0 B6R0.4 CCCCC(=O)O 109-52-4 [0,0,0,0,0,0|0,0,0]=0 1 B6R0.4 CSCCC(=O)O 646-01-5 [0,0,0,0,0,0|1,0,0]=1 2 B6R0.4 NCCCC(=O)O 56-12-2 [0,0,0,0,0,0|1,0,0]=1 3 B6R0.4 O=CNCC(=O)O 2491-15-8 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.1 CCCC(=O)O 107-92-6 [1,0,0,0,0,0|0,0,0]=1 5 B5R0.1 CNCC(=O)O 107-97-1 [1,0,0,0,0,0|1,0,0]=2 6 B5R0.1 C\C=C\C(=O)O 107-93-7 [1,0,0,0,0,0|0,0,2]=3 7 B5R0.1 NCCC(=O)O 107-95-9 [1,0,0,0,0,0|1,0,0]=2 8 B5R0.1 NCCS(=O)O 300-84-5 [1,0,0,0,0,0|2,0,0]=3 9 B5R0.2 NCCCCN 110-60-1 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.4 CCCCCC(=O)O 142-62-1 [0,1,0,0,0,0|0,0,0]=1 11 B7R0.4 NCCCCC(=O)O 660-88-8 [0,1,0,0,0,0|0,0,0]=1 12 B7R0.5 CCC[C@H](N)C(=O)O 6600-40-4 [0,1,0,0,0,0|0,0,0]=1 13 B7R0.5 NC(CCS)C(=O)O 454-29-5 [0,1,0,0,0,0|1,0,0]=2 14 B7R0.5 N[C@@H](CCO)C(=O)O 672-15-1 [0,1,0,0,0,0|1,0,0]=2 15 B7R0.6 CC(=O)NCC(=O)O 543-24-8 [0,1,0,0,0,0|1,0,1]=3 16 B7R0.6 CC(C)CCC(=O)O 646-07-1 [0,1,0,0,0,0|0,0,0]=1 17 B7R0.6 N=C(N)NCC(=O)O 352-97-6 [0,1,0,0,0,0|2,0,1]=4 18 B7R0.6 O=C(O)CCC(=O)O 110-15-6 [0,1,0,0,0,0|1,0,1]=3 19 B7R0.8 NCCCS(=O)(=O)O 3687-18-1 [0,1,0,0,0,0|2,0,0]=3 20 B7R0.8 NCCOP(=O)(O)O 1071-23-4 [0,1,0,0,0,0|3,0,0]=4 21 B7R1.3 O=C1CCCCO1 542-28-9 [0,0,0,1,0,0|0,0,0]=1 22 B4R0.1 C=CC(=O)O 79-10-7 [2,0,0,0,0,0|0,0,2]=4 23 B4R0.1 CCC(=O)O 79-09-4 [2,0,0,0,0,0|0,0,0]=2 24 B4R0.1 NCC(=O)O 56-40-6 [2,0,0,0,0,0|1,0,0]=3 25 B4R0.1 O=CC(=O)O 563-96-2 [2,0,0,0,0,0|1,0,1]=4 26 B4R0.2 COCCO 109-86-4 [2,0,0,0,0,0|1,0,0]=3 27 B4R0.2 NCCCN 109-76-2 [2,0,0,0,0,0|2,0,0]=4 28 B6R0.2 CC(=O)CC(=O)[O-] 3483-11-2 [1,1,0,0,0,0|0,0,2]=4 29 B6R0.2 CC(C)=CC(=O)O 541-47-9 [1,1,0,0,0,0|0,0,2]=4 30 B6R0.2 CC(O)CC(=O)O 300-85-6 [1,1,0,0,0,0|0,0,0]=2 31 B6R0.2 CN(C)CC(=O)O 1118-68-9 [1,1,0,0,0,0|1,0,0]=3 32 B6R0.2 C[C@@H](O)CC(=O)O 625-72-9 [1,1,0,0,0,0|0,0,0]=2 33 B6R0.2 O=C(O)CC(=O)O 141-82-2 [1,1,0,0,0,0|1,0,1]=4 34 B6R0.3 CC(CN)C(=O)O 144-90-1 [1,1,0,0,0,0|1,0,0]=3 35 B6R0.3 CCC(=O)C(=O)O 600-18-0 [1,1,0,0,0,0|0,0,1]=3 36 B6R0.3 CCC(O)C(=O)[O-] 5094-24-6 [1,1,0,0,0,0|0,0,1]=3 37 B6R0.3 CC[C@H](N)C(=O)O 1492-24-6 [1,1,0,0,0,0|0,0,0]=2 38 B6R0.3 NC(CO)C(=O)O 56-45-1 [1,1,0,0,0,0|1,0,0]=3 39 B6R0.3 NC(CS)C(=O)O 52-90-4 [1,1,0,0,0,0|1,0,0]=3 40 B6R0.3 NCC(N)C(=O)O 54897-59-5 [1,1,0,0,0,0|1,0,0]=3 41 B6R0.5 NCCP(=O)(O)O 2041-14-7 [1,1,0,0,0,0|2,0,0]=4 42 B6R0.5 NCCS(=O)(=O)O 107-35-7 [1,1,0,0,0,0|2,0,0]=4 43 B6R0.6 NCCCCCN 1476-39-7 [1,1,0,0,0,0|1,0,1]=4 44 B6R0.6 OCCNCCO 111-42-2 [1,1,0,0,0,0|1,0,1]=4 45 B6R0.6 OCCSCCO 111-48-8 [1,1,0,0,0,0|1,0,1]=4 46 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O 1509-34-8 [0,2,0,0,0,0|0,0,0]=2 47 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O 73-32-5 [0,2,0,0,0,0|0,0,0]=2 48 B8R0.2 O=C([O-])[C@H](O)[C@@H](O)CO 70753-61-6 [0,2,0,0,0,0|1,0,1]=4 49 B8R0.5 CCOC(=O)CC(=O)O 1071-46-1 [0,2,0,0,0,0|0,0,1]=3 50 B8R0.23 CC(=O)N[C@@H](C)C(=O)O 97-69-8 [0,2,0,0,0,0|1,0,1]=4 51 B8R0.23 CC(C)CC(=O)C(=O)O 816-66-0 [0,2,0,0,0,0|0,0,1]=3 52 B8R0.23 CC(C)CC(N)C(=O)O 328-39-2 [0,2,0,0,0,0|0,0,0]=2 53 B8R0.23 CC(C)C[C@H](O)C(=O)O 13748-90-8 [0,2,0,0,0,0|0,0,0]=2 54 B8R0.23 CC(CC(=O)O)C(=O)O 498-21-5 [0,2,0,0,0,0|1,0,1]=4 55 B8R0.23 NC(=O)CC(N)C(=O)O 70-47-3 [0,2,0,0,0,0|1,0,1]=4 56 B8R0.23 NC(CC(=O)O)C(=O)O 56-84-8 [0,2,0,0,0,0|1,0,1]=4 57 B8R0.23 N[C@H](CC(=O)O)C(=O)O 1783-96-6 [0,2,0,0,0,0|1,0,1]=4 58 B8R0.23 O=C(O)C[C@H](O)C(=O)O 97-67-6 [0,2,0,0,0,0|1,0,1]=4 59 B8R0.8 CCCCC(O)C(=O)O 6064-63-7 [0,2,0,0,0,0|0,0,0]=2 60 B8R0.8 CCCC[C@H](N)C(=O)O 327-57-1 [0,2,0,0,0,0|0,0,0]=2 61 B8R0.8 CSCC[C@H](N)C(=O)O 63-68-3 [0,2,0,0,0,0|0,0,0]=2 62 B8R0.8 C[Se]CCC(N)C(=O)O 1464-42-2 [0,2,0,0,0,0|0,0,0]=2 63 B8R0.8 NCCCC(N)C(=O)O 3184-13-2 [0,2,0,0,0,0|0,0,0]=2 64 B8R0.8 NCCC[C@@H](N)C(=O)O 16682-12-5 [0,2,0,0,0,0|0,0,0]=2 65 B8R0.8 NCCC[C@H](N)C(=O)O 70-26-8 [0,2,0,0,0,0|0,0,0]=2 66 B8R0.9 NCC(=O)CCC(=O)O 5451-09-2 [0,2,0,0,0,0|0,0,1]=3 67 B8R0.9 NCC(=O)NCC(=O)O 556-50-3 [0,2,0,0,0,0|1,0,1]=4 68 B8R0.7 CCCCCCC(=O)O 111-14-8 [0,2,0,0,0,0|0,0,0]=2 69 B8R0.7 NCCCCN=C(N)N 2482-00-0 [0,2,0,0,0,0|2,0,0]=4 70 B8R0.28 NC(=O)NCCC(=O)O 462-88-4 [0,2,0,0,0,0|1,0,1]=4 71 B8R0.28 O=C(O)CCCC(=O)O 110-94-1 [0,2,0,0,0,0|0,0,1]=3 72 B6R1.2 O=C1CCCC1 120-92-3 [1,0,0,1,0,0|1,0,0]=3 73 B6R1.2 O=C1CCCN1 616-45-5 [1,0,0,1,0,0|1,0,0]=3 74 B8R1.5 O[C@@H]1CCCC[C@H]1O 1460-57-7 [0,1,0,1,0,0|0,0,2]=4 75 B8R1.7 O=C(O)C1CCCN1 147-85-3 [0,1,0,1,0,0|0,0,0]=2 76 B8R1.7 O=C(O)[C@H]1CCCN1 344-25-2 [0,1,0,1,0,0|0,0,0]=2