COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.882  -0.839  -0.654  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.945  -0.578   0.189  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.466  -1.590   0.979  1.00  0.00           C  
HETATM    4  N   UNL     1       5.441   2.529   0.577  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.315   0.262  -1.513  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.277   2.432   0.547  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.172   0.431  -0.447  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.842  -0.473  -1.272  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.193  -0.386  -1.450  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.920   0.612  -0.805  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.253   1.529   0.030  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.868   1.430   0.204  1.00  0.00           C  
HETATM   13  C   UNL     1       2.144   3.760  -0.014  1.00  0.00           C  
HETATM   14  C   UNL     1       1.979   1.463  -0.105  1.00  0.00           C  
HETATM   15  C   UNL     1       4.023   0.056   0.246  1.00  0.00           C  
HETATM   16  C   UNL     1       7.369  -1.193   0.613  1.00  0.00           C  
HETATM   17  C   UNL     1       7.951  -2.605   0.699  1.00  0.00           C  
HETATM   18  C   UNL     1       8.242  -4.621  -0.565  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.921  -2.862   0.921  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.858  -3.120   0.076  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.335  -2.108  -0.707  1.00  0.00           C  
HETATM   22  F   UNL     1      -8.505  -1.337   1.804  1.00  0.00           F  
HETATM   23  N   UNL     1      -4.249   0.951  -0.782  1.00  0.00           N  
HETATM   24  N   UNL     1      -4.422   2.061   0.051  1.00  0.00           N  
HETATM   25  N   UNL     1       1.214   0.324  -0.278  1.00  0.00           N  
HETATM   26  N   UNL     1       3.438   3.720   0.229  1.00  0.00           N  
HETATM   27  N   UNL     1       1.424   2.669  -0.179  1.00  0.00           N  
HETATM   28  C   UNL     1       3.359   1.366   0.154  1.00  0.00           C  
HETATM   29  C   UNL     1       4.084   2.560   0.321  1.00  0.00           C  
HETATM   30  N   UNL     1       5.310  -0.010   0.380  1.00  0.00           N  
HETATM   31  O   UNL     1       5.950  -1.270   0.468  1.00  0.00           O  
HETATM   32  O   UNL     1       7.734  -3.286  -0.539  1.00  0.00           O  
HETATM   33  H   UNL     1      -7.369   0.414   0.234  1.00  0.00           H  
HETATM   34  H   UNL     1       5.975   3.330   0.461  1.00  0.00           H  
HETATM   35  H   UNL     1       5.860   1.706   0.872  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.910  -0.165  -2.430  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.104   0.972  -1.761  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.114   3.257   1.224  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.286  -1.249  -1.776  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.699  -1.092  -2.092  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.349   2.128   0.843  1.00  0.00           H  
HETATM   42  H   UNL     1       1.656   4.721  -0.077  1.00  0.00           H  
HETATM   43  H   UNL     1       3.438  -0.851   0.202  1.00  0.00           H  
HETATM   44  H   UNL     1       7.612  -0.644   1.523  1.00  0.00           H  
HETATM   45  H   UNL     1       7.795  -0.676  -0.247  1.00  0.00           H  
HETATM   46  H   UNL     1       9.021  -2.546   0.898  1.00  0.00           H  
HETATM   47  H   UNL     1       7.461  -3.152   1.505  1.00  0.00           H  
HETATM   48  H   UNL     1       9.318  -4.604  -0.392  1.00  0.00           H  
HETATM   49  H   UNL     1       7.758  -5.209   0.215  1.00  0.00           H  
HETATM   50  H   UNL     1       8.037  -5.069  -1.538  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.327  -3.651   1.536  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.433  -4.111   0.031  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.505  -2.310  -1.367  1.00  0.00           H  
HETATM   54  H   UNL     1       1.637  -0.549  -0.283  1.00  0.00           H  
CONECT    1    2    2    5   21                                       
CONECT    2    1    1    3   33                                       
CONECT    3    2   19   19   22                                       
CONECT    4   29   34   35                                            
CONECT    5    1   23   36   37                                       
CONECT    6   11   24   24   38                                       
CONECT    7    8    8   12   25                                       
CONECT    8    7    7    9   39                                       
CONECT    9    8   10   10   40                                       
CONECT   10    9    9   11   23                                       
CONECT   11    6   10   12   12                                       
CONECT   12    7   11   11   41                                       
CONECT   13   26   26   27   42                                       
CONECT   14   25   27   27   28                                       
CONECT   15   28   30   30   43                                       
CONECT   16   17   31   44   45                                       
CONECT   17   16   32   46   47                                       
CONECT   18   32   48   49   50                                       
CONECT   19    3    3   20   51                                       
CONECT   20   19   21   21   52                                       
CONECT   21    1   20   20   53                                       
CONECT   22    3                                                      
CONECT   23    5   10   24                                            
CONECT   24    6    6   23                                            
CONECT   25    7   14   54                                            
CONECT   26   13   13   29                                            
CONECT   27   13   14   14                                            
CONECT   28   14   15   29   29                                       
CONECT   29    4   26   28   28                                       
CONECT   30   15   15   31                                            
CONECT   31   16   30                                                 
CONECT   32   17   18                                                 
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   25                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
