COMPND    HMDB0014731
HETATM    1  C1  UNL     1       2.066  -0.062   0.911  1.00  0.00           C  
HETATM    2  C2  UNL     1       1.057   0.595   0.016  1.00  0.00           C  
HETATM    3  C3  UNL     1      -0.143  -0.281  -0.263  1.00  0.00           C  
HETATM    4  C4  UNL     1       0.246  -1.572  -0.939  1.00  0.00           C  
HETATM    5  C5  UNL     1      -1.088   0.526  -1.132  1.00  0.00           C  
HETATM    6  C6  UNL     1      -1.673   1.453  -0.129  1.00  0.00           C  
HETATM    7  O1  UNL     1      -2.007   2.659  -0.210  1.00  0.00           O  
HETATM    8  N1  UNL     1      -1.802   0.654   1.061  1.00  0.00           N  
HETATM    9  C7  UNL     1      -0.963  -0.489   0.949  1.00  0.00           C  
HETATM   10  O2  UNL     1      -0.903  -1.487   1.705  1.00  0.00           O  
HETATM   11  H1  UNL     1       1.910   0.273   1.950  1.00  0.00           H  
HETATM   12  H2  UNL     1       3.079   0.326   0.604  1.00  0.00           H  
HETATM   13  H3  UNL     1       2.051  -1.155   0.816  1.00  0.00           H  
HETATM   14  H4  UNL     1       0.677   1.510   0.513  1.00  0.00           H  
HETATM   15  H5  UNL     1       1.504   0.872  -0.941  1.00  0.00           H  
HETATM   16  H6  UNL     1       0.882  -1.310  -1.797  1.00  0.00           H  
HETATM   17  H7  UNL     1       0.685  -2.261  -0.221  1.00  0.00           H  
HETATM   18  H8  UNL     1      -0.678  -2.033  -1.351  1.00  0.00           H  
HETATM   19  H9  UNL     1      -1.891  -0.163  -1.456  1.00  0.00           H  
HETATM   20  H10 UNL     1      -0.585   1.044  -1.954  1.00  0.00           H  
HETATM   21  H11 UNL     1      -2.423   0.899   1.868  1.00  0.00           H  
CONECT    1    2   11   12   13
CONECT    2    3   14   15
CONECT    3    4    5    9
CONECT    4   16   17   18
CONECT    5    6   19   20
CONECT    6    7    7    8
CONECT    8    9   21
CONECT    9   10   10
END