COMPND    HMDB0259009
HETATM    1  C1  UNL     1      -1.224   1.379   0.579  1.00  0.00           C  
HETATM    2  N1  UNL     1      -0.522   0.114   0.605  1.00  0.00           N  
HETATM    3  C2  UNL     1      -1.578  -0.901   0.636  1.00  0.00           C  
HETATM    4  C3  UNL     1       0.257  -0.014  -0.612  1.00  0.00           C  
HETATM    5  C4  UNL     1       1.308   1.029  -0.745  1.00  0.00           C  
HETATM    6  S1  UNL     1       2.350   1.235   0.708  1.00  0.00           S  
HETATM    7  S2  UNL     1       2.822  -0.630   1.600  1.00  0.00           S  
HETATM    8  S3  UNL     1       1.430  -2.058   0.826  1.00  0.00           S  
HETATM    9  C5  UNL     1       0.853  -1.382  -0.766  1.00  0.00           C  
HETATM   10  H1  UNL     1      -0.554   2.252   0.594  1.00  0.00           H  
HETATM   11  H2  UNL     1      -1.809   1.432   1.527  1.00  0.00           H  
HETATM   12  H3  UNL     1      -1.962   1.413  -0.253  1.00  0.00           H  
HETATM   13  H4  UNL     1      -1.227  -1.894   0.926  1.00  0.00           H  
HETATM   14  H5  UNL     1      -2.135  -0.851  -0.318  1.00  0.00           H  
HETATM   15  H6  UNL     1      -2.301  -0.562   1.429  1.00  0.00           H  
HETATM   16  H7  UNL     1      -0.466   0.121  -1.450  1.00  0.00           H  
HETATM   17  H8  UNL     1       0.826   1.971  -1.044  1.00  0.00           H  
HETATM   18  H9  UNL     1       1.992   0.722  -1.572  1.00  0.00           H  
HETATM   19  H10 UNL     1       1.758  -1.276  -1.395  1.00  0.00           H  
HETATM   20  H11 UNL     1       0.182  -2.100  -1.274  1.00  0.00           H  
CONECT    1    2   10   11   12
CONECT    2    3    4
CONECT    3   13   14   15
CONECT    4    5    9   16
CONECT    5    6   17   18
CONECT    6    7
CONECT    7    8
CONECT    8    9
CONECT    9   19   20
END