COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.757   3.585  -1.145  1.00  0.00           C  
HETATM    2  C   UNL     1       5.495   3.506  -1.719  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.987  -2.921  -2.163  1.00  0.00           C  
HETATM    4  C   UNL     1       7.190   2.614  -0.267  1.00  0.00           C  
HETATM    5  C   UNL     1       0.180  -3.097  -1.442  1.00  0.00           C  
HETATM    6  C   UNL     1       4.650   2.460  -1.424  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.032  -2.198  -1.622  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.741  -1.829   0.369  1.00  0.00           C  
HETATM    9  C   UNL     1      -9.458   2.249   0.832  1.00  0.00           C  
HETATM   10  C   UNL     1       6.351   1.550   0.049  1.00  0.00           C  
HETATM   11  C   UNL     1       0.302  -2.552  -0.177  1.00  0.00           C  
HETATM   12  C   UNL     1       5.066   1.463  -0.537  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.914  -1.655  -0.351  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.714   1.157   0.162  1.00  0.00           C  
HETATM   15  C   UNL     1       6.762   0.486   0.980  1.00  0.00           C  
HETATM   16  C   UNL     1       4.653  -0.510   0.604  1.00  0.00           C  
HETATM   17  C   UNL     1       3.713  -1.618   0.903  1.00  0.00           C  
HETATM   18  C   UNL     1       1.575  -2.748   0.607  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.119  -0.805  -0.613  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.157   0.019   0.149  1.00  0.00           C  
HETATM   21  N   UNL     1      -8.951   1.553  -0.153  1.00  0.00           N  
HETATM   22  N   UNL     1      -7.421   1.604   1.361  1.00  0.00           N  
HETATM   23  N   UNL     1       4.270   0.423  -0.222  1.00  0.00           N  
HETATM   24  N   UNL     1      -8.542   2.319   1.812  1.00  0.00           N  
HETATM   25  N   UNL     1       5.874  -0.506   1.223  1.00  0.00           N  
HETATM   26  N   UNL     1       2.503  -1.653   0.312  1.00  0.00           N  
HETATM   27  O   UNL     1       7.858   0.498   1.510  1.00  0.00           O  
HETATM   28  O   UNL     1       4.035  -2.494   1.681  1.00  0.00           O  
HETATM   29  O   UNL     1      -2.941  -0.944   0.184  1.00  0.00           O  
HETATM   30  S   UNL     1      -6.652   0.196  -0.863  1.00  0.00           S  
HETATM   31  H   UNL     1       7.407   4.411  -1.392  1.00  0.00           H  
HETATM   32  H   UNL     1       5.172   4.276  -2.405  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.078  -3.344  -3.153  1.00  0.00           H  
HETATM   34  H   UNL     1       8.175   2.678   0.172  1.00  0.00           H  
HETATM   35  H   UNL     1       0.996  -3.662  -1.867  1.00  0.00           H  
HETATM   36  H   UNL     1       3.671   2.409  -1.876  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.941  -2.056  -2.188  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.646  -1.408   1.359  1.00  0.00           H  
HETATM   39  H   UNL     1     -10.442   2.693   0.853  1.00  0.00           H  
HETATM   40  H   UNL     1       1.347  -2.754   1.673  1.00  0.00           H  
HETATM   41  H   UNL     1       2.032  -3.697   0.327  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.527  -1.792  -0.833  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.868  -0.301  -1.546  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.408  -0.485   1.082  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.748   1.006   0.368  1.00  0.00           H  
HETATM   46  H   UNL     1       6.109  -1.225   1.830  1.00  0.00           H  
HETATM   47  H   UNL     1       2.246  -0.953  -0.309  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.637   2.772   2.665  1.00  0.00           H  
CONECT    1    2    2    4   31                                       
CONECT    2    1    1    6   32                                       
CONECT    3    5    7    7   33                                       
CONECT    4    1   10   10   34                                       
CONECT    5   11   11    3   35                                       
CONECT    6    2   12   12   36                                       
CONECT    7    3    3   13   37                                       
CONECT    8   11   13   13   38                                       
CONECT    9   24   21   21   39                                       
CONECT   10    4    4   12   15                                       
CONECT   11   18    5    5    8                                       
CONECT   12    6    6   10   23                                       
CONECT   13    8    8    7   29                                       
CONECT   14   30   22   22   21                                       
CONECT   15   10   27   27   25                                       
CONECT   16   23   23   25   17                                       
CONECT   17   16   26   28   28                                       
CONECT   18   26   11   40   41                                       
CONECT   19   29   20   42   43                                       
CONECT   20   19   30   44   45                                       
CONECT   21   14    9    9                                            
CONECT   22   14   14   24                                            
CONECT   23   12   16   16                                            
CONECT   24   22    9   48                                            
CONECT   25   15   16   46                                            
CONECT   26   17   18   47                                            
CONECT   27   15   15                                                 
CONECT   28   17   17                                                 
CONECT   29   13   19                                                 
CONECT   30   20   14                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   24                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
