)O)NC(=O)C 1P019UDP [1,1,0,0,0,0|2,0,0]=4 58 B12R0.151 NCC(=O)NC(C(=O)O)CC(=O)O 1P003R9A [1,1,0,0,0,0|2,0,0]=4 59 B12R0.151 NCC(=O)N[C@H](C(=O)O)CC(=O)O 1P003R9J [1,1,0,0,0,0|2,0,0]=4 60 B12R0.180 COC(=O)[C@@H](NC(=O)C)CC(=O)O 1P00DAAQ [1,1,0,0,0,0|2,0,0]=4 61 B12R0.393 OC(=O)CC(C(=O)O)CP(=O)(O)O 1P01M48X [1,1,0,0,0,0|1,0,0]=3 62 B12R0.356 CCCCC(C(=O)O)(CC(=O)O)O 1P01BKWC [1,1,0,0,0,0|1,0,1]=4 63 B12R0.271 CCCC(CC(=O)O)(CC(=O)O)O 1P01C4HQ [1,1,0,0,0,0|1,0,1]=4 64 B14R0.3762 COC(=O)CC(C(=O)[O-])(CC(=O)OC)O 1P01HWNO [0,2,0,0,0,0|0,0,1]=3 65 B12R1.850 O=C1CC(C(C1)C(=O)O)C(=O)O 1P0034LB [1,0,0,1,0,0|1,0,0]=3 66 B12R1.850 O=C1CC(C(O1)C(=O)O)C(=O)O 1P003QAK [1,0,0,1,0,0|0,0,0]=2 67 B12R1.850 O=C1C[C@H]([C@@H](C1)C(=O)O)C(=O)O 1P0221L8 [1,0,0,1,0,0|1,0,0]=3 68 B12R1.1383 OC(=O)C1[C@@H]([C@H]1C(=O)O)C(=O)O 1P00FDJ0 [1,0,0,1,0,0|0,0,0]=2 69 B10R0.162 OC(=O)CC(C(=O)O)C(=O)O 1P006LS6 [1,0,0,0,1,0|0,0,0]=2 70 B12R0.41 NC(=O)CN(CC(=O)O)CC(=O)O 1P002SVF [1,0,0,0,0,1|2,0,0]=4 71 B12R0.41 OC(=O)CC(CC(=O)O)CC(=O)O 1P00EQHL [1,0,0,0,0,1|0,0,0]=2 72 B12R0.41 OC(=O)CN(CC(=O)O)CC(=O)O 1P003VJ8 [1,0,0,0,0,1|1,0,0]=3 73 B12R0.138 CC(=O)SCC(C(=O)O)CC(=O)O 1P019ZZT [1,0,0,0,0,1|1,0,0]=3 74 B12R0.138 OC(=O)CCC(C(=O)O)CC(=O)O 1P00GTCD [1,0,0,0,0,1|0,0,0]=2 75 B12R0.138 OC(=O)CCC(C(=O)O)NC(=O)C 1P00IATE [1,0,0,0,0,1|2,0,0]=4 76 B12R0.138 OC(=O)CCC(C(=O)O)NC(=O)N 1P00C77I [1,0,0,0,0,1|2,0,0]=4 77 B12R0.138 OC(=O)CC[C@@H](C(=O)O)NC(=O)C 1P00819Y [1,0,0,0,0,1|2,0,0]=4 78 B12R0.138 OC(=O)CC[C@@H](C(=O)O)NC(=O)N 1P0038MW [1,0,0,0,0,1|2,0,0]=4 79 B12R0.138 OC(=O)CC[C@H](C(=O)O)NC(=O)C 1P002FPJ [1,0,0,0,0,1|2,0,0]=4 80 B12R0.138 OC(=O)CSC(C(=O)O)CC(=O)O 1P006O28 [1,0,0,0,0,1|0,0,0]=2 81 B12R0.138 OC(=O)C\C=C(\C(=O)O)/CC(=O)O 1P01HEWJ [1,0,0,0,0,1|0,0,1]=3