COMPND    HMDB0014991
HETATM    1  C1  UNL     1      -3.581  -0.395   1.057  1.00  0.00           C  
HETATM    2  N1  UNL     1      -2.152  -0.296   0.815  1.00  0.00           N  
HETATM    3  N2  UNL     1      -1.247  -0.620   1.707  1.00  0.00           N  
HETATM    4  N3  UNL     1       0.041  -0.510   1.435  1.00  0.00           N  
HETATM    5  C2  UNL     1       0.493  -0.062   0.235  1.00  0.00           C  
HETATM    6  C3  UNL     1       1.735   0.148  -0.309  1.00  0.00           C  
HETATM    7  C4  UNL     1       3.020  -0.082   0.337  1.00  0.00           C  
HETATM    8  N4  UNL     1       4.226   0.187  -0.366  1.00  0.00           N  
HETATM    9  O1  UNL     1       3.110  -0.519   1.518  1.00  0.00           O  
HETATM   10  N5  UNL     1       1.554   0.608  -1.552  1.00  0.00           N  
HETATM   11  C5  UNL     1       0.235   0.687  -1.791  1.00  0.00           C  
HETATM   12  N6  UNL     1      -0.411   0.272  -0.685  1.00  0.00           N  
HETATM   13  C6  UNL     1      -1.715   0.149  -0.377  1.00  0.00           C  
HETATM   14  O2  UNL     1      -2.537   0.477  -1.277  1.00  0.00           O  
HETATM   15  H1  UNL     1      -3.793  -0.923   1.997  1.00  0.00           H  
HETATM   16  H2  UNL     1      -4.030   0.631   1.048  1.00  0.00           H  
HETATM   17  H3  UNL     1      -4.072  -0.941   0.204  1.00  0.00           H  
HETATM   18  H4  UNL     1       4.556  -0.588  -1.008  1.00  0.00           H  
HETATM   19  H5  UNL     1       4.755   1.084  -0.262  1.00  0.00           H  
HETATM   20  H6  UNL     1      -0.187   1.030  -2.726  1.00  0.00           H  
CONECT    1    2   15   16   17
CONECT    2    3   13
CONECT    3    4    4
CONECT    4    5
CONECT    5    6    6   12
CONECT    6    7   10
CONECT    7    8    9    9
CONECT    8   18   19
CONECT   10   11   11
CONECT   11   12   20
CONECT   12   13
CONECT   13   14   14
END