COMPND    HMDB0245112
HETATM    1  C1  UNL     1       2.369   0.287   0.364  1.00  0.00           C  
HETATM    2  C2  UNL     1       1.478  -0.595  -0.492  1.00  0.00           C  
HETATM    3  C3  UNL     1       0.062  -0.210  -0.308  1.00  0.00           C  
HETATM    4  N1  UNL     1      -0.364   0.735   0.465  1.00  0.00           N  
HETATM    5  C4  UNL     1      -1.788   0.825   0.391  1.00  0.00           C  
HETATM    6  C5  UNL     1      -2.159  -0.534  -0.164  1.00  0.00           C  
HETATM    7  O1  UNL     1      -1.016  -0.819  -0.950  1.00  0.00           O  
HETATM    8  H1  UNL     1       3.286   0.497  -0.223  1.00  0.00           H  
HETATM    9  H2  UNL     1       2.588  -0.199   1.331  1.00  0.00           H  
HETATM   10  H3  UNL     1       1.816   1.250   0.549  1.00  0.00           H  
HETATM   11  H4  UNL     1       1.619  -1.667  -0.244  1.00  0.00           H  
HETATM   12  H5  UNL     1       1.722  -0.463  -1.584  1.00  0.00           H  
HETATM   13  H6  UNL     1      -2.036   1.592  -0.384  1.00  0.00           H  
HETATM   14  H7  UNL     1      -2.278   1.035   1.357  1.00  0.00           H  
HETATM   15  H8  UNL     1      -2.221  -1.255   0.665  1.00  0.00           H  
HETATM   16  H9  UNL     1      -3.080  -0.480  -0.772  1.00  0.00           H  
CONECT    1    2    8    9   10
CONECT    2    3   11   12
CONECT    3    4    4    7
CONECT    4    5
CONECT    5    6   13   14
CONECT    6    7   15   16
END