COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.293   0.019   0.523  1.00  0.00           C  
HETATM    2  C   UNL     1       6.034   0.876   1.176  1.00  0.00           C  
HETATM    3  C   UNL     1       4.145   0.651  -0.278  1.00  0.00           C  
HETATM    4  C   UNL     1       4.941   0.021  -1.215  1.00  0.00           C  
HETATM    5  C   UNL     1       6.282  -0.193  -0.952  1.00  0.00           C  
HETATM    6  C   UNL     1       2.681   0.873  -0.560  1.00  0.00           C  
HETATM    7  C   UNL     1       0.572  -0.301  -0.225  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.136  -1.360   0.217  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.536  -1.334   0.173  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.210  -0.122   0.181  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.591  -0.098   0.138  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.305  -1.281   0.087  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.640  -2.494   0.079  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.256  -2.526   0.116  1.00  0.00           C  
HETATM   15  O   UNL     1      -5.749   1.176   0.645  1.00  0.00           O  
HETATM   16  C   UNL     1       6.829   0.240   0.242  1.00  0.00           C  
HETATM   17  C   UNL     1       4.691   1.079   0.918  1.00  0.00           C  
HETATM   18  N   UNL     1       1.912  -0.278  -0.079  1.00  0.00           N  
HETATM   19  O   UNL     1       0.002   0.633  -0.755  1.00  0.00           O  
HETATM   20  O   UNL     1      -1.600  -3.717   0.108  1.00  0.00           O  
HETATM   21  S   UNL     1      -4.445   1.443   0.148  1.00  0.00           S  
HETATM   22  O   UNL     1      -3.565   2.385   0.744  1.00  0.00           O  
HETATM   23  N   UNL     1      -4.633   1.910  -1.429  1.00  0.00           N  
HETATM   24  H   UNL     1       8.866   0.872   0.162  1.00  0.00           H  
HETATM   25  H   UNL     1       8.443  -0.092   1.597  1.00  0.00           H  
HETATM   26  H   UNL     1       8.628  -0.886   0.015  1.00  0.00           H  
HETATM   27  H   UNL     1       6.460   1.210   2.111  1.00  0.00           H  
HETATM   28  H   UNL     1       4.515  -0.313  -2.149  1.00  0.00           H  
HETATM   29  H   UNL     1       6.904  -0.685  -1.684  1.00  0.00           H  
HETATM   30  H   UNL     1       2.345   1.774  -0.047  1.00  0.00           H  
HETATM   31  H   UNL     1       2.531   0.988  -1.633  1.00  0.00           H  
HETATM   32  H   UNL     1       0.324  -2.139   0.565  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.655   0.804   0.221  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.384  -1.259   0.054  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.200  -3.417   0.039  1.00  0.00           H  
HETATM   36  H   UNL     1       4.069   1.572   1.650  1.00  0.00           H  
HETATM   37  H   UNL     1       2.367  -1.023   0.344  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.387  -4.043  -0.777  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.291   1.351  -2.145  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.085   2.743  -1.638  1.00  0.00           H  
CONECT    1   16   24   25   26                                       
CONECT    2   16   17   17   27                                       
CONECT    3    4    4   17    6                                       
CONECT    4    5    3    3   28                                       
CONECT    5   16   16    4   29                                       
CONECT    6    3   18   30   31                                       
CONECT    7   19   19    8   18                                       
CONECT    8    7    9   32                                            
CONECT    9   14    8   10   10                                       
CONECT   10    9    9   11   33                                       
CONECT   11   12   12   10   21                                       
CONECT   12   13   11   11   34                                       
CONECT   13   14   14   12   35                                       
CONECT   14   20   13   13    9                                       
CONECT   15   21   21                                                 
CONECT   16    1    5    5    2                                       
CONECT   17    2    2    3   36                                       
CONECT   18    7    6   37                                            
CONECT   19    7    7                                                 
CONECT   20   14   38                                                 
CONECT   21   11   23   15   15                                       
CONECT   21   22   22                                                 
CONECT   22   21   21                                                 
CONECT   23   21   39   40                                            
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    8                                                      
CONECT   33   10                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   20                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
