COMPND    HMDB0302545
HETATM    1  C1  UNL     1       4.444   0.090   0.070  1.00  0.00           C  
HETATM    2  C2  UNL     1       2.945   0.069   0.085  1.00  0.00           C  
HETATM    3  C3  UNL     1       2.223  -0.818   0.848  1.00  0.00           C  
HETATM    4  C4  UNL     1       0.843  -0.821   0.849  1.00  0.00           C  
HETATM    5  C5  UNL     1       0.165   0.098   0.057  1.00  0.00           C  
HETATM    6  C6  UNL     1      -1.278   0.080   0.069  1.00  0.00           C  
HETATM    7  C7  UNL     1      -2.005   1.257  -0.124  1.00  0.00           C  
HETATM    8  C8  UNL     1      -3.383   1.224  -0.110  1.00  0.00           C  
HETATM    9  C9  UNL     1      -4.036   0.011   0.097  1.00  0.00           C  
HETATM   10  C10 UNL     1      -3.337  -1.159   0.289  1.00  0.00           C  
HETATM   11  C11 UNL     1      -1.960  -1.119   0.274  1.00  0.00           C  
HETATM   12  C12 UNL     1       0.918   0.967  -0.691  1.00  0.00           C  
HETATM   13  N1  UNL     1       2.266   0.951  -0.676  1.00  0.00           N  
HETATM   14  H1  UNL     1       4.794   1.003   0.626  1.00  0.00           H  
HETATM   15  H2  UNL     1       4.847   0.132  -0.966  1.00  0.00           H  
HETATM   16  H3  UNL     1       4.841  -0.822   0.554  1.00  0.00           H  
HETATM   17  H4  UNL     1       2.795  -1.526   1.458  1.00  0.00           H  
HETATM   18  H5  UNL     1       0.316  -1.523   1.452  1.00  0.00           H  
HETATM   19  H6  UNL     1      -1.470   2.166  -0.280  1.00  0.00           H  
HETATM   20  H7  UNL     1      -3.902   2.154  -0.263  1.00  0.00           H  
HETATM   21  H8  UNL     1      -5.116   0.014   0.103  1.00  0.00           H  
HETATM   22  H9  UNL     1      -3.883  -2.075   0.446  1.00  0.00           H  
HETATM   23  H10 UNL     1      -1.430  -2.044   0.426  1.00  0.00           H  
HETATM   24  H11 UNL     1       0.403   1.693  -1.316  1.00  0.00           H  
CONECT    1    2   14   15   16
CONECT    2    3    3   13
CONECT    3    4   17
CONECT    4    5    5   18
CONECT    5    6   12
CONECT    6    7    7   11
CONECT    7    8   19
CONECT    8    9    9   20
CONECT    9   10   21
CONECT   10   11   11   22
CONECT   11   23
CONECT   12   13   13   24
END