COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.772  -4.986  -0.450  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.703  -4.052  -0.037  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.427  -4.668  -0.452  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.289  -2.799   0.374  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.013  -3.414  -0.041  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.944  -2.480   0.373  1.00  0.00           C  
HETATM    7  C   UNL     1       3.067   2.000  -0.277  1.00  0.00           C  
HETATM    8  C   UNL     1       2.602   0.693  -0.297  1.00  0.00           C  
HETATM    9  C   UNL     1       2.148   3.033  -0.080  1.00  0.00           C  
HETATM   10  C   UNL     1       0.427   1.440   0.007  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.517   3.502   0.100  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.075   3.813   0.448  1.00  0.00           C  
HETATM   13  C   UNL     1       3.054  -1.620  -1.078  1.00  0.00           C  
HETATM   14  C   UNL     1       4.883  -0.245  -0.014  1.00  0.00           C  
HETATM   15  C   UNL     1       3.476  -2.776  -0.163  1.00  0.00           C  
HETATM   16  C   UNL     1       5.216  -1.468   0.849  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.905   2.084   0.487  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.336  -0.204  -0.400  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.493  -1.113   0.820  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.253   1.741  -0.150  1.00  0.00           C  
HETATM   21  N   UNL     1       1.294   0.458  -0.160  1.00  0.00           N  
HETATM   22  N   UNL     1       3.484  -0.357  -0.458  1.00  0.00           N  
HETATM   23  N   UNL     1       0.841   2.731   0.106  1.00  0.00           N  
HETATM   24  N   UNL     1      -0.905   1.127   0.036  1.00  0.00           N  
HETATM   25  O   UNL     1       2.520   4.196  -0.075  1.00  0.00           O  
HETATM   26  O   UNL     1       4.869  -2.657   0.134  1.00  0.00           O  
HETATM   27  O   UNL     1      -0.239  -1.223   1.497  1.00  0.00           O  
HETATM   28  F   UNL     1      -3.122   1.735  -1.543  1.00  0.00           F  
HETATM   29  F   UNL     1      -3.666   0.477   0.285  1.00  0.00           F  
HETATM   30  F   UNL     1      -4.203   2.697   0.225  1.00  0.00           F  
HETATM   31  H   UNL     1      -3.095  -5.967  -0.767  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.754  -4.301  -0.036  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.699  -5.398  -0.774  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.017  -2.068   0.696  1.00  0.00           H  
HETATM   35  H   UNL     1       0.038  -3.165  -0.041  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.235  -0.689   1.497  1.00  0.00           H  
HETATM   37  H   UNL     1       4.118   2.214  -0.406  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.167   4.203   0.623  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.656   3.626  -0.974  1.00  0.00           H  
HETATM   40  H   UNL     1       0.228   4.713  -0.087  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.007   4.006   1.519  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.996   2.022   1.571  1.00  0.00           H  
HETATM   43  H   UNL     1       3.529  -1.731  -2.052  1.00  0.00           H  
HETATM   44  H   UNL     1       1.970  -1.621  -1.195  1.00  0.00           H  
HETATM   45  H   UNL     1       2.901  -2.736   0.762  1.00  0.00           H  
HETATM   46  H   UNL     1       3.291  -3.724  -0.667  1.00  0.00           H  
HETATM   47  H   UNL     1       5.010   0.664   0.573  1.00  0.00           H  
HETATM   48  H   UNL     1       5.542  -0.218  -0.882  1.00  0.00           H  
HETATM   49  H   UNL     1       6.282  -1.476   1.073  1.00  0.00           H  
HETATM   50  H   UNL     1       4.648  -1.423   1.778  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.590  -0.625  -1.074  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.291  -0.124  -0.920  1.00  0.00           H  
HETATM   53  H   UNL     1       0.485  -1.533   0.936  1.00  0.00           H  
CONECT    1    2    3    3   31                                       
CONECT    2    1    4    4   32                                       
CONECT    3    1    1    5   33                                       
CONECT    4    2    2    6   34                                       
CONECT    5    3    6    6   35                                       
CONECT    6    4    5    5   19                                       
CONECT    7    8    8    9   37                                       
CONECT    8    7    7   21   22                                       
CONECT    9    7   23   25   25                                       
CONECT   10   21   21   23   24                                       
CONECT   11   12   17   38   39                                       
CONECT   12   11   23   40   41                                       
CONECT   13   15   22   43   44                                       
CONECT   14   16   22   47   48                                       
CONECT   15   13   26   45   46                                       
CONECT   16   14   26   49   50                                       
CONECT   17   11   20   24   42                                       
CONECT   18   19   24   51   52                                       
CONECT   19    6   18   27   36                                       
CONECT   20   17   28   29   30                                       
CONECT   21    8   10   10                                            
CONECT   22    8   13   14                                            
CONECT   23    9   10   12                                            
CONECT   24   10   17   18                                            
CONECT   25    9    9                                                 
CONECT   26   15   16                                                 
CONECT   27   19   53                                                 
CONECT   28   20                                                      
CONECT   29   20                                                      
CONECT   30   20                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36   19                                                      
CONECT   37    7                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   17                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   27                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
