COMPND    HMDB0304081
HETATM    1  O1  UNL     1       4.127  -0.480  -0.275  1.00  0.00           O  
HETATM    2  C1  UNL     1       3.542   0.226   0.602  1.00  0.00           C  
HETATM    3  O2  UNL     1       4.363   0.947   1.451  1.00  0.00           O1-
HETATM    4  C2  UNL     1       2.094   0.268   0.701  1.00  0.00           C  
HETATM    5  O3  UNL     1       1.595   0.993   1.598  1.00  0.00           O  
HETATM    6  C3  UNL     1       1.199  -0.495  -0.196  1.00  0.00           C  
HETATM    7  C4  UNL     1      -0.233  -0.269   0.125  1.00  0.00           C  
HETATM    8  C5  UNL     1      -0.888   0.757  -0.497  1.00  0.00           C  
HETATM    9  C6  UNL     1      -2.238   1.039  -0.251  1.00  0.00           C  
HETATM   10  C7  UNL     1      -2.902   0.240   0.649  1.00  0.00           C  
HETATM   11  C8  UNL     1      -2.257  -0.799   1.284  1.00  0.00           C  
HETATM   12  C9  UNL     1      -0.929  -1.051   1.023  1.00  0.00           C  
HETATM   13  H1  UNL     1       1.445  -0.180  -1.238  1.00  0.00           H  
HETATM   14  H2  UNL     1       1.412  -1.593  -0.133  1.00  0.00           H  
HETATM   15  H3  UNL     1      -0.393   1.402  -1.210  1.00  0.00           H  
HETATM   16  H4  UNL     1      -2.748   1.854  -0.748  1.00  0.00           H  
HETATM   17  H5  UNL     1      -3.955   0.438   0.859  1.00  0.00           H  
HETATM   18  H6  UNL     1      -2.817  -1.417   1.998  1.00  0.00           H  
HETATM   19  H7  UNL     1      -0.418  -1.881   1.532  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    4    5    5    6
CONECT    6    7   13   14
CONECT    7    8    8   12
CONECT    8    9   15
CONECT    9   10   10   16
CONECT   10   11   17
CONECT   11   12   12   18
CONECT   12   19
END