COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -4.066   2.657  -0.921  1.00  0.00           F  
HETATM    2  C   UNL     1      -4.405   1.437  -0.450  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.648   0.908  -0.731  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.997  -0.346  -0.247  1.00  0.00           C  
HETATM    5  O   UNL     1      -7.220  -0.863  -0.526  1.00  0.00           O  
HETATM    6  C   UNL     1      -7.514  -2.157   0.003  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.096  -1.074   0.522  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.854  -0.555   0.809  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.494   0.704   0.320  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.164   1.263   0.625  1.00  0.00           C  
HETATM   11  O   UNL     1      -2.056   2.429   0.954  1.00  0.00           O  
HETATM   12  N   UNL     1      -1.069   0.483   0.539  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.169  -0.893   0.033  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.193  -1.057  -1.139  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.804  -1.878   1.146  1.00  0.00           C  
HETATM   16  C   UNL     1       0.248   0.994   0.943  1.00  0.00           C  
HETATM   17  C   UNL     1       0.132   2.475   1.312  1.00  0.00           C  
HETATM   18  C   UNL     1       1.221   0.827  -0.230  1.00  0.00           C  
HETATM   19  N   UNL     1       1.123  -0.547  -0.729  1.00  0.00           N  
HETATM   20  C   UNL     1       2.220  -1.325  -0.815  1.00  0.00           C  
HETATM   21  O   UNL     1       2.113  -2.493  -1.138  1.00  0.00           O  
HETATM   22  C   UNL     1       3.549  -0.761  -0.518  1.00  0.00           C  
HETATM   23  C   UNL     1       4.389  -1.393   0.407  1.00  0.00           C  
HETATM   24  F   UNL     1       3.984  -2.521   1.030  1.00  0.00           F  
HETATM   25  C   UNL     1       5.633  -0.860   0.681  1.00  0.00           C  
HETATM   26  C   UNL     1       6.049   0.299   0.041  1.00  0.00           C  
HETATM   27  O   UNL     1       7.273   0.820   0.313  1.00  0.00           O  
HETATM   28  C   UNL     1       7.638   2.014  -0.381  1.00  0.00           C  
HETATM   29  C   UNL     1       5.217   0.929  -0.879  1.00  0.00           C  
HETATM   30  C   UNL     1       3.977   0.403  -1.163  1.00  0.00           C  
HETATM   31  H   UNL     1      -6.351   1.470  -1.328  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.521  -2.451  -0.293  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.796  -2.879  -0.385  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.449  -2.128   1.091  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.372  -2.049   0.896  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.156  -1.123   1.407  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.187  -1.086  -0.306  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.111  -2.111  -1.403  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.556  -0.492  -1.998  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.489  -1.749   1.984  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.879  -2.898   0.768  1.00  0.00           H  
HETATM   42  H   UNL     1       0.216  -1.688   1.479  1.00  0.00           H  
HETATM   43  H   UNL     1       0.611   0.431   1.803  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.570   2.590   2.138  1.00  0.00           H  
HETATM   45  H   UNL     1       1.110   2.852   1.612  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.225   3.037   0.450  1.00  0.00           H  
HETATM   47  H   UNL     1       0.958   1.525  -1.025  1.00  0.00           H  
HETATM   48  H   UNL     1       2.239   1.020   0.108  1.00  0.00           H  
HETATM   49  H   UNL     1       6.282  -1.346   1.394  1.00  0.00           H  
HETATM   50  H   UNL     1       8.637   2.323  -0.072  1.00  0.00           H  
HETATM   51  H   UNL     1       7.632   1.827  -1.455  1.00  0.00           H  
HETATM   52  H   UNL     1       6.925   2.804  -0.146  1.00  0.00           H  
HETATM   53  H   UNL     1       5.546   1.830  -1.374  1.00  0.00           H  
HETATM   54  H   UNL     1       3.333   0.893  -1.877  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    9    1    3    3                                       
CONECT    3    2    2    4   31                                       
CONECT    4    7    7    3    5                                       
CONECT    5    4    6                                                 
CONECT    6    5   32   33   34                                       
CONECT    7    8    4    4   35                                       
CONECT    8    9    9    7   36                                       
CONECT    9   10    8    8    2                                       
CONECT   10   11   11   12    9                                       
CONECT   11   10   10                                                 
CONECT   12   16   10   13                                            
CONECT   13   12   14   15   37                                       
CONECT   14   19   13   38   39                                       
CONECT   15   13   40   41   42                                       
CONECT   16   18   17   12   43                                       
CONECT   17   16   44   45   46                                       
CONECT   18   16   19   47   48                                       
CONECT   19   18   20   14                                            
CONECT   20   22   19   21   21                                       
CONECT   21   20   20                                                 
CONECT   22   23   23   30   20                                       
CONECT   23   25   24   22   22                                       
CONECT   24   23                                                      
CONECT   25   26   26   23   49                                       
CONECT   26   27   25   25   29                                       
CONECT   27   28   26                                                 
CONECT   28   27   50   51   52                                       
CONECT   29   26   30   30   53                                       
CONECT   30   29   29   22   54                                       
CONECT   31    3                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   25                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
