RESIDUE   A1MDA     49
CONECT      C10    3 C11  C05  N09 
CONECT      C11    3 C10  C12  H1  
CONECT      C12    3 C11  C13  H2  
CONECT      C13    3 C12  C04  H3  
CONECT      C14    4 C15  C02  C27  H4  
CONECT      C15    4 C14  C16  H5   H6  
CONECT      O01    1 C02 
CONECT      C02    3 C14  O01  N03 
CONECT      N03    3 C02  C04  H7  
CONECT      C04    3 C13  N03  C05 
CONECT      C05    3 C10  C04  S06 
CONECT      S06    2 C05  C07 
CONECT      C07    3 S06  O08  N09 
CONECT      O08    1 C07 
CONECT      N09    3 C10  C07  H8  
CONECT      C16    4 C15  C17  H9   H10 
CONECT      C17    4 C16  N18  H11  H12 
CONECT      N18    3 C17  C19  C27 
CONECT      C19    4 N18  C20  H14  H15 
CONECT      C20    4 C19  C21  H16  H17 
CONECT      C21    3 C20  N22  C26 
CONECT      N22    2 C21  C23 
CONECT      C23    3 N22  C24  H18 
CONECT      C24    3 C23  C25  H19 
CONECT      C25    3 C24  C26  H20 
CONECT      C26    3 C21  C25  H21 
CONECT      C27    4 C14  N18  H22  H23 
CONECT      H1     1 C11 
CONECT      H2     1 C12 
CONECT      H3     1 C13 
CONECT      H4     1 C14 
CONECT      H5     1 C15 
CONECT      H6     1 C15 
CONECT      H7     1 N03 
CONECT      H8     1 N09 
CONECT      H9     1 C16 
CONECT      H10    1 C16 
CONECT      H11    1 C17 
CONECT      H12    1 C17 
CONECT      H14    1 C19 
CONECT      H15    1 C19 
CONECT      H16    1 C20 
CONECT      H17    1 C20 
CONECT      H18    1 C23 
CONECT      H19    1 C24 
CONECT      H20    1 C25 
CONECT      H21    1 C26 
CONECT      H22    1 C27 
CONECT      H23    1 C27 
END   
HET    A1MDA             49
HETNAM     A1MDA (3~{S})-~{N}-(2-oxidanylidene-3~{H}-1,3-benzothiazol-7-
HETNAM   2 A1MDA yl)-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide
FORMUL      A1MDA    C20 H22 N4 O2 S