0  B4R0.1  CC[C@@H](C)O B4806 [1,0,0,0,0,0|3,0,0]=4
1  B4R0.1  CC[C@H](C)O B4805 [1,0,0,0,0,0|3,0,0]=4
2  B6R0.5  NCCS(=O)(=O)O T13277 [0,1,0,0,0,0|1,0,0]=2
3  B6R0.5  O=S(=O)([O-])CCS M1653 [0,1,0,0,0,0|1,0,1]=3
4  B5R0.1  CCCC(=O)O B18853 [1,1,0,0,0,0|2,0,0]=4
5  B5R0.1  CNCC(=O)O S18803 [1,1,0,0,0,0|2,0,0]=4
6  B5R0.1  COC[C@@H](C)O M5850 [1,1,0,0,0,0|2,0,0]=4
7  B5R0.1  COC[C@H](C)O M5856 [1,1,0,0,0,0|2,0,0]=4
8  B5R0.3  COC(=O)CN G18901 [1,1,0,0,0,0|2,0,0]=4
9  B5R0.5  CC(Br)C(=O)O B18872 [1,1,0,0,0,0|2,0,0]=4
10  B5R0.5  C[C@@H](Cl)C(=O)O C6128 [1,1,0,0,0,0|2,0,0]=4
11  B5R0.5  C[C@@H](N)C(=O)O A6086 [1,1,0,0,0,0|2,0,0]=4
12  B5R0.5  C[C@H](Cl)C(=O)O C4804 [1,1,0,0,0,0|2,0,0]=4
13  B7R0.13  C=CS(=O)(=O)N(C)C E11519 [0,2,0,0,0,0|2,0,0]=4