0  B5R0.3  CCC(C)C=O 96-17-3 [0,0,0,0,0,0|0,0,2]=2
1  B5R0.3  O=CC(O)CO 56-82-6 [0,0,0,0,0,0|2,0,2]=4
2  B4R0.1  C=CC(=O)O 79-10-7 [1,0,0,0,0,0|1,0,1]=3
3  B4R0.1  CCC(=O)O 79-09-4 [1,0,0,0,0,0|1,0,1]=3
4  B4R0.1  CNC(=N)N 21770-81-0 [1,0,0,0,0,0|3,0,0]=4
5  B4R0.1  NCC(=O)O 56-40-6 [1,0,0,0,0,0|2,0,1]=4
6  B4R0.1  O=CC(=O)O 563-96-2 [1,0,0,0,0,0|2,0,0]=3
7  B6R0.3  CC(CN)C(=O)O 144-90-1 [0,1,0,0,0,0|1,0,2]=4
8  B6R0.3  CCC(=O)C(=O)O 600-18-0 [0,1,0,0,0,0|1,0,1]=3
9  B6R0.3  CCC(O)C(=O)[O-] 5094-24-6 [0,1,0,0,0,0|1,0,2]=4
10  B6R0.3  CC[C@H](N)C(=O)O 1492-24-6 [0,1,0,0,0,0|1,0,2]=4
11  B3R0.2  CN(C)C 593-81-7 [2,0,0,0,0,0|1,0,1]=4
12  B3R0.2  NC(N)=O 57-13-6 [2,0,0,0,0,0|2,0,0]=4
13  B3R0.2  O=C([O-])[O-] 471-34-1 [2,0,0,0,0,0|2,0,0]=4
14  B5R0.1  CC(C)=CCO 556-82-1 [1,1,0,0,0,0|0,0,1]=3
15  B5R0.1  CCCC(=O)O 107-92-6 [1,1,0,0,0,0|1,0,1]=4
16  B5R0.1  CNCC(=O)O 107-97-1 [1,1,0,0,0,0|1,0,1]=4
17  B5R0.1  C\C=C\C(=O)O 107-93-7 [1,1,0,0,0,0|1,0,0]=3
18  B5R0.1  NCCC(=O)O 107-95-9 [1,1,0,0,0,0|1,0,1]=4
19  B5R0.5  CC(=O)C(=O)O 127-17-3 [1,1,0,0,0,0|1,0,0]=3
20  B5R0.5  CC(=O)C(C)=O 431-03-8 [1,1,0,0,0,0|0,0,0]=2
21  B5R0.5  CC(C)C(=O)O 79-31-2 [1,1,0,0,0,0|0,0,1]=3
22  B5R0.5  CC(N)C(=O)O 56-41-7 [1,1,0,0,0,0|1,0,1]=4
23  B5R0.5  C[C@@H](N)C(=O)O 338-69-2 [1,1,0,0,0,0|1,0,1]=4
24  B5R0.5  C[C@@H](O)C(=O)[O-] 920-49-0 [1,1,0,0,0,0|1,0,1]=4
25  B5R0.5  C[C@H](O)C(=O)O 79-33-4 [1,1,0,0,0,0|1,0,1]=4
26  B5R0.5  O=C(O)C(=O)O 6153-56-6 [1,1,0,0,0,0|2,0,0]=4
27  B7R0.16  CC(C(=O)O)C(=O)O 516-05-2 [0,2,0,0,0,0|1,0,1]=4
28  B7R0.16  CC(C)C(=O)C(=O)O 759-05-7 [0,2,0,0,0,0|1,0,1]=4
29  B7R1.2  O=C1C=CC(=O)N1 541-59-3 [0,1,0,1,0,0|1,0,1]=4