RESIDUE   VK9     56
CONECT      C4     4 C5   C3   H1   H2  
CONECT      C5     4 C4   C6   H3   H4  
CONECT      C6     4 C5   C7   S6   H5  
CONECT      C7     4 C6   C8   H6   H7  
CONECT      C8     4 C7   S8   H8   H9  
CONECT      C13    4 N2   C14  H10  H11 
CONECT      C15    4 C14  N16  H12  H13 
CONECT      C17    3 N16  O18  C19 
CONECT      C21    3 N20  N22  H14 
CONECT      C24    3 N20  C23  N28 
CONECT      S8     2 C8   S6  
CONECT      S6     2 C6   S8  
CONECT      C3     4 C4   C2   H15  H16 
CONECT      C2     4 C3   C1   H17  H18 
CONECT      C1     3 C2   O2   N2  
CONECT      O2     1 C1  
CONECT      N2     3 C13  C1   H19 
CONECT      C14    4 C13  C15  H20  H21 
CONECT      N16    3 C15  C17  H22 
CONECT      O18    1 C17 
CONECT      C19    4 C17  N20  H23  H24 
CONECT      N20    3 C21  C24  C19 
CONECT      N22    2 C21  C23 
CONECT      C23    3 C24  N22  C25 
CONECT      N28    2 C24  C27 
CONECT      C27    3 N28  N26  H25 
CONECT      N26    2 C27  C25 
CONECT      C25    3 C23  N26  N29 
CONECT      N29    3 C25  H26  H27 
CONECT      H1     1 C4  
CONECT      H2     1 C4  
CONECT      H3     1 C5  
CONECT      H4     1 C5  
CONECT      H5     1 C6  
CONECT      H6     1 C7  
CONECT      H7     1 C7  
CONECT      H8     1 C8  
CONECT      H9     1 C8  
CONECT      H10    1 C13 
CONECT      H11    1 C13 
CONECT      H12    1 C15 
CONECT      H13    1 C15 
CONECT      H14    1 C21 
CONECT      H15    1 C3  
CONECT      H16    1 C3  
CONECT      H17    1 C2  
CONECT      H18    1 C2  
CONECT      H19    1 N2  
CONECT      H20    1 C14 
CONECT      H21    1 C14 
CONECT      H22    1 N16 
CONECT      H23    1 C19 
CONECT      H24    1 C19 
CONECT      H25    1 C27 
CONECT      H26    1 N29 
CONECT      H27    1 N29 
END   
HET    VK9             56
HETNAM     VK9 ~{N}-[3-[2-(6-aminopurin-9-yl)ethanoylamino]propyl]-5-[
HETNAM   2 VK9 (3~{R})-1,2-dithiolan-3-yl]pentanamide
FORMUL      VK9    C18 H27 N7 O2 S2