COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.552  -0.407  -0.023  1.00  0.00           C  
HETATM    2  C   UNL     1       5.654  -1.267   0.112  1.00  0.00           C  
HETATM    3  C   UNL     1       4.753   0.970  -0.084  1.00  0.00           C  
HETATM    4  C   UNL     1       3.187  -0.960  -0.106  1.00  0.00           C  
HETATM    5  C   UNL     1       6.937  -0.745   0.191  1.00  0.00           C  
HETATM    6  O   UNL     1       5.463  -2.608   0.168  1.00  0.00           O  
HETATM    7  C   UNL     1       6.045   1.485  -0.005  1.00  0.00           C  
HETATM    8  N   UNL     1       2.132  -0.133  -0.242  1.00  0.00           N  
HETATM    9  O   UNL     1       3.014  -2.162  -0.053  1.00  0.00           O  
HETATM   10  C   UNL     1       7.137   0.618   0.135  1.00  0.00           C  
HETATM   11  C   UNL     1       6.628  -3.424   0.306  1.00  0.00           C  
HETATM   12  C   UNL     1       6.258   2.900  -0.067  1.00  0.00           C  
HETATM   13  C   UNL     1       0.776  -0.682  -0.325  1.00  0.00           C  
HETATM   14 CL   UNL     1       8.746   1.262   0.234  1.00  0.00          Cl  
HETATM   15  N   UNL     1       6.426   4.022  -0.117  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.229   0.461  -0.474  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.589  -0.089  -0.558  1.00  0.00           N  
HETATM   18  C   UNL     1      -2.555   0.949  -0.937  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.972  -0.737   0.704  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.930   0.313  -1.155  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.329  -1.423   0.534  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.377  -0.380   0.135  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.703  -1.059  -0.092  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.953  -0.300   0.058  1.00  0.00           C  
HETATM   25  O   UNL     1      -5.739  -2.232  -0.398  1.00  0.00           O  
HETATM   26  C   UNL     1      -8.186  -0.927  -0.152  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.915   1.053   0.417  1.00  0.00           C  
HETATM   28  C   UNL     1      -9.353  -0.210  -0.010  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.090   1.758   0.556  1.00  0.00           C  
HETATM   30  C   UNL     1      -9.309   1.131   0.341  1.00  0.00           C  
HETATM   31  F   UNL     1     -10.457   1.829   0.479  1.00  0.00           F  
HETATM   32  H   UNL     1       3.910   1.636  -0.192  1.00  0.00           H  
HETATM   33  H   UNL     1       7.782  -1.409   0.295  1.00  0.00           H  
HETATM   34  H   UNL     1       2.270   0.826  -0.285  1.00  0.00           H  
HETATM   35  H   UNL     1       7.291  -3.257  -0.543  1.00  0.00           H  
HETATM   36  H   UNL     1       7.147  -3.163   1.229  1.00  0.00           H  
HETATM   37  H   UNL     1       6.335  -4.473   0.337  1.00  0.00           H  
HETATM   38  H   UNL     1       0.705  -1.344  -1.188  1.00  0.00           H  
HETATM   39  H   UNL     1       0.556  -1.244   0.583  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.158   1.123   0.389  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.009   1.023  -1.382  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.621   1.692  -0.142  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.227   1.431  -1.858  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.221  -1.479   0.974  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.041   0.014   1.491  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.650   1.087  -1.422  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.868  -0.419  -1.960  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.258  -2.183  -0.244  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.621  -1.890   1.475  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.476   0.359   0.930  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.222  -1.971  -0.426  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.967   1.542   0.584  1.00  0.00           H  
HETATM   53  H   UNL     1     -10.306  -0.693  -0.172  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.062   2.802   0.833  1.00  0.00           H  
CONECT    1    2    4    3    3                                       
CONECT    2    6    5    5    1                                       
CONECT    3    1    1    7   32                                       
CONECT    4    8    1    9    9                                       
CONECT    5    2    2   10   33                                       
CONECT    6   11    2                                                 
CONECT    7   10   10    3   12                                       
CONECT    8   13    4   34                                            
CONECT    9    4    4                                                 
CONECT   10    5   14    7    7                                       
CONECT   11    6   35   36   37                                       
CONECT   12    7   15   15   15                                       
CONECT   13    8   16   38   39                                       
CONECT   14   10                                                      
CONECT   15   12   12   12                                            
CONECT   16   13   17   40   41                                       
CONECT   17   16   19   18                                            
CONECT   18   17   20   42   43                                       
CONECT   19   17   21   44   45                                       
CONECT   20   18   22   46   47                                       
CONECT   21   19   22   48   49                                       
CONECT   22   21   20   23   50                                       
CONECT   23   22   24   25   25                                       
CONECT   24   27   23   26   26                                       
CONECT   25   23   23                                                 
CONECT   26   24   24   28   51                                       
CONECT   27   29   29   24   52                                       
CONECT   28   30   30   26   53                                       
CONECT   29   27   27   30   54                                       
CONECT   30   29   31   28   28                                       
CONECT   31   30                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    8                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
