COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -1.369   1.449   0.036  1.00  0.00           C  
HETATM    2  C   UNL     1       4.609  -0.907   0.107  1.00  0.00           C  
HETATM    3  C   UNL     1       3.741  -1.861  -0.416  1.00  0.00           C  
HETATM    4  C   UNL     1       0.477  -0.014  -0.308  1.00  0.00           C  
HETATM    5  C   UNL     1       2.401  -1.575  -0.551  1.00  0.00           C  
HETATM    6  C   UNL     1       1.913  -0.324  -0.163  1.00  0.00           C  
HETATM    7  C   UNL     1       2.787   0.632   0.362  1.00  0.00           C  
HETATM    8  C   UNL     1       4.125   0.339   0.495  1.00  0.00           C  
HETATM    9  C   UNL     1       8.340  -0.521   0.356  1.00  0.00           C  
HETATM   10  C   UNL     1       6.885  -0.232   0.088  1.00  0.00           C  
HETATM   11  O   UNL     1       6.544   0.875  -0.273  1.00  0.00           O  
HETATM   12  N   UNL     1       5.964  -1.202   0.248  1.00  0.00           N  
HETATM   13  O   UNL     1      -0.282  -0.847  -0.765  1.00  0.00           O  
HETATM   14  N   UNL     1       0.008   1.192   0.067  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.270   0.399   0.078  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.641   0.659   0.046  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.099   1.975  -0.027  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.197   3.019  -0.069  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.834   2.764  -0.032  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.923   3.825  -0.075  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.608  -0.459   0.090  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.949  -0.330   0.066  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.644  -1.521   0.117  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.884  -2.618   0.183  1.00  0.00           C  
HETATM   25  S   UNL     1      -4.185  -2.164   0.175  1.00  0.00           S  
HETATM   26  H   UNL     1       4.120  -2.827  -0.716  1.00  0.00           H  
HETATM   27  H   UNL     1       1.729  -2.316  -0.958  1.00  0.00           H  
HETATM   28  H   UNL     1       2.412   1.599   0.664  1.00  0.00           H  
HETATM   29  H   UNL     1       4.801   1.077   0.901  1.00  0.00           H  
HETATM   30  H   UNL     1       8.815  -0.872  -0.560  1.00  0.00           H  
HETATM   31  H   UNL     1       8.835   0.388   0.697  1.00  0.00           H  
HETATM   32  H   UNL     1       8.421  -1.290   1.125  1.00  0.00           H  
HETATM   33  H   UNL     1       6.244  -2.106   0.462  1.00  0.00           H  
HETATM   34  H   UNL     1       0.623   1.883   0.359  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.913  -0.618   0.134  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.160   2.177  -0.051  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.553   4.037  -0.126  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.245   4.738  -0.131  1.00  0.00           H  
HETATM   39  H   UNL     1       0.030   3.647  -0.050  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.441   0.630   0.012  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.723  -1.564   0.105  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.256  -3.630   0.229  1.00  0.00           H  
CONECT    1   19   14   15   15                                       
CONECT    2    8   12    3    3                                       
CONECT    3    2    2    5   26                                       
CONECT    4   13   13    6   14                                       
CONECT    5    6    6    3   27                                       
CONECT    6    7    4    5    5                                       
CONECT    7    8    8    6   28                                       
CONECT    8    7    7    2   29                                       
CONECT    9   10   30   31   32                                       
CONECT   10   11   11    9   12                                       
CONECT   11   10   10                                                 
CONECT   12   10    2   33                                            
CONECT   13    4    4                                                 
CONECT   14    4    1   34                                            
CONECT   15    1    1   16   35                                       
CONECT   16   17   17   15   21                                       
CONECT   17   18   16   16   36                                       
CONECT   18   19   19   17   37                                       
CONECT   19   20   18   18    1                                       
CONECT   20   19   38   39                                            
CONECT   21   16   22   22   25                                       
CONECT   22   21   21   23   40                                       
CONECT   23   22   24   24   41                                       
CONECT   24   25   23   23   42                                       
CONECT   25   21   24                                                 
CONECT   26    3                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   12                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
