COMPND    HMDB0031871
HETATM    1  C1  UNL     1      -2.727   0.659   0.368  1.00  0.00           C  
HETATM    2  C2  UNL     1      -2.000   0.084  -0.840  1.00  0.00           C  
HETATM    3  C3  UNL     1      -0.731  -0.547  -0.321  1.00  0.00           C  
HETATM    4  S1  UNL     1       0.257  -1.284  -1.650  1.00  0.00           S  
HETATM    5  S2  UNL     1       1.986  -2.113  -0.729  1.00  0.00           S  
HETATM    6  S3  UNL     1       3.491  -0.653  -0.695  1.00  0.00           S  
HETATM    7  C4  UNL     1       3.473   0.366   0.788  1.00  0.00           C  
HETATM    8  H1  UNL     1      -3.352   1.521   0.116  1.00  0.00           H  
HETATM    9  H2  UNL     1      -1.955   1.024   1.089  1.00  0.00           H  
HETATM   10  H3  UNL     1      -3.308  -0.105   0.905  1.00  0.00           H  
HETATM   11  H4  UNL     1      -1.777   0.949  -1.498  1.00  0.00           H  
HETATM   12  H5  UNL     1      -2.637  -0.615  -1.397  1.00  0.00           H  
HETATM   13  H6  UNL     1      -0.980  -1.360   0.392  1.00  0.00           H  
HETATM   14  H7  UNL     1      -0.164   0.249   0.209  1.00  0.00           H  
HETATM   15  H8  UNL     1       2.543   0.237   1.382  1.00  0.00           H  
HETATM   16  H9  UNL     1       3.575   1.452   0.519  1.00  0.00           H  
HETATM   17  H10 UNL     1       4.310   0.135   1.486  1.00  0.00           H  
CONECT    1    2    8    9   10
CONECT    2    3   11   12
CONECT    3    4   13   14
CONECT    4    5
CONECT    5    6
CONECT    6    7
CONECT    7   15   16   17
END