COMPND    HMDB0060412
HETATM    1  C1  UNL     1       3.219  -0.087  -0.131  1.00  0.00           C  
HETATM    2  S1  UNL     1       2.171   0.176   1.332  1.00  0.00           S  
HETATM    3  C2  UNL     1       0.542   0.656   0.825  1.00  0.00           C  
HETATM    4  N1  UNL     1       0.193   1.942   0.639  1.00  0.00           N  
HETATM    5  C3  UNL     1      -1.039   2.299   0.256  1.00  0.00           C  
HETATM    6  N2  UNL     1      -1.975   1.363   0.043  1.00  0.00           N  
HETATM    7  C4  UNL     1      -1.680   0.049   0.215  1.00  0.00           C  
HETATM    8  N3  UNL     1      -2.463  -1.033   0.056  1.00  0.00           N  
HETATM    9  C5  UNL     1      -1.675  -2.101   0.356  1.00  0.00           C  
HETATM   10  N4  UNL     1      -0.438  -1.668   0.690  1.00  0.00           N  
HETATM   11  C6  UNL     1      -0.408  -0.321   0.610  1.00  0.00           C  
HETATM   12  H1  UNL     1       2.966   0.657  -0.931  1.00  0.00           H  
HETATM   13  H2  UNL     1       4.271   0.011   0.213  1.00  0.00           H  
HETATM   14  H3  UNL     1       3.092  -1.109  -0.531  1.00  0.00           H  
HETATM   15  H4  UNL     1      -1.254   3.340   0.125  1.00  0.00           H  
HETATM   16  H5  UNL     1      -3.481  -1.056  -0.240  1.00  0.00           H  
HETATM   17  H6  UNL     1      -2.042  -3.118   0.315  1.00  0.00           H  
CONECT    1    2   12   13   14
CONECT    2    3
CONECT    3    4    4   11
CONECT    4    5
CONECT    5    6    6   15
CONECT    6    7
CONECT    7    8   11   11
CONECT    8    9   16
CONECT    9   10   10   17
CONECT   10   11
END