COMPND    HMDB0029611
HETATM    1  O1  UNL     1       0.390  -2.186   0.616  1.00  0.00           O  
HETATM    2  C1  UNL     1       0.791  -1.154   0.042  1.00  0.00           C  
HETATM    3  O2  UNL     1       2.093  -1.054  -0.362  1.00  0.00           O  
HETATM    4  C2  UNL     1      -0.140  -0.033  -0.207  1.00  0.00           C  
HETATM    5  C3  UNL     1       0.417   1.166   0.508  1.00  0.00           C  
HETATM    6  S1  UNL     1      -0.848   2.490   0.324  1.00  0.00           S  
HETATM    7  S2  UNL     1      -2.512   1.106   0.263  1.00  0.00           S  
HETATM    8  C4  UNL     1      -1.469  -0.396   0.325  1.00  0.00           C  
HETATM    9  H1  UNL     1       2.843  -0.641   0.192  1.00  0.00           H  
HETATM   10  H2  UNL     1      -0.120   0.151  -1.299  1.00  0.00           H  
HETATM   11  H3  UNL     1       1.287   1.518  -0.082  1.00  0.00           H  
HETATM   12  H4  UNL     1       0.640   0.990   1.560  1.00  0.00           H  
HETATM   13  H5  UNL     1      -1.936  -1.110  -0.382  1.00  0.00           H  
HETATM   14  H6  UNL     1      -1.435  -0.847   1.310  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3    9
CONECT    4    5    8   10
CONECT    5    6   11   12
CONECT    6    7
CONECT    7    8
CONECT    8   13   14
END