COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.873  -4.938   1.590  1.00  0.00           C  
HETATM    2  C   UNL     1       3.252  -3.784   3.038  1.00  0.00           C  
HETATM    3  C   UNL     1       3.567  -4.353   1.804  1.00  0.00           C  
HETATM    4  C   UNL     1       2.623  -4.358   0.777  1.00  0.00           C  
HETATM    5  C   UNL     1       1.364  -3.794   0.983  1.00  0.00           C  
HETATM    6  C   UNL     1       1.993  -3.220   3.245  1.00  0.00           C  
HETATM    7  C   UNL     1       1.069  -3.234   2.214  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.297  -2.622   2.438  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.060  -3.306   3.564  1.00  0.00           C  
HETATM   10  F   UNL     1      -1.249  -4.616   3.284  1.00  0.00           F  
HETATM   11  F   UNL     1      -0.374  -3.242   4.727  1.00  0.00           F  
HETATM   12  F   UNL     1      -2.274  -2.754   3.769  1.00  0.00           F  
HETATM   13  N   UNL     1       1.778   1.421   2.096  1.00  0.00           N  
HETATM   14  C   UNL     1       2.107   2.774   2.484  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.204  -1.181   2.670  1.00  0.00           N  
HETATM   16  C   UNL     1       0.422  -0.507   1.563  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.342  -0.714   0.249  1.00  0.00           C  
HETATM   18  C   UNL     1       0.296  -0.041  -0.984  1.00  0.00           C  
HETATM   19  C   UNL     1       1.723  -0.561  -1.174  1.00  0.00           C  
HETATM   20  C   UNL     1       0.313   1.484  -0.872  1.00  0.00           C  
HETATM   21  C   UNL     1       0.476   0.977   1.913  1.00  0.00           C  
HETATM   22  O   UNL     1      -0.530   1.668   2.056  1.00  0.00           O  
HETATM   23  C   UNL     1       5.567  -5.504   2.658  1.00  0.00           C  
HETATM   24  C   UNL     1       6.826  -6.068   2.452  1.00  0.00           C  
HETATM   25  C   UNL     1       7.391  -6.066   1.177  1.00  0.00           C  
HETATM   26  C   UNL     1       6.697  -5.499   0.108  1.00  0.00           C  
HETATM   27  C   UNL     1       5.438  -4.935   0.314  1.00  0.00           C  
HETATM   28  S   UNL     1       8.966  -6.773   0.918  1.00  0.00           S  
HETATM   29  N   UNL     1       9.978  -5.423   1.190  1.00  0.00           N  
HETATM   30  O   UNL     1       9.205  -7.758   1.963  1.00  0.00           O  
HETATM   31  O   UNL     1       9.074  -7.162  -0.481  1.00  0.00           O  
HETATM   32  C   UNL     1       2.173   2.934   3.993  1.00  0.00           C  
HETATM   33  N   UNL     1       2.479   4.284   4.383  1.00  0.00           N  
HETATM   34  H   UNL     1       3.976  -3.774   3.849  1.00  0.00           H  
HETATM   35  H   UNL     1       2.854  -4.797  -0.191  1.00  0.00           H  
HETATM   36  H   UNL     1       0.635  -3.803   0.178  1.00  0.00           H  
HETATM   37  H   UNL     1       1.756  -2.778   4.209  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.890  -2.723   1.521  1.00  0.00           H  
HETATM   39  H   UNL     1       2.548   0.772   1.965  1.00  0.00           H  
HETATM   40  H   UNL     1       1.332   3.425   2.067  1.00  0.00           H  
HETATM   41  H   UNL     1       3.063   3.028   2.014  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.150  -0.815   2.816  1.00  0.00           H  
HETATM   43  H   UNL     1       1.446  -0.889   1.493  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.365  -0.329   0.369  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.449  -1.790   0.056  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.277  -0.314  -1.879  1.00  0.00           H  
HETATM   47  H   UNL     1       2.180  -0.125  -2.069  1.00  0.00           H  
HETATM   48  H   UNL     1       1.728  -1.649  -1.296  1.00  0.00           H  
HETATM   49  H   UNL     1       2.355  -0.313  -0.315  1.00  0.00           H  
HETATM   50  H   UNL     1       0.819   1.809   0.044  1.00  0.00           H  
HETATM   51  H   UNL     1       0.839   1.929  -1.723  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.700   1.895  -0.868  1.00  0.00           H  
HETATM   53  H   UNL     1       5.140  -5.515   3.659  1.00  0.00           H  
HETATM   54  H   UNL     1       7.359  -6.506   3.292  1.00  0.00           H  
HETATM   55  H   UNL     1       7.127  -5.492  -0.890  1.00  0.00           H  
HETATM   56  H   UNL     1       4.909  -4.497  -0.529  1.00  0.00           H  
HETATM   57  H   UNL     1      10.540  -5.408   2.050  1.00  0.00           H  
HETATM   58  H   UNL     1      10.447  -5.001   0.380  1.00  0.00           H  
HETATM   59  H   UNL     1       2.938   2.285   4.431  1.00  0.00           H  
HETATM   60  H   UNL     1       1.206   2.683   4.440  1.00  0.00           H  
HETATM   61  H   UNL     1       3.078   4.442   5.179  1.00  0.00           H  
HETATM   62  H   UNL     1       1.941   5.042   3.995  1.00  0.00           H  
CONECT    1    3   23   23   27                                       
CONECT    2    6    6    3   34                                       
CONECT    3    1    2    4    4                                       
CONECT    4    3    3    5   35                                       
CONECT    5    4    7    7   36                                       
CONECT    6    2    2    7   37                                       
CONECT    7    5    5    6    8                                       
CONECT    8    7    9   15   38                                       
CONECT    9    8   10   12   11                                       
CONECT   10    9                                                      
CONECT   11    9                                                      
CONECT   12    9                                                      
CONECT   13   14   21   39                                            
CONECT   14   13   32   40   41                                       
CONECT   15    8   16   42                                            
CONECT   16   15   21   17   43                                       
CONECT   17   16   18   44   45                                       
CONECT   18   17   19   20   46                                       
CONECT   19   18   47   48   49                                       
CONECT   20   18   50   51   52                                       
CONECT   21   13   16   22   22                                       
CONECT   22   21   21                                                 
CONECT   23    1    1   24   53                                       
CONECT   24   23   25   25   54                                       
CONECT   25   24   24   26   28                                       
CONECT   26   25   27   27   55                                       
CONECT   27    1   26   26   56                                       
CONECT   28   25   31   31   30                                       
CONECT   28   30   29                                                 
CONECT   29   28   57   58                                            
CONECT   30   28   28                                                 
CONECT   31   28   28                                                 
CONECT   32   14   33   59   60                                       
CONECT   33   32   61   62                                            
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   32                                                      
CONECT   60   32                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
