RESIDUE   SX2     24
CONECT      BR1    1 C8  
CONECT      C8     3 BR1  C9   C7  
CONECT      C9     3 C8   N2   H9  
CONECT      N2     2 C9   C5  
CONECT      C7     3 C8   C6   H7  
CONECT      C6     3 C7   C5   H6  
CONECT      C5     3 N2   C6   N1  
CONECT      N1     3 C5   C4   HN1 
CONECT      C4     3 N1   O3   C3  
CONECT      O3     1 C4  
CONECT      C3     4 C4   C2   H3   H3A 
CONECT      C2     4 C3   C1   H2   H2A 
CONECT      C1     3 C2   O2   O1  
CONECT      O2     2 C1   HO2 
CONECT      O1     1 C1  
CONECT      H9     1 C9  
CONECT      H7     1 C7  
CONECT      H6     1 C6  
CONECT      HN1    1 N1  
CONECT      H3     1 C3  
CONECT      H3A    1 C3  
CONECT      H2     1 C2  
CONECT      H2A    1 C2  
CONECT      HO2    1 O2  
END   
HET    SX2             24
HETNAM     SX2 4-[(5-bromopyridin-2-yl)amino]-4-oxobutanoic acid
FORMUL      SX2    C9 H9 Br1 N2 O3