COMPND    HMDB0040065
HETATM    1  C1  UNL     1      -4.006  -0.468  -0.302  1.00  0.00           C  
HETATM    2  C2  UNL     1      -2.546  -0.887  -0.216  1.00  0.00           C  
HETATM    3  C3  UNL     1      -1.637   0.319  -0.106  1.00  0.00           C  
HETATM    4  C4  UNL     1      -0.225  -0.201  -0.028  1.00  0.00           C  
HETATM    5  C5  UNL     1       0.780   0.930   0.087  1.00  0.00           C  
HETATM    6  N1  UNL     1       0.439   2.165  -0.117  1.00  0.00           N  
HETATM    7  C6  UNL     1       1.338   3.130  -0.006  1.00  0.00           C  
HETATM    8  S1  UNL     1       2.751   2.268   0.410  1.00  0.00           S  
HETATM    9  C7  UNL     1       2.082   0.670   0.415  1.00  0.00           C  
HETATM   10  C8  UNL     1       2.789  -0.607   0.703  1.00  0.00           C  
HETATM   11  C9  UNL     1       3.119  -1.355  -0.548  1.00  0.00           C  
HETATM   12  H1  UNL     1      -4.222  -0.291  -1.364  1.00  0.00           H  
HETATM   13  H2  UNL     1      -4.160   0.423   0.340  1.00  0.00           H  
HETATM   14  H3  UNL     1      -4.612  -1.283   0.105  1.00  0.00           H  
HETATM   15  H4  UNL     1      -2.378  -1.525   0.694  1.00  0.00           H  
HETATM   16  H5  UNL     1      -2.303  -1.492  -1.090  1.00  0.00           H  
HETATM   17  H6  UNL     1      -1.769   0.900  -1.041  1.00  0.00           H  
HETATM   18  H7  UNL     1      -1.919   0.929   0.769  1.00  0.00           H  
HETATM   19  H8  UNL     1       0.002  -0.707  -0.994  1.00  0.00           H  
HETATM   20  H9  UNL     1      -0.095  -0.887   0.831  1.00  0.00           H  
HETATM   21  H10 UNL     1       1.164   4.211  -0.155  1.00  0.00           H  
HETATM   22  H11 UNL     1       3.659  -0.422   1.358  1.00  0.00           H  
HETATM   23  H12 UNL     1       2.094  -1.259   1.299  1.00  0.00           H  
HETATM   24  H13 UNL     1       3.567  -2.335  -0.286  1.00  0.00           H  
HETATM   25  H14 UNL     1       2.210  -1.500  -1.153  1.00  0.00           H  
HETATM   26  H15 UNL     1       3.879  -0.727  -1.102  1.00  0.00           H  
CONECT    1    2   12   13   14
CONECT    2    3   15   16
CONECT    3    4   17   18
CONECT    4    5   19   20
CONECT    5    6    9    9
CONECT    6    7    7
CONECT    7    8   21
CONECT    8    9
CONECT    9   10
CONECT   10   11   22   23
CONECT   11   24   25   26
END