0 B9R0.7 CC(=O)OC[C@H](N)C(=O)O 66638-22-0 [0,0,0,0,0,0|2,0,0]=2 1 B9R0.7 CC(CCC(=O)O)C(=O)O 617-62-9 [0,0,0,0,0,0|1,0,0]=1 2 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O 5959-95-5 [0,0,0,0,0,0|1,0,0]=1 3 B9R0.7 NC(=O)CC[C@H](N)C(=O)O 56-85-9 [0,0,0,0,0,0|1,0,0]=1 4 B9R0.7 NC(CCC(=O)O)C(=O)O 56-86-0 [0,0,0,0,0,0|0,0,0]=0 5 B9R0.7 O=C(O)CCC(=O)C(=O)[O-] 22202-68-2 [0,0,0,0,0,0|1,0,2]=3 6 B8R0.8 CCCCC(O)C(=O)O 6064-63-7 [1,0,0,0,0,0|2,0,1]=4 7 B8R0.8 CCCC[C@H](N)C(=O)O 327-57-1 [1,0,0,0,0,0|1,0,1]=3 8 B8R0.8 CSCC[C@H](N)C(=O)O 63-68-3 [1,0,0,0,0,0|2,0,0]=3 9 B8R0.8 C[Se]CCC(N)C(=O)O 1464-42-2 [1,0,0,0,0,0|2,0,0]=3 10 B8R0.8 NCCCC(N)C(=O)O 3184-13-2 [1,0,0,0,0,0|1,0,1]=3 11 B8R0.8 NCCC[C@@H](N)C(=O)O 16682-12-5 [1,0,0,0,0,0|1,0,1]=3 12 B8R0.8 NCCC[C@H](N)C(=O)O 70-26-8 [1,0,0,0,0,0|1,0,1]=3 13 B8R0.28 NC(=O)NCCC(=O)O 462-88-4 [1,0,0,0,0,0|2,0,0]=3 14 B8R0.28 O=C(O)CCCC(=O)O 110-94-1 [1,0,0,0,0,0|0,0,0]=1 15 B10R0.82 NCC(O)CCC(N)C(=O)O 13204-98-3 [0,1,0,0,0,0|1,0,1]=3 16 B10R0.92 NC(COP(=O)(O)O)C(=O)O 17885-08-4 [0,1,0,0,0,0|2,0,0]=3 17 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O 407-41-0 [0,1,0,0,0,0|2,0,0]=3 18 B8R0.23 C=C(CC(=O)O)C(=O)O 97-65-4 [0,0,0,0,1,0|1,0,1]=3 19 B8R0.23 CC(=O)N[C@@H](C)C(=O)O 97-69-8 [0,0,0,0,1,0|3,0,0]=4 20 B8R0.23 CC(C)CC(N)C(=O)O 328-39-2 [0,0,0,0,1,0|2,0,1]=4 21 B8R0.23 CC(CC(=O)O)C(=O)O 498-21-5 [0,0,0,0,1,0|1,0,0]=2 22 B8R0.23 C\C(=C\C(=O)O)C(=O)O 498-23-7 [0,0,0,0,1,0|1,0,2]=4 23 B8R0.23 NC(=O)CC(N)C(=O)O 70-47-3 [0,0,0,0,1,0|1,0,0]=2 24 B8R0.23 NC(CC(=O)O)C(=O)O 56-84-8 [0,0,0,0,1,0|0,0,0]=1 25 B8R0.23 N[C@H](CC(=O)O)C(=O)O 1783-96-6 [0,0,0,0,1,0|0,0,0]=1 26 B8R0.23 O=C(O)CC(=O)C(=O)O 328-42-7 [0,0,0,0,1,0|1,0,1]=3 27 B8R0.23 O=C(O)C[C@H](O)C(=O)O 97-67-6 [0,0,0,0,1,0|1,0,0]=2 28 B10R0.96 C[C@@H](CCC(=O)O)CC(=O)O 3058-01-3 [0,0,0,0,0,1|1,0,0]=2 29 B10R0.98 NC(CCCC(=O)O)C(=O)O 542-32-5 [0,0,0,0,0,1|0,0,0]=1 30 B10R0.98 O=C(O)CCCC(=O)C(=O)O 3184-35-8 [0,0,0,0,0,1|1,0,1]=3 31 B7R0.4 CCCCCC(=O)O 142-62-1 [2,0,0,0,0,0|1,0,1]=4 32 B7R0.4 NCCCCC(=O)O 660-88-8 [2,0,0,0,0,0|1,0,1]=4 33 B7R0.5 CCC[C@H](N)C(=O)O 6600-40-4 [2,0,0,0,0,0|0,0,1]=3 34 B7R0.5 NC(CCS)C(=O)O 454-29-5 [2,0,0,0,0,0|0,1,0]=3 35 B7R0.5 N[C@@H](CCO)C(=O)O 672-15-1 [2,0,0,0,0,0|0,0,0]=2 36 B7R0.6 CC(C)CCC(=O)O 646-07-1 [2,0,0,0,0,0|1,0,1]=4 37 B7R0.6 O=C(O)CCC(=O)O 110-15-6 [2,0,0,0,0,0|1,0,1]=4 38 B9R0.47 NCCCCC(N)C(=O)O 56-87-1 [1,1,0,0,0,0|1,0,1]=4 39 B9R0.1 COC(=O)CCCC(=O)O 1501-27-5 [1,1,0,0,0,0|0,0,0]=2 40 B9R0.53 CC(CC(=O)O)CC(=O)O 626-51-7 [1,1,0,0,0,0|0,0,0]=2 41 B9R0.39 CN[C@H](CC(=O)O)C(=O)O 6384-92-5 [0,1,0,0,1,0|0,0,0]=2 42 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O 23537-25-9 [0,1,0,0,1,0|1,0,0]=3 43 B9R0.79 O=C(O)[C@@H](O)[C@@H](O)C(=O)O 5990-63-6 [0,1,0,0,1,0|1,0,0]=3 44 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O 147-71-7 [0,1,0,0,1,0|1,0,0]=3 45 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O 87-69-4 [0,1,0,0,1,0|1,0,0]=3 46 B9R1.6 O=C(O)C1CCCCN1 535-75-1 [1,0,0,1,0,0|1,0,1]=4 47 B9R1.6 O=C(O)[C@@H]1CCCCN1 3105-95-1 [1,0,0,1,0,0|1,0,1]=4 48 B9R1.35 O=C1CCC(C(=O)O)N1 4042-36-8 [1,0,0,1,0,0|0,0,0]=2 49 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 98-79-3 [1,0,0,1,0,0|0,0,0]=2 50 B7R0.16 CC(C(=O)O)C(=O)O 516-05-2 [0,0,0,0,2,0|1,0,0]=3 51 B7R0.16 CC(O)C(N)C(=O)O 72-19-5 [0,0,0,0,2,0|1,0,1]=4 52 B7R0.16 C[C@H](O)[C@H](N)C(=O)O 28954-12-3 [0,0,0,0,2,0|1,0,1]=4 53 B7R0.16 NC(C(=O)O)C(=O)O 1068-84-4 [0,0,0,0,2,0|0,0,0]=2 54 B9R0.55 CC(=O)NCCCC(=O)O 3025-96-5 [1,0,0,0,0,1|1,0,0]=3 55 B9R0.55 NC(N)=NCCCC(=O)O 463-00-3 [1,0,0,0,0,1|2,0,0]=4 56 B9R0.55 O=C(O)C\C=C\CC(=O)O 4436-74-2 [1,0,0,0,0,1|0,0,1]=3 57 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O 1119-34-2 [0,0,0,0,0,2|2,0,0]=4 58 B11R0.29 NC(=O)NCCCC(N)C(=O)O 627-77-0 [0,0,0,0,0,2|1,0,0]=3 59 B11R0.29 NC(=O)NCCC[C@H](N)C(=O)O 372-75-8 [0,0,0,0,0,2|1,0,0]=3