COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.372   1.082  -0.090  1.00  0.00           C  
HETATM    2  C   UNL     1       3.604   0.274  -0.076  1.00  0.00           C  
HETATM    3  C   UNL     1       4.800   0.873   0.079  1.00  0.00           C  
HETATM    4  F   UNL     1       4.883   2.221   0.096  1.00  0.00           F  
HETATM    5  C   UNL     1       6.017   0.058   0.231  1.00  0.00           C  
HETATM    6  C   UNL     1       7.255   0.690   0.392  1.00  0.00           C  
HETATM    7  C   UNL     1       8.383  -0.073   0.533  1.00  0.00           C  
HETATM    8  C   UNL     1       8.255  -1.470   0.511  1.00  0.00           C  
HETATM    9  C   UNL     1       9.408  -2.307   0.649  1.00  0.00           C  
HETATM   10  N   UNL     1      10.324  -2.971   0.759  1.00  0.00           N  
HETATM   11  C   UNL     1       6.986  -2.034   0.347  1.00  0.00           C  
HETATM   12  N   UNL     1       5.925  -1.269   0.219  1.00  0.00           N  
HETATM   13  C   UNL     1       1.164   0.511  -0.500  1.00  0.00           C  
HETATM   14  C   UNL     1       0.013   1.271  -0.506  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.291   0.658  -0.948  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.826   1.430  -2.155  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.063  -0.732  -1.329  1.00  0.00           N  
HETATM   18  C   UNL     1      -2.037  -1.543  -1.631  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.769  -2.842  -1.997  1.00  0.00           N  
HETATM   20  S   UNL     1      -3.705  -0.963  -1.569  1.00  0.00           S  
HETATM   21  C   UNL     1      -3.609  -0.047   0.000  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.563  -0.519   1.013  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.898   0.553   0.498  1.00  0.00           C  
HETATM   24  O   UNL     1      -4.921   1.701   0.888  1.00  0.00           O  
HETATM   25  N   UNL     1      -6.025  -0.185   0.510  1.00  0.00           N  
HETATM   26  C   UNL     1      -7.271   0.342   1.091  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.825  -0.698   2.071  1.00  0.00           C  
HETATM   28  O   UNL     1      -7.917  -1.964   1.412  1.00  0.00           O  
HETATM   29  C   UNL     1      -6.661  -2.491   0.978  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.049  -1.540  -0.064  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.304   0.748   0.197  1.00  0.00           C  
HETATM   32  C   UNL     1       0.053   2.597  -0.105  1.00  0.00           C  
HETATM   33  F   UNL     1      -1.078   3.336  -0.112  1.00  0.00           F  
HETATM   34  C   UNL     1       1.248   3.169   0.303  1.00  0.00           C  
HETATM   35  C   UNL     1       2.406   2.420   0.312  1.00  0.00           C  
HETATM   36  H   UNL     1       3.547  -0.798  -0.190  1.00  0.00           H  
HETATM   37  H   UNL     1       7.320   1.768   0.404  1.00  0.00           H  
HETATM   38  H   UNL     1       9.351   0.390   0.658  1.00  0.00           H  
HETATM   39  H   UNL     1       6.877  -3.109   0.328  1.00  0.00           H  
HETATM   40  H   UNL     1       1.131  -0.522  -0.812  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.103   1.378  -2.970  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.769   0.990  -2.479  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.987   2.472  -1.878  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.852  -3.157  -2.030  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.497  -3.443  -2.221  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.797  -0.396   2.071  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.983  -1.406   0.761  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.064   1.272   1.620  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.997   0.523   0.299  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.157  -0.782   2.928  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.814  -0.390   2.408  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.990  -2.581   1.831  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.814  -3.472   0.529  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.655  -1.545  -0.970  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.033  -1.857  -0.299  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.368   1.714   0.698  1.00  0.00           H  
HETATM   57  H   UNL     1       1.273   4.203   0.614  1.00  0.00           H  
HETATM   58  H   UNL     1       3.336   2.867   0.631  1.00  0.00           H  
CONECT    1    2   13   13   35                                       
CONECT    2    3    3    1   36                                       
CONECT    3    5    2    2    4                                       
CONECT    4    3                                                      
CONECT    5   12   12    6    3                                       
CONECT    6    7    7    5   37                                       
CONECT    7    8    6    6   38                                       
CONECT    8    9   11   11    7                                       
CONECT    9   10   10   10    8                                       
CONECT   10    9    9    9                                            
CONECT   11    8    8   12   39                                       
CONECT   12   11    5    5                                            
CONECT   13    1    1   14   40                                       
CONECT   14   13   15   32   32                                       
CONECT   15   17   14   16   31                                       
CONECT   16   15   41   42   43                                       
CONECT   17   18   18   15                                            
CONECT   18   19   17   17   20                                       
CONECT   19   18   44   45                                            
CONECT   20   18   21                                                 
CONECT   21   20   31   22   23                                       
CONECT   22   21   31   46   47                                       
CONECT   23   21   25   24   24                                       
CONECT   24   23   23                                                 
CONECT   25   26   23   30                                            
CONECT   26   27   25   48   49                                       
CONECT   27   26   28   50   51                                       
CONECT   28   27   29                                                 
CONECT   29   28   30   52   53                                       
CONECT   30   25   29   54   55                                       
CONECT   31   15   21   22   56                                       
CONECT   32   14   14   34   33                                       
CONECT   33   32                                                      
CONECT   34   35   35   32   57                                       
CONECT   35    1   34   34   58                                       
CONECT   36    2                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   34                                                      
CONECT   58   35                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
