0  B5R0.4  C#CS(C)(=O)=O AT11264 [0,0,0,0,0,0|2,0,1]=3
1  B5R0.4  CS(=O)(=O)CBr AT13120 [0,0,0,0,0,0|3,0,0]=3
2  B5R0.4  O=S(=O)(Cl)CF AT12627 [0,0,0,0,0,0|3,0,0]=3
3  B4R0.3  O=P(O)(O)O 41446 [1,0,0,0,0,0|1,0,1]=3
4  B4R0.3  O=P(O)(O)O 41451 [1,0,0,0,0,0|1,0,1]=3
5  B6R0.5  CONS(N)(=O)=O AT20298 [0,1,0,0,0,0|1,0,0]=2
6  B6R0.5  O=S(=O)(Cl)CCF AT12628 [0,1,0,0,0,0|2,0,0]=3
7  B6R0.8  CCS(=N)(=O)CC AT25733 [0,1,0,0,0,0|3,0,0]=4
8  B3R0.2  C[13C](=O)[O-] 41466 [2,0,0,0,0,0|1,0,1]=4
9  B3R0.2  [13CH3]C(=O)[O-] 41465 [2,0,0,0,0,0|1,0,1]=4
10  B3R0.2  [13CH3][13C](=O)O 41419 [2,0,0,0,0,0|1,0,0]=3
11  B3R0.2  [13CH3][13C](=O)[O-] 41460 [2,0,0,0,0,0|1,0,1]=4
12  B5R0.5  [13CH3][13C@H]([15NH2])[13C](=O)O D98095 [1,1,0,0,0,0|2,0,0]=4
13  B7R0.8  C#CCNS(N)(=O)=O AT20299 [0,2,0,0,0,0|2,0,0]=4
14  B7R0.8  CNCCS(=O)(=O)F AT24778 [0,2,0,0,0,0|2,0,0]=4
15  B7R0.8  CSCCS(N)(=O)=O AT20773 [0,2,0,0,0,0|1,1,0]=4
16  B7R0.8  NS(=O)(=O)NCCO AT20309 [0,2,0,0,0,0|2,0,0]=4
17  B7R0.9  CC(=O)CS(=O)(=O)F E73418 [0,2,0,0,0,0|2,0,0]=4
18  B7R1.14  O=S1(=O)CCC=N1 38085 [0,1,0,1,0,0|2,0,0]=4