COMPND    HMDB0031626
HETATM    1  C1  UNL     1      -2.241  -0.197  -0.863  1.00  0.00           C  
HETATM    2  C2  UNL     1      -1.449   0.109   0.382  1.00  0.00           C  
HETATM    3  C3  UNL     1      -1.622   1.546   0.800  1.00  0.00           C  
HETATM    4  O1  UNL     1      -2.147   1.841   1.864  1.00  0.00           O  
HETATM    5  C4  UNL     1       0.007  -0.131   0.204  1.00  0.00           C  
HETATM    6  C5  UNL     1       0.734   0.517  -0.801  1.00  0.00           C  
HETATM    7  C6  UNL     1       2.084   0.283  -0.951  1.00  0.00           C  
HETATM    8  C7  UNL     1       2.781  -0.584  -0.138  1.00  0.00           C  
HETATM    9  C8  UNL     1       2.071  -1.231   0.861  1.00  0.00           C  
HETATM   10  C9  UNL     1       0.722  -0.995   1.008  1.00  0.00           C  
HETATM   11  H1  UNL     1      -2.340   0.714  -1.521  1.00  0.00           H  
HETATM   12  H2  UNL     1      -1.765  -0.966  -1.491  1.00  0.00           H  
HETATM   13  H3  UNL     1      -3.260  -0.552  -0.625  1.00  0.00           H  
HETATM   14  H4  UNL     1      -1.776  -0.517   1.233  1.00  0.00           H  
HETATM   15  H5  UNL     1      -1.290   2.368   0.179  1.00  0.00           H  
HETATM   16  H6  UNL     1       0.172   1.199  -1.436  1.00  0.00           H  
HETATM   17  H7  UNL     1       2.641   0.784  -1.727  1.00  0.00           H  
HETATM   18  H8  UNL     1       3.841  -0.758  -0.268  1.00  0.00           H  
HETATM   19  H9  UNL     1       2.634  -1.906   1.487  1.00  0.00           H  
HETATM   20  H10 UNL     1       0.204  -1.523   1.804  1.00  0.00           H  
CONECT    1    2   11   12   13
CONECT    2    3    5   14
CONECT    3    4    4   15
CONECT    5    6    6   10
CONECT    6    7   16
CONECT    7    8    8   17
CONECT    8    9   18
CONECT    9   10   10   19
CONECT   10   20
END