COMPND    HMDB0240482
HETATM    1  O1  UNL     1       4.182  -2.229   1.230  1.00  0.00           O  
HETATM    2  C1  UNL     1       3.097  -1.763   0.785  1.00  0.00           C  
HETATM    3  C2  UNL     1       2.122  -2.599   0.286  1.00  0.00           C  
HETATM    4  C3  UNL     1       0.969  -2.003  -0.178  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.786  -0.635  -0.152  1.00  0.00           C  
HETATM    6  C5  UNL     1      -0.349   0.003  -0.606  1.00  0.00           C  
HETATM    7  O2  UNL     1      -1.383  -0.741  -1.123  1.00  0.00           O  
HETATM    8  S1  UNL     1      -2.666  -1.355  -0.188  1.00  0.00           S  
HETATM    9  O3  UNL     1      -3.975  -0.718  -0.570  1.00  0.00           O  
HETATM   10  O4  UNL     1      -2.786  -2.830  -0.442  1.00  0.00           O  
HETATM   11  O5  UNL     1      -2.381  -1.125   1.463  1.00  0.00           O  
HETATM   12  C6  UNL     1      -0.483   1.383  -0.557  1.00  0.00           C  
HETATM   13  C7  UNL     1      -1.453   2.296  -0.916  1.00  0.00           C  
HETATM   14  C8  UNL     1      -0.992   3.560  -0.612  1.00  0.00           C  
HETATM   15  O6  UNL     1       0.195   3.405  -0.097  1.00  0.00           O  
HETATM   16  C9  UNL     1       0.546   2.145  -0.040  1.00  0.00           C  
HETATM   17  C10 UNL     1       1.691   1.491   0.416  1.00  0.00           C  
HETATM   18  C11 UNL     1       1.818   0.122   0.365  1.00  0.00           C  
HETATM   19  O7  UNL     1       2.930  -0.466   0.813  1.00  0.00           O  
HETATM   20  H1  UNL     1       2.257  -3.667   0.262  1.00  0.00           H  
HETATM   21  H2  UNL     1       0.183  -2.606  -0.575  1.00  0.00           H  
HETATM   22  H3  UNL     1      -2.806  -0.295   1.777  1.00  0.00           H  
HETATM   23  H4  UNL     1      -2.411   2.059  -1.360  1.00  0.00           H  
HETATM   24  H5  UNL     1      -1.563   4.460  -0.795  1.00  0.00           H  
HETATM   25  H6  UNL     1       2.473   2.108   0.812  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   19
CONECT    3    4    4   20
CONECT    4    5   21
CONECT    5    6    6   18
CONECT    6    7   12
CONECT    7    8
CONECT    8    9    9   10   10
CONECT    8   11
CONECT   11   22
CONECT   12   13   16   16
CONECT   13   14   14   23
CONECT   14   15   24
CONECT   15   16
CONECT   16   17
CONECT   17   18   18   25
CONECT   18   19
END