0  B3R0.2  CC(=O)C 1458a_100000070787_200000210301 [1,0,0,0,0,0|3,0,0]=4
1  B3R0.2  CC(=O)[13CH3] 1458a_100000070787_200025704644 [1,0,0,0,0,0|3,0,0]=4
2  B5R0.4  CNS(=O)(=O)C 40a_100102657272_100000738038 [0,1,0,0,0,0|2,0,0]=3
3  B4R0.1  CC(=O)CO 1458a_100000210174_200000210301 [1,1,0,0,0,0|2,0,0]=4
4  B4R0.1  [13CH3]C(=O)CO 1458a_100000210174_200025704644 [1,1,0,0,0,0|2,0,0]=4
5  B6R0.5  CCNS(=O)(=O)C 40a_100015525214_100000738038 [0,2,0,0,0,0|2,0,0]=4
6  B6R0.5  CNCS(=O)(=O)[O-] 34a_100102657272_100009817235 [0,2,0,0,0,0|1,0,1]=4
7  B6R0.5  CNNS(=O)(=O)C 40a_100016993582_100000738038 [0,2,0,0,0,0|2,0,0]=4
8  B6R0.5  COCS(=O)(=O)[O-] 34a_100138415774_100009817235 [0,2,0,0,0,0|0,0,1]=3
9  B6R0.5  CSCS(=O)(=O)N 62a_100000741382_200000210301 [0,2,0,0,0,0|1,1,0]=4
10  B6R0.5  CSCS(=O)(=O)N 62a_200000210301_100000741382 [0,2,0,0,0,0|1,1,0]=4
11  B6R0.5  CSCS(=O)(=O)[O-] 62a_100009817235_200000210301 [0,2,0,0,0,0|0,1,1]=4
12  B6R0.5  CSCS(=O)(=O)[O-] 62a_200000210301_100009817235 [0,2,0,0,0,0|0,1,1]=4
13  B6R0.5  [13CH3]SCS(=O)(=O)N 62a_100000741382_200025704644 [0,2,0,0,0,0|1,1,0]=4
14  B6R0.5  [13CH3]SCS(=O)(=O)N 62a_200025704644_100000741382 [0,2,0,0,0,0|1,1,0]=4
15  B6R0.5  [13CH3]SCS(=O)(=O)[O-] 62a_100009817235_200025704644 [0,2,0,0,0,0|0,1,1]=4
16  B6R0.5  [13CH3]SCS(=O)(=O)[O-] 62a_200025704644_100009817235 [0,2,0,0,0,0|0,1,1]=4
17  B6R0.7  CN(C)S(=O)(=O)C 40a_100102631434_100000738038 [0,2,0,0,0,0|2,0,0]=4
18  B6R0.8  CCS(=O)(=O)NC 270084a_100102657272_100000211323 [0,2,0,0,0,0|2,0,0]=4
19  B6R0.8  CCS(=O)(=O)NC 274078a_100102657272_100000211323 [0,2,0,0,0,0|2,0,0]=4
20  B6R0.8  CCS(=O)(=O)NC 40a_100102657272_100000053943 [0,2,0,0,0,0|2,0,0]=4
21  B6R0.8  CNS(=O)(=O)CCl 270084a_100102657272_100000031410 [0,2,0,0,0,0|2,0,0]=4
22  B6R0.8  CNS(=O)(=O)CCl 274078a_100102657272_100000031410 [0,2,0,0,0,0|2,0,0]=4