COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.589  -2.664   0.090  1.00  0.00           C  
HETATM    2  C   UNL     1       1.136  -1.306  -0.591  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.679  -1.150  -0.257  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.148  -1.176   0.123  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.616   1.044   0.389  1.00  0.00           C  
HETATM    6  C   UNL     1      -9.247   0.655  -0.790  1.00  0.00           C  
HETATM    7  C   UNL     1     -10.527   1.097  -1.064  1.00  0.00           C  
HETATM    8  C   UNL     1     -10.559   2.314   1.005  1.00  0.00           C  
HETATM    9  C   UNL     1       8.642   1.762  -0.380  1.00  0.00           C  
HETATM   10  C   UNL     1       7.343   1.550   0.077  1.00  0.00           C  
HETATM   11  C   UNL     1       6.828   2.351   1.094  1.00  0.00           C  
HETATM   12  C   UNL     1       7.606   3.349   1.646  1.00  0.00           C  
HETATM   13  C   UNL     1       8.895   3.556   1.190  1.00  0.00           C  
HETATM   14  C   UNL     1       9.413   2.764   0.179  1.00  0.00           C  
HETATM   15  C   UNL     1       6.509   0.476  -0.519  1.00  0.00           C  
HETATM   16  C   UNL     1       5.228   0.150  -0.180  1.00  0.00           C  
HETATM   17  C   UNL     1       2.209  -3.325   0.139  1.00  0.00           C  
HETATM   18  C   UNL     1       3.587  -1.569  -0.981  1.00  0.00           C  
HETATM   19  C   UNL     1       2.474  -0.565  -0.668  1.00  0.00           C  
HETATM   20  C   UNL     1       2.187  -4.378   1.248  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.898  -0.294   0.092  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.464  -0.236  -0.090  1.00  0.00           C  
HETATM   23  F   UNL     1      10.675   2.967  -0.259  1.00  0.00           F  
HETATM   24  N   UNL     1       6.863  -0.367  -1.505  1.00  0.00           N  
HETATM   25  N   UNL     1       5.875  -1.152  -1.754  1.00  0.00           N  
HETATM   26  N   UNL     1       4.881  -0.882  -0.983  1.00  0.00           N  
HETATM   27  N   UNL     1      -5.295  -0.383   0.574  1.00  0.00           N  
HETATM   28  N   UNL     1      -5.359   0.291   1.668  1.00  0.00           N  
HETATM   29  N   UNL     1      -6.500   0.876   1.770  1.00  0.00           N  
HETATM   30  O   UNL     1       1.216  -2.332   0.404  1.00  0.00           O  
HETATM   31  O   UNL     1       3.886  -2.085   1.363  1.00  0.00           O  
HETATM   32  O   UNL     1       0.940  -5.076   1.217  1.00  0.00           O  
HETATM   33  O   UNL     1       2.415   0.421  -1.700  1.00  0.00           O  
HETATM   34  O   UNL     1      -3.061   0.728  -0.893  1.00  0.00           O  
HETATM   35  S   UNL     1      -0.178  -0.136  -0.149  1.00  0.00           S  
HETATM   36  C   UNL     1      -7.238   0.577   0.686  1.00  0.00           C  
HETATM   37  C   UNL     1     -11.182   1.926  -0.167  1.00  0.00           C  
HETATM   38  C   UNL     1      -9.280   1.877   1.287  1.00  0.00           C  
HETATM   39  F   UNL     1     -11.141   0.722  -2.207  1.00  0.00           F  
HETATM   40  H   UNL     1       4.343  -3.412  -0.154  1.00  0.00           H  
HETATM   41  H   UNL     1       0.913  -1.755  -1.559  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.607  -1.982   0.443  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.785  -1.536  -1.271  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.345  -1.563  -0.876  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.990  -2.007   0.810  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.736   0.010  -1.490  1.00  0.00           H  
HETATM   47  H   UNL     1     -11.073   2.960   1.700  1.00  0.00           H  
HETATM   48  H   UNL     1       9.047   1.141  -1.165  1.00  0.00           H  
HETATM   49  H   UNL     1       5.821   2.191   1.451  1.00  0.00           H  
HETATM   50  H   UNL     1       7.207   3.970   2.434  1.00  0.00           H  
HETATM   51  H   UNL     1       9.500   4.338   1.624  1.00  0.00           H  
HETATM   52  H   UNL     1       4.616   0.619   0.575  1.00  0.00           H  
HETATM   53  H   UNL     1       2.001  -3.800  -0.820  1.00  0.00           H  
HETATM   54  H   UNL     1       3.410  -2.017  -1.959  1.00  0.00           H  
HETATM   55  H   UNL     1       2.678  -0.082   0.288  1.00  0.00           H  
HETATM   56  H   UNL     1       3.002  -5.085   1.094  1.00  0.00           H  
HETATM   57  H   UNL     1       2.307  -3.891   2.215  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.753   0.164   1.071  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.729  -0.670  -1.043  1.00  0.00           H  
HETATM   60  H   UNL     1       3.903  -2.722   2.090  1.00  0.00           H  
HETATM   61  H   UNL     1       0.855  -5.760   1.894  1.00  0.00           H  
HETATM   62  H   UNL     1       1.727   1.088  -1.568  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.196   0.393  -1.789  1.00  0.00           H  
HETATM   64  H   UNL     1     -12.182   2.270  -0.384  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.795   2.180   2.203  1.00  0.00           H  
CONECT    1   18   17   31   40                                       
CONECT    2   19   35   30   41                                       
CONECT    3   35   21   42   43                                       
CONECT    4   21   27   44   45                                       
CONECT    5   36   38   38    6                                       
CONECT    6    5    7    7   46                                       
CONECT    7    6    6   37   39                                       
CONECT    8   38   37   37   47                                       
CONECT    9   10   14   14   48                                       
CONECT   10   15   11   11    9                                       
CONECT   11   10   10   12   49                                       
CONECT   12   11   13   13   50                                       
CONECT   13   12   12   14   51                                       
CONECT   14    9    9   13   23                                       
CONECT   15   24   16   16   10                                       
CONECT   16   26   15   15   52                                       
CONECT   17    1   30   20   53                                       
CONECT   18   26   19    1   54                                       
CONECT   19   33   18    2   55                                       
CONECT   20   17   32   56   57                                       
CONECT   21    3    4   34   58                                       
CONECT   22   27   36   36   59                                       
CONECT   23   14                                                      
CONECT   24   25   25   15                                            
CONECT   25   24   24   26                                            
CONECT   26   25   18   16                                            
CONECT   27    4   28   22                                            
CONECT   28   27   29   29                                            
CONECT   29   28   28   36                                            
CONECT   30    2   17                                                 
CONECT   31    1   60                                                 
CONECT   32   20   61                                                 
CONECT   33   19   62                                                 
CONECT   34   21   63                                                 
CONECT   35    2    3                                                 
CONECT   36   29   22   22    5                                       
CONECT   37    8    8    7   64                                       
CONECT   38    5    5    8   65                                       
CONECT   39    7                                                      
CONECT   40    1                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    4                                                      
CONECT   46    6                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   31                                                      
CONECT   61   32                                                      
CONECT   62   33                                                      
CONECT   63   34                                                      
CONECT   64   37                                                      
CONECT   65   38                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
