COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.299   1.911  -0.149  1.00  0.00           C  
HETATM    2  C   UNL     1       1.117  -0.745  -0.037  1.00  0.00           C  
HETATM    3  C   UNL     1       0.243   0.285  -0.035  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.708   0.632   0.023  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.058  -0.253  -0.052  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.324   0.523  -0.057  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.557  -0.132   0.031  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.604   2.016  -0.076  1.00  0.00           C  
HETATM    9  C   UNL     1       0.480  -4.006   1.177  1.00  0.00           C  
HETATM   10  C   UNL     1       0.503  -3.983  -1.321  1.00  0.00           C  
HETATM   11  C   UNL     1       0.964  -3.249  -0.061  1.00  0.00           C  
HETATM   12  N   UNL     1       0.407  -1.894  -0.054  1.00  0.00           N  
HETATM   13  N   UNL     1      -0.954  -1.565  -0.063  1.00  0.00           N  
HETATM   14  N   UNL     1      -3.421   2.605  -0.154  1.00  0.00           N  
HETATM   15  N   UNL     1      -5.758   2.791  -0.096  1.00  0.00           N  
HETATM   16  C   UNL     1      -6.060  -0.027   0.110  1.00  0.00           C  
HETATM   17  F   UNL     1      -6.735   0.439   1.243  1.00  0.00           F  
HETATM   18  F   UNL     1      -6.804   0.280  -1.035  1.00  0.00           F  
HETATM   19  F   UNL     1      -5.898  -1.414   0.202  1.00  0.00           F  
HETATM   20  C   UNL     1       2.620  -0.632  -0.027  1.00  0.00           C  
HETATM   21  C   UNL     1       3.244   0.538  -0.789  1.00  0.00           C  
HETATM   22  C   UNL     1       3.235   0.531   0.753  1.00  0.00           C  
HETATM   23  C   UNL     1       4.720   0.428   1.162  1.00  0.00           C  
HETATM   24  N   UNL     1       5.468   0.967  -0.003  1.00  0.00           N  
HETATM   25  C   UNL     1       4.724   0.424  -1.214  1.00  0.00           C  
HETATM   26  C   UNL     1       6.860   0.498   0.003  1.00  0.00           C  
HETATM   27  C   UNL     1       7.709   1.087   1.145  1.00  0.00           C  
HETATM   28  O   UNL     1       8.733   1.256   0.145  1.00  0.00           O  
HETATM   29  C   UNL     1       7.785   1.286  -0.944  1.00  0.00           C  
HETATM   30  H   UNL     1      -1.352   2.426  -0.213  1.00  0.00           H  
HETATM   31  H   UNL     1       0.498   1.335  -0.023  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.608  -1.208   0.104  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.609  -4.061   1.166  1.00  0.00           H  
HETATM   34  H   UNL     1       0.894  -5.014   1.171  1.00  0.00           H  
HETATM   35  H   UNL     1       0.809  -3.483   2.075  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.586  -4.038  -1.332  1.00  0.00           H  
HETATM   37  H   UNL     1       0.848  -3.443  -2.203  1.00  0.00           H  
HETATM   38  H   UNL     1       0.917  -4.991  -1.327  1.00  0.00           H  
HETATM   39  H   UNL     1       2.053  -3.194  -0.051  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.628   2.366  -0.040  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.693   3.756  -0.165  1.00  0.00           H  
HETATM   42  H   UNL     1       3.162  -1.578  -0.028  1.00  0.00           H  
HETATM   43  H   UNL     1       2.603   1.208  -1.364  1.00  0.00           H  
HETATM   44  H   UNL     1       2.588   1.195   1.327  1.00  0.00           H  
HETATM   45  H   UNL     1       4.909   1.035   2.048  1.00  0.00           H  
HETATM   46  H   UNL     1       4.997  -0.610   1.345  1.00  0.00           H  
HETATM   47  H   UNL     1       5.004  -0.613  -1.400  1.00  0.00           H  
HETATM   48  H   UNL     1       4.928   1.037  -2.092  1.00  0.00           H  
HETATM   49  H   UNL     1       6.946  -0.584  -0.098  1.00  0.00           H  
HETATM   50  H   UNL     1       7.323   2.025   1.544  1.00  0.00           H  
HETATM   51  H   UNL     1       7.963   0.366   1.922  1.00  0.00           H  
HETATM   52  H   UNL     1       8.103   0.724  -1.822  1.00  0.00           H  
HETATM   53  H   UNL     1       7.421   2.285  -1.184  1.00  0.00           H  
CONECT    1    6    6   14   30                                       
CONECT    2   20   12    3    3                                       
CONECT    3    2    2    5   31                                       
CONECT    4    7    7    8   16                                       
CONECT    5    3   13   13    6                                       
CONECT    6    5    1    1    7                                       
CONECT    7    6    4    4   32                                       
CONECT    8   14   14    4   15                                       
CONECT    9   11   33   34   35                                       
CONECT   10   11   36   37   38                                       
CONECT   11    9   12   10   39                                       
CONECT   12    2   11   13                                            
CONECT   13   12    5    5                                            
CONECT   14    1    8    8                                            
CONECT   15    8   40   41                                            
CONECT   16   18    4   17   19                                       
CONECT   17   16                                                      
CONECT   18   16                                                      
CONECT   19   16                                                      
CONECT   20   22   21    2   42                                       
CONECT   21   22   20   25   43                                       
CONECT   22   23   20   21   44                                       
CONECT   23   24   22   45   46                                       
CONECT   24   23   26   25                                            
CONECT   25   24   21   47   48                                       
CONECT   26   27   29   24   49                                       
CONECT   27   28   26   50   51                                       
CONECT   28   27   29                                                 
CONECT   29   28   26   52   53                                       
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    7                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
