RESIDUE   CXJ     19
CONECT      C7     3 C6   C2   H5  
CONECT      C4     3 C5   C3   F   
CONECT      C5     3 C4   C6   H4  
CONECT      C6     3 C7   C5   F1  
CONECT      C3     3 C4   C2   H3  
CONECT      C2     3 C7   C3   C   
CONECT      C1     3 C    O1   O2  
CONECT      F1     1 C6  
CONECT      F      1 C4  
CONECT      C      4 C2   C1   O    H1  
CONECT      O      2 C    H   
CONECT      O1     2 C1   H2  
CONECT      O2     1 C1  
CONECT      H5     1 C7  
CONECT      H4     1 C5  
CONECT      H3     1 C3  
CONECT      H1     1 C   
CONECT      H      1 O   
CONECT      H2     1 O1  
END   
HET    CXJ             19
HETNAM     CXJ (2S)-(3,5-difluorophenyl)(hydroxy)acetic acid
FORMUL      CXJ    C8 H6 F2 O3