COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.976  -1.039   0.762  1.00  0.00           N  
HETATM    2  C   UNL     1       2.527  -1.003   0.654  1.00  0.00           C  
HETATM    3  C   UNL     1       3.668  -1.206  -0.256  1.00  0.00           C  
HETATM    4  C   UNL     1       3.464  -1.761  -1.523  1.00  0.00           C  
HETATM    5  C   UNL     1       4.535  -1.948  -2.370  1.00  0.00           C  
HETATM    6  C   UNL     1       5.814  -1.587  -1.967  1.00  0.00           C  
HETATM    7  C   UNL     1       4.956  -0.839   0.143  1.00  0.00           C  
HETATM    8  C   UNL     1       2.459   2.003  -0.544  1.00  0.00           C  
HETATM    9  C   UNL     1       3.471   4.062   0.150  1.00  0.00           C  
HETATM   10  C   UNL     1       3.089   2.334   1.767  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.067  -2.618  -1.105  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.558  -2.444  -1.284  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.467  -4.041  -1.498  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.768   0.058  -0.428  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.554   2.359  -1.064  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.290   2.402  -0.495  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.275  -0.645   1.049  1.00  0.00           C  
HETATM   18  C   UNL     1       2.036   0.181   1.097  1.00  0.00           C  
HETATM   19  C   UNL     1       2.536   1.528   0.768  1.00  0.00           C  
HETATM   20  C   UNL     1       2.927   3.263  -0.847  1.00  0.00           C  
HETATM   21  C   UNL     1       3.546   3.597   1.456  1.00  0.00           C  
HETATM   22  C   UNL     1       0.857  -0.167   2.010  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.438  -2.370   0.359  1.00  0.00           C  
HETATM   24  C   UNL     1       0.280  -1.997   0.540  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.505   0.101   0.147  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.290   1.184  -1.034  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.376   3.353  -2.226  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.767   1.277   0.112  1.00  0.00           C  
HETATM   29  C   UNL     1       1.648  -2.086   1.286  1.00  0.00           C  
HETATM   30  C   UNL     1       6.021  -1.035  -0.710  1.00  0.00           C  
HETATM   31  F   UNL     1      -3.742  -1.702  -1.918  1.00  0.00           F  
HETATM   32  O   UNL     1      -2.198   0.304   2.636  1.00  0.00           O  
HETATM   33  O   UNL     1       6.866  -1.774  -2.806  1.00  0.00           O  
HETATM   34  O   UNL     1       3.932   5.304  -0.154  1.00  0.00           O  
HETATM   35  O   UNL     1       1.313  -1.446   2.567  1.00  0.00           O  
HETATM   36  O   UNL     1      -5.069   3.468  -1.661  1.00  0.00           O  
HETATM   37  O   UNL     1      -1.838  -2.143   2.608  1.00  0.00           O  
HETATM   38  S   UNL     1      -1.831  -0.884   1.949  1.00  0.00           S  
HETATM   39  H   UNL     1       2.470  -2.043  -1.837  1.00  0.00           H  
HETATM   40  H   UNL     1       4.379  -2.377  -3.349  1.00  0.00           H  
HETATM   41  H   UNL     1       5.117  -0.405   1.119  1.00  0.00           H  
HETATM   42  H   UNL     1       2.036   1.382  -1.320  1.00  0.00           H  
HETATM   43  H   UNL     1       3.148   1.972   2.783  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.260  -1.457  -0.927  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.033  -3.210  -0.714  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.304  -2.539  -2.340  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.941  -4.754  -0.864  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.542  -4.165  -1.370  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.202  -4.218  -2.541  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.341  -0.858  -0.405  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.714   3.316  -0.527  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.407   0.056   0.224  1.00  0.00           H  
HETATM   53  H   UNL     1       2.871   3.629  -1.862  1.00  0.00           H  
HETATM   54  H   UNL     1       3.962   4.225   2.230  1.00  0.00           H  
HETATM   55  H   UNL     1       0.573   0.603   2.727  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.964  -3.124   0.987  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.520  -2.428   0.474  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.377  -2.819   0.826  1.00  0.00           H  
HETATM   59  H   UNL     1       0.428  -1.977  -0.539  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.270   1.149  -1.485  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.087   3.084  -1.445  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.666   4.306  -2.669  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.373   2.580  -2.995  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.784   1.312   0.558  1.00  0.00           H  
HETATM   65  H   UNL     1       2.085  -3.082   1.352  1.00  0.00           H  
HETATM   66  H   UNL     1       7.017  -0.756  -0.401  1.00  0.00           H  
HETATM   67  H   UNL     1       7.048  -1.020  -3.384  1.00  0.00           H  
HETATM   68  H   UNL     1       3.266   6.001  -0.076  1.00  0.00           H  
CONECT    1   38   23   25                                            
CONECT    2   29    3   18   18                                       
CONECT    3    4    2    7    7                                       
CONECT    4    5    5    3   39                                       
CONECT    5    4    4    6   40                                       
CONECT    6    5   33   30   30                                       
CONECT    7    3    3   30   41                                       
CONECT    8   19   19   20   42                                       
CONECT    9   20   20   21   34                                       
CONECT   10   19   21   21   43                                       
CONECT   11   13   23   12   31                                       
CONECT   12   11   44   45   46                                       
CONECT   13   11   47   48   49                                       
CONECT   14   25   25   26   50                                       
CONECT   15   26   26   16   36                                       
CONECT   16   28   28   15   51                                       
CONECT   17   24   38   22   52                                       
CONECT   18    2    2   22   19                                       
CONECT   19   18    8    8   10                                       
CONECT   20    8    9    9   53                                       
CONECT   21   10   10    9   54                                       
CONECT   22   35   17   18   55                                       
CONECT   23    1   11   56   57                                       
CONECT   24   29   17   58   59                                       
CONECT   25    1   14   14   28                                       
CONECT   26   14   15   15   60                                       
CONECT   27   36   61   62   63                                       
CONECT   28   25   16   16   64                                       
CONECT   29   24   35    2   65                                       
CONECT   30    6    6    7   66                                       
CONECT   31   11                                                      
CONECT   32   38   38                                                 
CONECT   33    6   67                                                 
CONECT   34    9   68                                                 
CONECT   35   29   22                                                 
CONECT   36   15   27                                                 
CONECT   37   38   38                                                 
CONECT   38   37   37   17   32                                       
CONECT   38   32    1                                                 
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43   10                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   29                                                      
CONECT   66   30                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
