COMPND    HMDB0032420
HETATM    1  C1  UNL     1      -1.119  -0.139   1.621  1.00  0.00           C  
HETATM    2  C2  UNL     1      -1.130   0.863   0.497  1.00  0.00           C  
HETATM    3  S1  UNL     1      -1.519   2.546   0.554  1.00  0.00           S  
HETATM    4  C3  UNL     1      -1.302   2.910  -1.096  1.00  0.00           C  
HETATM    5  N1  UNL     1      -0.947   1.741  -1.602  1.00  0.00           N  
HETATM    6  C4  UNL     1      -0.852   0.701  -0.835  1.00  0.00           C  
HETATM    7  C5  UNL     1      -0.439  -0.652  -1.360  1.00  0.00           C  
HETATM    8  C6  UNL     1       0.977  -0.998  -1.089  1.00  0.00           C  
HETATM    9  O1  UNL     1       1.315  -1.035   0.271  1.00  0.00           O  
HETATM   10  C7  UNL     1       2.574  -1.339   0.726  1.00  0.00           C  
HETATM   11  O2  UNL     1       3.461  -1.597  -0.155  1.00  0.00           O  
HETATM   12  H1  UNL     1      -0.234  -0.013   2.273  1.00  0.00           H  
HETATM   13  H2  UNL     1      -1.238  -1.159   1.245  1.00  0.00           H  
HETATM   14  H3  UNL     1      -2.046   0.091   2.194  1.00  0.00           H  
HETATM   15  H4  UNL     1      -1.413   3.852  -1.657  1.00  0.00           H  
HETATM   16  H5  UNL     1      -0.725  -0.724  -2.422  1.00  0.00           H  
HETATM   17  H6  UNL     1      -1.068  -1.437  -0.844  1.00  0.00           H  
HETATM   18  H7  UNL     1       1.249  -1.981  -1.525  1.00  0.00           H  
HETATM   19  H8  UNL     1       1.617  -0.263  -1.645  1.00  0.00           H  
HETATM   20  H9  UNL     1       2.840  -1.368   1.782  1.00  0.00           H  
CONECT    1    2   12   13   14
CONECT    2    3    6    6
CONECT    3    4
CONECT    4    5    5   15
CONECT    5    6
CONECT    6    7
CONECT    7    8   16   17
CONECT    8    9   18   19
CONECT    9   10
CONECT   10   11   11   20
END