COMPND    HMDB0012182
HETATM    1  O1  UNL     1       2.790  -1.304   1.140  1.00  0.00           O  
HETATM    2  C1  UNL     1       1.656  -0.653   0.558  1.00  0.00           C  
HETATM    3  N1  UNL     1       1.562   0.593   0.376  1.00  0.00           N  
HETATM    4  C2  UNL     1       0.318   0.945  -0.221  1.00  0.00           C  
HETATM    5  N2  UNL     1      -0.426   1.912   0.522  1.00  0.00           N  
HETATM    6  C3  UNL     1      -1.614   1.735   0.906  1.00  0.00           C  
HETATM    7  N3  UNL     1      -2.287   0.538   0.613  1.00  0.00           N  
HETATM    8  C4  UNL     1      -1.742  -0.400  -0.036  1.00  0.00           C  
HETATM    9  C5  UNL     1      -0.363  -0.329  -0.540  1.00  0.00           C  
HETATM   10  N4  UNL     1       0.495  -1.299   0.112  1.00  0.00           N  
HETATM   11  H1  UNL     1       3.585  -1.549   0.564  1.00  0.00           H  
HETATM   12  H2  UNL     1       0.582   1.485  -1.193  1.00  0.00           H  
HETATM   13  H3  UNL     1      -2.179   2.485   1.477  1.00  0.00           H  
HETATM   14  H4  UNL     1      -2.272  -1.340  -0.267  1.00  0.00           H  
HETATM   15  H5  UNL     1      -0.355  -0.502  -1.660  1.00  0.00           H  
HETATM   16  H6  UNL     1       0.251  -2.317   0.213  1.00  0.00           H  
CONECT    1    2   11
CONECT    2    3    3   10
CONECT    3    4
CONECT    4    5    9   12
CONECT    5    6    6
CONECT    6    7   13
CONECT    7    8    8
CONECT    8    9   14
CONECT    9   10   15
CONECT   10   16
END