RESIDUE   IS8      4
CONECT      S      1 C   
CONECT      C      2 S    N   
CONECT      N      2 C    H1  
CONECT      H1     1 N   
END   
HET    IS8              4
HETNAM     IS8 isothiocyanate
FORMUL      IS8    C1 H1 N1 S1