COMPND    HMDB0031370
HETATM    1  C1  UNL     1      -2.206  -1.096  -0.129  1.00  0.00           C  
HETATM    2  C2  UNL     1      -0.979  -0.460  -0.612  1.00  0.00           C  
HETATM    3  C3  UNL     1      -0.436   0.616  -0.042  1.00  0.00           C  
HETATM    4  C4  UNL     1      -1.081   1.195   1.112  1.00  0.00           C  
HETATM    5  O1  UNL     1      -2.126   0.708   1.579  1.00  0.00           O  
HETATM    6  C5  UNL     1       0.813   1.166  -0.629  1.00  0.00           C  
HETATM    7  S1  UNL     1       2.182   1.165   0.551  1.00  0.00           S  
HETATM    8  C6  UNL     1       2.641  -0.556   0.947  1.00  0.00           C  
HETATM    9  H1  UNL     1      -3.112  -0.460  -0.156  1.00  0.00           H  
HETATM   10  H2  UNL     1      -2.427  -1.984  -0.780  1.00  0.00           H  
HETATM   11  H3  UNL     1      -1.991  -1.506   0.886  1.00  0.00           H  
HETATM   12  H4  UNL     1      -0.489  -0.909  -1.498  1.00  0.00           H  
HETATM   13  H5  UNL     1      -0.666   2.065   1.591  1.00  0.00           H  
HETATM   14  H6  UNL     1       1.043   0.588  -1.539  1.00  0.00           H  
HETATM   15  H7  UNL     1       0.691   2.220  -0.963  1.00  0.00           H  
HETATM   16  H8  UNL     1       3.307  -1.001   0.185  1.00  0.00           H  
HETATM   17  H9  UNL     1       1.677  -1.134   0.983  1.00  0.00           H  
HETATM   18  H10 UNL     1       3.161  -0.617   1.933  1.00  0.00           H  
CONECT    1    2    9   10   11
CONECT    2    3    3   12
CONECT    3    4    6
CONECT    4    5    5   13
CONECT    6    7   14   15
CONECT    7    8
CONECT    8   16   17   18
END