COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.830   2.424   0.282  1.00  0.00           C  
HETATM    2  C   UNL     1       2.594  -3.680   0.059  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.725   1.895  -0.856  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.282  -0.566  -1.309  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.018  -1.939   0.531  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.160  -1.359  -1.444  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.891  -2.722   0.391  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.667   1.601   0.133  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.422   0.002  -0.162  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.218  -0.850  -0.316  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.965  -2.435  -0.596  1.00  0.00           C  
HETATM   12  C   UNL     1       2.357  -0.524   0.446  1.00  0.00           C  
HETATM   13  C   UNL     1       4.102   0.734  -0.822  1.00  0.00           C  
HETATM   14  C   UNL     1       4.828   2.043  -0.416  1.00  0.00           C  
HETATM   15  C   UNL     1       7.248   3.458   0.038  1.00  0.00           C  
HETATM   16  C   UNL     1       0.261  -3.297  -0.749  1.00  0.00           C  
HETATM   17  C   UNL     1       1.391  -2.737   0.117  1.00  0.00           C  
HETATM   18  N   UNL     1      -8.752   3.077   0.400  1.00  0.00           N  
HETATM   19  N   UNL     1       2.958   1.760   1.060  1.00  0.00           N  
HETATM   20  N   UNL     1       1.781  -1.416  -0.384  1.00  0.00           N  
HETATM   21  C   UNL     1      -6.475   0.504   0.977  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.610   1.100  -1.001  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.357  -0.286   0.833  1.00  0.00           C  
HETATM   24  C   UNL     1       4.365   2.215   1.052  1.00  0.00           C  
HETATM   25  C   UNL     1       2.758   0.834  -0.070  1.00  0.00           C  
HETATM   26  N   UNL     1       3.719  -3.084   0.792  1.00  0.00           N  
HETATM   27  O   UNL     1       2.552  -0.814   1.607  1.00  0.00           O  
HETATM   28  S   UNL     1       6.629   1.843  -0.510  1.00  0.00           S  
HETATM   29  H   UNL     1       2.329  -4.635   0.513  1.00  0.00           H  
HETATM   30  H   UNL     1       2.882  -3.839  -0.980  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.873   2.742  -1.509  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.431   0.276  -1.968  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.740  -2.164   1.302  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.434  -1.139  -2.212  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.730  -3.560   1.052  1.00  0.00           H  
HETATM   36  H   UNL     1       3.938   0.703  -1.900  1.00  0.00           H  
HETATM   37  H   UNL     1       4.663  -0.140  -0.493  1.00  0.00           H  
HETATM   38  H   UNL     1       4.497   2.881  -1.030  1.00  0.00           H  
HETATM   39  H   UNL     1       8.338   3.454   0.021  1.00  0.00           H  
HETATM   40  H   UNL     1       6.877   4.235  -0.631  1.00  0.00           H  
HETATM   41  H   UNL     1       6.901   3.655   1.052  1.00  0.00           H  
HETATM   42  H   UNL     1       0.032  -4.315  -0.433  1.00  0.00           H  
HETATM   43  H   UNL     1       0.573  -3.303  -1.794  1.00  0.00           H  
HETATM   44  H   UNL     1       1.048  -2.647   1.148  1.00  0.00           H  
HETATM   45  H   UNL     1       2.726   1.317   1.936  1.00  0.00           H  
HETATM   46  H   UNL     1       1.625  -1.184  -1.313  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.202   0.276   1.742  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.882   1.326  -1.766  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.209  -1.137   1.482  1.00  0.00           H  
HETATM   50  H   UNL     1       4.968   1.595   1.716  1.00  0.00           H  
HETATM   51  H   UNL     1       4.427   3.262   1.349  1.00  0.00           H  
HETATM   52  H   UNL     1       1.988   1.223  -0.736  1.00  0.00           H  
HETATM   53  H   UNL     1       3.457  -2.867   1.742  1.00  0.00           H  
HETATM   54  H   UNL     1       4.527  -3.689   0.769  1.00  0.00           H  
CONECT    1    8   18   18   18                                       
CONECT    2   17   26   29   30                                       
CONECT    3   22   22    8   31                                       
CONECT    4    6    6   10   32                                       
CONECT    5   10   10    7   33                                       
CONECT    6    4    4   11   34                                       
CONECT    7   11   11    5   35                                       
CONECT    8    3    1   21   21                                       
CONECT    9   22   10   23   23                                       
CONECT   10    4    9    5    5                                       
CONECT   11    6   16    7    7                                       
CONECT   12   25   20   27   27                                       
CONECT   13   14   25   36   37                                       
CONECT   14   28   24   13   38                                       
CONECT   15   28   39   40   41                                       
CONECT   16   17   11   42   43                                       
CONECT   17   20    2   16   44                                       
CONECT   18    1    1    1                                            
CONECT   19   24   25   45                                            
CONECT   20   12   17   46                                            
CONECT   21    8    8   23   47                                       
CONECT   22    3    3    9   48                                       
CONECT   23    9    9   21   49                                       
CONECT   24   14   19   50   51                                       
CONECT   25   13   19   12   52                                       
CONECT   26    2   53   54                                            
CONECT   27   12   12                                                 
CONECT   28   15   14                                                 
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
