COMPND    HMDB0251475
HETATM    1  C1  UNL     1       3.446  -0.346  -0.177  1.00  0.00           C  
HETATM    2  C2  UNL     1       2.633   0.661  -0.388  1.00  0.00           C  
HETATM    3  C3  UNL     1       1.260   0.212  -0.187  1.00  0.00           C  
HETATM    4  C4  UNL     1       0.213   0.969  -0.318  1.00  0.00           C  
HETATM    5  C5  UNL     1      -1.163   0.478  -0.107  1.00  0.00           C  
HETATM    6  C6  UNL     1      -1.662  -0.764  -0.435  1.00  0.00           C  
HETATM    7  C7  UNL     1      -2.991  -0.783  -0.058  1.00  0.00           C  
HETATM    8  C8  UNL     1      -3.304   0.438   0.497  1.00  0.00           C  
HETATM    9  N1  UNL     1      -2.177   1.159   0.446  1.00  0.00           N  
HETATM   10  N2  UNL     1       1.380  -1.164   0.162  1.00  0.00           N  
HETATM   11  C9  UNL     1       2.624  -1.488   0.169  1.00  0.00           C  
HETATM   12  H1  UNL     1       4.535  -0.321  -0.251  1.00  0.00           H  
HETATM   13  H2  UNL     1       2.953   1.670  -0.669  1.00  0.00           H  
HETATM   14  H3  UNL     1       0.328   2.002  -0.592  1.00  0.00           H  
HETATM   15  H4  UNL     1      -1.092  -1.569  -0.907  1.00  0.00           H  
HETATM   16  H5  UNL     1      -3.693  -1.620  -0.173  1.00  0.00           H  
HETATM   17  H6  UNL     1      -4.265   0.781   0.906  1.00  0.00           H  
HETATM   18  H7  UNL     1      -2.084   2.156   0.798  1.00  0.00           H  
HETATM   19  H8  UNL     1       3.059  -2.471   0.397  1.00  0.00           H  
CONECT    1    2    2   11   12
CONECT    2    3   13
CONECT    3    4    4   10
CONECT    4    5   14
CONECT    5    6    6    9
CONECT    6    7   15
CONECT    7    8    8   16
CONECT    8    9   17
CONECT    9   18
CONECT   10   11   11
CONECT   11   19
END