COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.418   3.457  -0.921  1.00  0.00           C  
HETATM    2  C   UNL     1       2.085   2.957  -0.428  1.00  0.00           C  
HETATM    3  C   UNL     1       0.990   3.798  -0.420  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.366   2.037   0.477  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.701   1.541   0.968  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.686   0.467   0.050  1.00  0.00           C  
HETATM    7  O   UNL     1      -4.172   0.479   1.165  1.00  0.00           O  
HETATM    8  C   UNL     1      -5.615  -0.670  -0.754  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.990  -1.775  -1.508  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.210  -2.382  -1.282  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.059  -1.892  -0.307  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.688  -0.791   0.447  1.00  0.00           C  
HETATM   13  C   UNL     1       1.955   1.646   0.013  1.00  0.00           C  
HETATM   14  C   UNL     1       2.878  -0.545   0.042  1.00  0.00           C  
HETATM   15  C   UNL     1       3.997  -1.411   0.137  1.00  0.00           C  
HETATM   16  C   UNL     1       3.971  -2.784   0.320  1.00  0.00           C  
HETATM   17  C   UNL     1       6.060  -2.198   0.194  1.00  0.00           C  
HETATM   18  C   UNL     1       7.464  -2.136   0.154  1.00  0.00           C  
HETATM   19  C   UNL     1       8.076  -0.931  -0.021  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.234   3.339   0.032  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.455   0.975  -0.153  1.00  0.00           N  
HETATM   22  N   UNL     1      -4.380  -0.053  -0.981  1.00  0.00           N  
HETATM   23  F   UNL     1      -8.520  -0.314   1.399  1.00  0.00           F  
HETATM   24  C   UNL     1      -6.470  -0.176   0.221  1.00  0.00           C  
HETATM   25  C   UNL     1       0.724   1.188   0.467  1.00  0.00           C  
HETATM   26  N   UNL     1       3.060   0.789   0.001  1.00  0.00           N  
HETATM   27  O   UNL     1       1.753  -1.008  -0.002  1.00  0.00           O  
HETATM   28  N   UNL     1       5.220  -3.221   0.350  1.00  0.00           N  
HETATM   29  C   UNL     1       7.298   0.227  -0.157  1.00  0.00           C  
HETATM   30  C   UNL     1       5.948   0.146  -0.120  1.00  0.00           C  
HETATM   31  N   UNL     1       5.331  -1.052   0.059  1.00  0.00           N  
HETATM   32  H   UNL     1       3.979   3.880  -0.087  1.00  0.00           H  
HETATM   33  H   UNL     1       3.980   2.630  -1.354  1.00  0.00           H  
HETATM   34  H   UNL     1       3.260   4.225  -1.679  1.00  0.00           H  
HETATM   35  H   UNL     1       1.090   4.816  -0.767  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.547   0.774   1.727  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.260   2.372   1.400  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.328  -2.159  -2.270  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.501  -3.241  -1.869  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.012  -2.369  -0.133  1.00  0.00           H  
HETATM   41  H   UNL     1       3.085  -3.392   0.422  1.00  0.00           H  
HETATM   42  H   UNL     1       8.053  -3.036   0.260  1.00  0.00           H  
HETATM   43  H   UNL     1       9.154  -0.868  -0.053  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.087   4.001   0.041  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.067   0.966  -1.043  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.023   0.000  -1.882  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.181   0.683   0.809  1.00  0.00           H  
HETATM   48  H   UNL     1       0.619   0.170   0.810  1.00  0.00           H  
HETATM   49  H   UNL     1       3.957   1.156  -0.037  1.00  0.00           H  
HETATM   50  H   UNL     1       7.777   1.185  -0.295  1.00  0.00           H  
HETATM   51  H   UNL     1       5.356   1.043  -0.225  1.00  0.00           H  
CONECT    1    2   32   33   34                                       
CONECT    2   13    1    3    3                                       
CONECT    3    2    2   20   35                                       
CONECT    4   25    5   20   20                                       
CONECT    5   21    4   36   37                                       
CONECT    6    7    7   22   21                                       
CONECT    7    6    6                                                 
CONECT    8   24   24    9   22                                       
CONECT    9   10   10    8   38                                       
CONECT   10   11    9    9   39                                       
CONECT   11   12   12   10   40                                       
CONECT   12   23   11   11   24                                       
CONECT   13   26   25   25    2                                       
CONECT   14   15   26   27   27                                       
CONECT   15   16   16   31   14                                       
CONECT   16   28   15   15   41                                       
CONECT   17   28   28   18   31                                       
CONECT   18   17   19   19   42                                       
CONECT   19   18   18   29   43                                       
CONECT   20    4    4    3   44                                       
CONECT   21    6    5   45                                            
CONECT   22    8    6   46                                            
CONECT   23   12                                                      
CONECT   24   12    8    8   47                                       
CONECT   25   13   13    4   48                                       
CONECT   26   14   13   49                                            
CONECT   27   14   14                                                 
CONECT   28   16   17   17                                            
CONECT   29   19   30   30   50                                       
CONECT   30   31   29   29   51                                       
CONECT   31   17   15   30                                            
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
