COMPND    HMDB0003282
HETATM    1  C1  UNL     1      -2.311  -0.797  -0.239  1.00  0.00           C  
HETATM    2  N1  UNL     1      -0.990  -0.215  -0.060  1.00  0.00           N  
HETATM    3  C2  UNL     1      -0.874   1.023   0.393  1.00  0.00           C  
HETATM    4  N2  UNL     1      -2.061   1.748   0.692  1.00  0.00           N  
HETATM    5  N3  UNL     1       0.356   1.586   0.567  1.00  0.00           N  
HETATM    6  C3  UNL     1       1.464   0.859   0.269  1.00  0.00           C  
HETATM    7  N4  UNL     1       2.781   1.088   0.318  1.00  0.00           N  
HETATM    8  C4  UNL     1       3.480   0.017  -0.096  1.00  0.00           C  
HETATM    9  N5  UNL     1       2.552  -0.917  -0.414  1.00  0.00           N  
HETATM   10  C5  UNL     1       1.324  -0.431  -0.202  1.00  0.00           C  
HETATM   11  C6  UNL     1       0.071  -1.001  -0.378  1.00  0.00           C  
HETATM   12  O1  UNL     1      -0.087  -2.176  -0.807  1.00  0.00           O  
HETATM   13  H1  UNL     1      -2.981  -0.054  -0.713  1.00  0.00           H  
HETATM   14  H2  UNL     1      -2.717  -1.029   0.773  1.00  0.00           H  
HETATM   15  H3  UNL     1      -2.271  -1.760  -0.786  1.00  0.00           H  
HETATM   16  H4  UNL     1      -2.282   2.023   1.673  1.00  0.00           H  
HETATM   17  H5  UNL     1      -2.745   2.028  -0.043  1.00  0.00           H  
HETATM   18  H6  UNL     1       4.564  -0.111  -0.172  1.00  0.00           H  
HETATM   19  H7  UNL     1       2.730  -1.882  -0.775  1.00  0.00           H  
CONECT    1    2   13   14   15
CONECT    2    3   11
CONECT    3    4    5    5
CONECT    4   16   17
CONECT    5    6
CONECT    6    7   10   10
CONECT    7    8    8
CONECT    8    9   18
CONECT    9   10   19
CONECT   10   11
CONECT   11   12   12
END