RESIDUE   A1BBN     40
CONECT      N2     3 C6   C7   H7  
CONECT      C3     3 C4   N1   N4  
CONECT      C6     3 N2   C5   H6  
CONECT      C9     4 C1   C10  H10  H9  
CONECT      C12    4 C11  C13  H15  H14 
CONECT      C14    4 C13  C15  H17  H18 
CONECT      C1     4 C9   C13  C2   O1  
CONECT      C10    4 C9   C11  C15  H11 
CONECT      C11    4 C12  C10  H12  H13 
CONECT      C13    4 C12  C14  C1   H16 
CONECT      C15    4 C14  C10  H19  H20 
CONECT      C2     4 C1   N1   H3   H2  
CONECT      C4     3 C3   C5   C7  
CONECT      C5     3 C6   C4   H5  
CONECT      C7     3 N2   C4   N3  
CONECT      C8     3 N3   N4   H8  
CONECT      N1     3 C3   C2   H4  
CONECT      N3     2 C7   C8  
CONECT      N4     2 C3   C8  
CONECT      O1     2 C1   H1  
CONECT      H7     1 N2  
CONECT      H6     1 C6  
CONECT      H10    1 C9  
CONECT      H9     1 C9  
CONECT      H15    1 C12 
CONECT      H14    1 C12 
CONECT      H17    1 C14 
CONECT      H18    1 C14 
CONECT      H11    1 C10 
CONECT      H12    1 C11 
CONECT      H13    1 C11 
CONECT      H16    1 C13 
CONECT      H19    1 C15 
CONECT      H20    1 C15 
CONECT      H3     1 C2  
CONECT      H2     1 C2  
CONECT      H5     1 C5  
CONECT      H8     1 C8  
CONECT      H4     1 N1  
CONECT      H1     1 O1  
END   
HET    A1BBN             40
HETNAM     A1BBN (1R,2R,4S)-2-{[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]m
HETNAM   2 A1BBN ethyl}bicyclo[2.2.2]octan-2-ol
FORMUL      A1BBN    C15 H20 N4 O