COMPND    HMDB0304227
HETATM    1  N1  UNL     1      -4.094   0.772   1.087  1.00  0.00           N  
HETATM    2  C1  UNL     1      -2.834   0.407   0.522  1.00  0.00           C  
HETATM    3  N2  UNL     1      -1.668   0.658   1.156  1.00  0.00           N  
HETATM    4  C2  UNL     1      -0.478   0.303   0.602  1.00  0.00           C  
HETATM    5  C3  UNL     1      -0.500  -0.318  -0.626  1.00  0.00           C  
HETATM    6  C4  UNL     1      -1.689  -0.582  -1.289  1.00  0.00           C  
HETATM    7  O1  UNL     1      -1.659  -1.152  -2.409  1.00  0.00           O  
HETATM    8  N3  UNL     1      -2.827  -0.203  -0.679  1.00  0.00           N  
HETATM    9  N4  UNL     1       0.762  -0.667  -1.159  1.00  0.00           N  
HETATM   10  C5  UNL     1       1.878  -0.447  -0.590  1.00  0.00           C  
HETATM   11  C6  UNL     1       3.173  -0.875  -1.278  1.00  0.00           C  
HETATM   12  O2  UNL     1       3.988   0.206  -1.507  1.00  0.00           O  
HETATM   13  C7  UNL     1       1.994   0.204   0.707  1.00  0.00           C  
HETATM   14  N5  UNL     1       0.733   0.569   1.272  1.00  0.00           N  
HETATM   15  H1  UNL     1      -4.834   1.214   0.497  1.00  0.00           H  
HETATM   16  H2  UNL     1      -4.337   0.621   2.090  1.00  0.00           H  
HETATM   17  H3  UNL     1      -3.758  -0.379  -1.140  1.00  0.00           H  
HETATM   18  H4  UNL     1       2.945  -1.386  -2.213  1.00  0.00           H  
HETATM   19  H5  UNL     1       3.670  -1.524  -0.528  1.00  0.00           H  
HETATM   20  H6  UNL     1       3.709   1.042  -1.095  1.00  0.00           H  
HETATM   21  H7  UNL     1       2.473  -0.572   1.395  1.00  0.00           H  
HETATM   22  H8  UNL     1       2.718   1.061   0.698  1.00  0.00           H  
HETATM   23  H9  UNL     1       0.634   1.047   2.203  1.00  0.00           H  
CONECT    1    2   15   16
CONECT    2    3    3    8
CONECT    3    4
CONECT    4    5    5   14
CONECT    5    6    9
CONECT    6    7    7    8
CONECT    8   17
CONECT    9   10   10
CONECT   10   11   13
CONECT   11   12   18   19
CONECT   12   20
CONECT   13   14   21   22
CONECT   14   23
END