COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.893  -1.174  -0.094  1.00  0.00           C  
HETATM    2  O   UNL     1       5.066   0.851   0.791  1.00  0.00           O  
HETATM    3  C   UNL     1       4.804  -0.176   0.202  1.00  0.00           C  
HETATM    4  C   UNL     1       1.259   0.254  -0.303  1.00  0.00           C  
HETATM    5  C   UNL     1       0.169   1.252  -0.007  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.162   0.731  -0.553  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.252   1.800  -0.365  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.611   1.098  -0.622  1.00  0.00           C  
HETATM    9  O   UNL     1      -3.911  -1.550  -0.566  1.00  0.00           O  
HETATM   10  S   UNL     1      -3.405  -0.502   0.248  1.00  0.00           S  
HETATM   11  O   UNL     1      -3.853  -0.369   1.590  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.576  -0.539   0.218  1.00  0.00           C  
HETATM   13  O   UNL     1       0.997  -0.773  -0.892  1.00  0.00           O  
HETATM   14  N   UNL     1       2.525   0.503   0.087  1.00  0.00           N  
HETATM   15  N   UNL     1       3.538  -0.425  -0.188  1.00  0.00           N  
HETATM   16  H   UNL     1       6.841  -0.802   0.295  1.00  0.00           H  
HETATM   17  H   UNL     1       5.654  -2.125   0.382  1.00  0.00           H  
HETATM   18  H   UNL     1       5.973  -1.316  -1.171  1.00  0.00           H  
HETATM   19  H   UNL     1       0.089   1.394   1.071  1.00  0.00           H  
HETATM   20  H   UNL     1       0.409   2.203  -0.482  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.057   0.496  -1.612  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.221   2.190   0.652  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.109   2.609  -1.080  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.431   1.671  -0.190  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.770   0.943  -1.690  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.224  -1.429  -0.303  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.180  -0.512   1.233  1.00  0.00           H  
HETATM   28  H   UNL     1       2.734   1.324   0.558  1.00  0.00           H  
HETATM   29  H   UNL     1       3.328  -1.246  -0.659  1.00  0.00           H  
CONECT    1    3   16   17   18                                       
CONECT    2    3    3                                                 
CONECT    3    2    2    1   15                                       
CONECT    4   14   13   13    5                                       
CONECT    5    4    6   19   20                                       
CONECT    6    5    7   12   21                                       
CONECT    7    6    8   22   23                                       
CONECT    8    7   10   24   25                                       
CONECT    9   10   10                                                 
CONECT   10   11   11   12    8                                       
CONECT   10    9    9                                                 
CONECT   11   10   10                                                 
CONECT   12    6   10   26   27                                       
CONECT   13    4    4                                                 
CONECT   14   15    4   28                                            
CONECT   15    3   14   29                                            
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    5                                                      
CONECT   20    5                                                      
CONECT   21    6                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25    8                                                      
CONECT   26   12                                                      
CONECT   27   12                                                      
CONECT   28   14                                                      
CONECT   29   15                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
