COMPND    HMDB0059933
HETATM    1  C1  UNL     1      -3.111  -0.676   0.017  1.00  0.00           C  
HETATM    2  C2  UNL     1      -1.680  -0.291   0.092  1.00  0.00           C  
HETATM    3  C3  UNL     1      -0.852  -0.637  -0.954  1.00  0.00           C  
HETATM    4  C4  UNL     1       0.495  -0.329  -0.988  1.00  0.00           C  
HETATM    5  C5  UNL     1       1.034   0.360   0.081  1.00  0.00           C  
HETATM    6  S1  UNL     1       2.734   0.795   0.126  1.00  0.00           S  
HETATM    7  O1  UNL     1       3.176   0.946  -1.306  1.00  0.00           O  
HETATM    8  O2  UNL     1       2.869   2.101   0.845  1.00  0.00           O  
HETATM    9  O3  UNL     1       3.585  -0.430   0.850  1.00  0.00           O  
HETATM   10  C6  UNL     1       0.193   0.709   1.139  1.00  0.00           C  
HETATM   11  C7  UNL     1      -1.144   0.390   1.146  1.00  0.00           C  
HETATM   12  H1  UNL     1      -3.721   0.044  -0.547  1.00  0.00           H  
HETATM   13  H2  UNL     1      -3.183  -1.707  -0.404  1.00  0.00           H  
HETATM   14  H3  UNL     1      -3.487  -0.682   1.077  1.00  0.00           H  
HETATM   15  H4  UNL     1      -1.241  -1.176  -1.806  1.00  0.00           H  
HETATM   16  H5  UNL     1       1.104  -0.620  -1.827  1.00  0.00           H  
HETATM   17  H6  UNL     1       4.316  -0.725   0.257  1.00  0.00           H  
HETATM   18  H7  UNL     1       0.666   1.247   1.949  1.00  0.00           H  
HETATM   19  H8  UNL     1      -1.753   0.680   1.984  1.00  0.00           H  
CONECT    1    2   12   13   14
CONECT    2    3    3   11
CONECT    3    4   15
CONECT    4    5    5   16
CONECT    5    6   10
CONECT    6    7    7    8    8
CONECT    6    9
CONECT    9   17
CONECT   10   11   11   18
CONECT   11   19
END