COMPND    HMDB0040590
HETATM    1  C1  UNL     1       4.407  -0.383   0.497  1.00  0.00           C  
HETATM    2  S1  UNL     1       3.248  -1.731   0.709  1.00  0.00           S  
HETATM    3  S2  UNL     1       1.321  -0.897   1.050  1.00  0.00           S  
HETATM    4  C2  UNL     1       0.531  -0.701  -0.568  1.00  0.00           C  
HETATM    5  C3  UNL     1      -0.827  -0.120  -0.409  1.00  0.00           C  
HETATM    6  C4  UNL     1      -1.919  -0.929  -0.244  1.00  0.00           C  
HETATM    7  C5  UNL     1      -3.170  -0.371  -0.098  1.00  0.00           C  
HETATM    8  C6  UNL     1      -3.317   0.998  -0.119  1.00  0.00           C  
HETATM    9  C7  UNL     1      -2.223   1.843  -0.285  1.00  0.00           C  
HETATM   10  C8  UNL     1      -0.991   1.241  -0.427  1.00  0.00           C  
HETATM   11  H1  UNL     1       4.259   0.213  -0.405  1.00  0.00           H  
HETATM   12  H2  UNL     1       5.446  -0.820   0.485  1.00  0.00           H  
HETATM   13  H3  UNL     1       4.366   0.267   1.411  1.00  0.00           H  
HETATM   14  H4  UNL     1       1.156  -0.121  -1.272  1.00  0.00           H  
HETATM   15  H5  UNL     1       0.384  -1.718  -1.002  1.00  0.00           H  
HETATM   16  H6  UNL     1      -1.813  -2.022  -0.226  1.00  0.00           H  
HETATM   17  H7  UNL     1      -4.052  -1.013   0.035  1.00  0.00           H  
HETATM   18  H8  UNL     1      -4.286   1.421  -0.006  1.00  0.00           H  
HETATM   19  H9  UNL     1      -2.373   2.916  -0.297  1.00  0.00           H  
HETATM   20  H10 UNL     1      -0.148   1.926  -0.556  1.00  0.00           H  
CONECT    1    2   11   12   13
CONECT    2    3
CONECT    3    4
CONECT    4    5   14   15
CONECT    5    6    6   10
CONECT    6    7   16
CONECT    7    8    8   17
CONECT    8    9   18
CONECT    9   10   10   19
CONECT   10   20
END