0  B5R0.5  CC(=O)C(C)=O 431-03-8 [0,0,0,0,0,0|0,2,2]=4
1  B5R0.5  CC(C)C(=O)O 79-31-2 [0,0,0,0,0,0|2,1,1]=4
2  B5R0.5  CC(N)C(=O)O 56-41-7 [0,0,0,0,0,0|2,1,1]=4
3  B5R0.5  C[C@@H](N)C(=O)O 338-69-2 [0,0,0,0,0,0|2,1,1]=4
4  B5R0.5  C[C@@H](O)C(=O)[O-] 920-49-0 [0,0,0,0,0,0|1,2,1]=4
5  B5R0.5  C[C@@H](O)[C@@H](C)O 24347-58-8 [0,0,0,0,0,0|0,2,0]=2
6  B5R0.5  C[C@H](O)C(=O)O 79-33-4 [0,0,0,0,0,0|1,2,1]=4
7  B4R0.1  CCC(=O)O 79-09-4 [1,0,0,0,0,0|1,1,1]=4
8  B3R0.1  NCCO 141-43-5 [2,0,0,0,0,0|1,1,0]=4
9  B3R0.1  NCCS 60-23-1 [2,0,0,0,0,0|1,0,0]=3
10  B3R0.2  CN(C)C 593-81-7 [2,0,0,0,0,0|2,0,0]=4
11  B5R0.3  CCC(C)C=O 96-17-3 [1,1,0,0,0,0|0,1,0]=3
12  B5R0.3  OCC(O)CO 56-81-5 [1,1,0,0,0,0|0,2,0]=4
13  B7R0.10  OC[C@@H](O)[C@H](O)CO 7493-90-5 [0,2,0,0,0,0|0,2,0]=4
14  B7R0.10  OC[C@H](O)[C@H](O)CO 149-32-6 [0,2,0,0,0,0|0,2,0]=4