COMPND    HMDB0245903
HETATM    1  O1  UNL     1       2.519  -0.115  -0.129  1.00  0.00           O  
HETATM    2  C1  UNL     1       1.622  -0.941  -0.244  1.00  0.00           C  
HETATM    3  O2  UNL     1       1.748  -2.132   0.375  1.00  0.00           O  
HETATM    4  C2  UNL     1       0.434  -0.573  -1.017  1.00  0.00           C  
HETATM    5  N1  UNL     1      -0.830  -1.094  -0.542  1.00  0.00           N  
HETATM    6  C3  UNL     1      -1.574  -0.283   0.246  1.00  0.00           C  
HETATM    7  C4  UNL     1      -1.098   1.107  -0.059  1.00  0.00           C  
HETATM    8  C5  UNL     1       0.229   0.977  -0.749  1.00  0.00           C  
HETATM    9  O3  UNL     1       1.201   1.506   0.116  1.00  0.00           O  
HETATM   10  H1  UNL     1       1.953  -2.988  -0.136  1.00  0.00           H  
HETATM   11  H2  UNL     1       0.653  -0.682  -2.044  1.00  0.00           H  
HETATM   12  H3  UNL     1      -1.391  -1.301  -1.476  1.00  0.00           H  
HETATM   13  H4  UNL     1      -2.666  -0.321   0.009  1.00  0.00           H  
HETATM   14  H5  UNL     1      -1.427  -0.515   1.316  1.00  0.00           H  
HETATM   15  H6  UNL     1      -1.007   1.665   0.906  1.00  0.00           H  
HETATM   16  H7  UNL     1      -1.778   1.660  -0.724  1.00  0.00           H  
HETATM   17  H8  UNL     1       0.271   1.543  -1.711  1.00  0.00           H  
HETATM   18  H9  UNL     1       1.142   2.486   0.079  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   10
CONECT    4    5    8   11
CONECT    5    6   12
CONECT    6    7   13   14
CONECT    7    8   15   16
CONECT    8    9   17
CONECT    9   18
END