0  B5R0.1  CC(C)=CCO 556-82-1 [0,0,0,0,0,0|0,0,2]=2
1  B5R0.1  C\C=C\C(=O)O 107-93-7 [0,0,0,0,0,0|3,0,0]=3
2  B4R0.1  C=CC(=O)O 79-10-7 [1,0,0,0,0,0|2,0,0]=3
3  B4R0.1  O=CC(=O)O 563-96-2 [1,0,0,0,0,0|2,0,0]=3
4  B6R0.2  CC(=O)CC(=O)[O-] 3483-11-2 [0,1,0,0,0,0|1,0,1]=3
5  B6R0.2  CC(C)=CC(=O)O 541-47-9 [0,1,0,0,0,0|0,0,0]=1
6  B6R0.2  CC(O)CC(=O)O 300-85-6 [0,1,0,0,0,0|1,0,2]=4
7  B6R0.2  CN(C)CC(=O)O 1118-68-9 [0,1,0,0,0,0|1,0,1]=3
8  B6R0.2  C[C@@H](O)CC(=O)O 625-72-9 [0,1,0,0,0,0|1,0,2]=4
9  B6R0.2  O=C(O)CC(=O)O 141-82-2 [0,1,0,0,0,0|2,0,1]=4
10  B6R0.4  O=CNCC(=O)O 2491-15-8 [0,1,0,0,0,0|2,0,1]=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  B5R0.3  CCC(C)C=O 96-17-3 [1,1,0,0,0,0|0,0,1]=3
15  B5R0.3  O=CC(O)CO 56-82-6 [1,1,0,0,0,0|1,0,1]=4
16  B5R0.5  CC(=O)C(=O)O 127-17-3 [1,1,0,0,0,0|1,0,0]=3
17  B5R0.5  CC(=O)C(C)=O 431-03-8 [1,1,0,0,0,0|1,0,0]=3
18  B5R0.5  CC(C)C(=O)O 79-31-2 [1,1,0,0,0,0|0,0,1]=3
19  B5R0.5  CC(N)C(=O)O 56-41-7 [1,1,0,0,0,0|1,0,1]=4
20  B5R0.5  C[C@@H](N)C(=O)O 338-69-2 [1,1,0,0,0,0|1,0,1]=4
21  B5R0.5  C[C@@H](O)C(=O)[O-] 920-49-0 [1,1,0,0,0,0|1,0,1]=4
22  B5R0.5  C[C@H](O)C(=O)O 79-33-4 [1,1,0,0,0,0|1,0,1]=4
23  B5R0.5  O=C(O)C(=O)O 6153-56-6 [1,1,0,0,0,0|2,0,0]=4
24  B7R0.9  CC(C)(O)CC(=O)O 625-08-1 [0,2,0,0,0,0|0,0,2]=4
25  B7R0.9  C[N+](C)(C)CC(=O)[O-] 107-43-7 [0,2,0,0,0,0|1,0,1]=4
26  B7R0.16  CC(C)C(=O)C(=O)O 759-05-7 [0,2,0,0,0,0|0,0,1]=3
27  B7R0.16  CC(C)C(N)C(=O)O 72-18-4 [0,2,0,0,0,0|0,0,2]=4
28  B7R0.16  CC(C)C(O)C(=O)O 4026-18-0 [0,2,0,0,0,0|0,0,2]=4
29  B7R0.6  CC(=O)NCC(=O)O 543-24-8 [0,2,0,0,0,0|1,0,1]=4
30  B7R0.6  CC(C)CCC(=O)O 646-07-1 [0,2,0,0,0,0|0,0,2]=4
31  B7R0.6  NC(=O)\C=C/C(=O)O 557-24-4 [0,2,0,0,0,0|2,0,0]=4
32  B7R0.6  O=C(O)\C=C/C(=O)O 110-16-7 [0,2,0,0,0,0|2,0,0]=4
33  B7R0.6  O=C(O)\C=C\C(=O)O 110-17-8 [0,2,0,0,0,0|2,0,0]=4
34  B7R1.2  O=C1C=CC(=O)N1 541-59-3 [0,1,0,1,0,0|2,0,0]=4