COMPND    HMDB0006236
HETATM    1  O1  UNL     1       2.225  -0.524  -1.241  1.00  0.00           O  
HETATM    2  C1  UNL     1       2.591  -0.499  -0.081  1.00  0.00           C  
HETATM    3  C2  UNL     1       1.593  -0.208   0.973  1.00  0.00           C  
HETATM    4  C3  UNL     1       0.257   0.009   0.380  1.00  0.00           C  
HETATM    5  C4  UNL     1      -0.598  -1.055   0.204  1.00  0.00           C  
HETATM    6  C5  UNL     1      -1.850  -0.877  -0.348  1.00  0.00           C  
HETATM    7  C6  UNL     1      -2.312   0.360  -0.750  1.00  0.00           C  
HETATM    8  C7  UNL     1      -1.453   1.426  -0.572  1.00  0.00           C  
HETATM    9  C8  UNL     1      -0.198   1.250  -0.020  1.00  0.00           C  
HETATM   10  H1  UNL     1       3.624  -0.684   0.177  1.00  0.00           H  
HETATM   11  H2  UNL     1       1.934   0.695   1.509  1.00  0.00           H  
HETATM   12  H3  UNL     1       1.564  -1.093   1.673  1.00  0.00           H  
HETATM   13  H4  UNL     1      -0.238  -2.037   0.520  1.00  0.00           H  
HETATM   14  H5  UNL     1      -2.512  -1.739  -0.478  1.00  0.00           H  
HETATM   15  H6  UNL     1      -3.303   0.476  -1.182  1.00  0.00           H  
HETATM   16  H7  UNL     1      -1.803   2.402  -0.883  1.00  0.00           H  
HETATM   17  H8  UNL     1       0.481   2.099   0.119  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   10
CONECT    3    4   11   12
CONECT    4    5    5    9
CONECT    5    6   13
CONECT    6    7    7   14
CONECT    7    8   15
CONECT    8    9    9   16
CONECT    9   17
END