COMPND    HMDB0250705
HETATM    1  N1  UNL     1      -1.852  -1.023  -0.674  1.00  0.00           N  
HETATM    2  C1  UNL     1      -0.725  -0.201  -0.309  1.00  0.00           C  
HETATM    3  C2  UNL     1       0.458  -1.064  -0.013  1.00  0.00           C  
HETATM    4  S1  UNL     1       1.922  -0.176   0.450  1.00  0.00           S  
HETATM    5  O1  UNL     1       1.919   0.390   1.846  1.00  0.00           O  
HETATM    6  O2  UNL     1       2.481   0.900  -0.705  1.00  0.00           O  
HETATM    7  C3  UNL     1      -1.075   0.756   0.750  1.00  0.00           C  
HETATM    8  O3  UNL     1      -2.238   0.748   1.290  1.00  0.00           O  
HETATM    9  O4  UNL     1      -0.224   1.726   1.254  1.00  0.00           O  
HETATM   10  H1  UNL     1      -1.623  -1.872  -1.187  1.00  0.00           H  
HETATM   11  H2  UNL     1      -2.676  -0.498  -0.998  1.00  0.00           H  
HETATM   12  H3  UNL     1      -0.467   0.398  -1.229  1.00  0.00           H  
HETATM   13  H4  UNL     1       0.707  -1.585  -0.986  1.00  0.00           H  
HETATM   14  H5  UNL     1       0.259  -1.832   0.763  1.00  0.00           H  
HETATM   15  H6  UNL     1       3.401   0.697  -1.028  1.00  0.00           H  
HETATM   16  H7  UNL     1      -0.267   2.637   0.775  1.00  0.00           H  
CONECT    1    2   10   11
CONECT    2    3    7   12
CONECT    3    4   13   14
CONECT    4    5    5    6
CONECT    6   15
CONECT    7    8    8    9
CONECT    9   16
END