COMPND HMDB0001453 HETATM 1 N1 UNL 1 -1.362 -0.839 0.000 1.00 0.00 N HETATM 2 C1 UNL 1 -0.206 -0.700 0.000 1.00 0.00 C HETATM 3 S1 UNL 1 1.568 -0.490 0.000 1.00 0.00 S1- CONECT 1 2 2 2 CONECT 2 3 END