COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.348  -3.932  -0.112  1.00  0.00           C  
HETATM    2  C   UNL     1       2.963  -3.461  -0.558  1.00  0.00           C  
HETATM    3  C   UNL     1       1.071  -2.300   0.297  1.00  0.00           C  
HETATM    4  C   UNL     1       0.397  -2.663  -0.860  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.897  -2.229  -1.069  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.523  -1.429  -0.122  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.847  -1.067   1.036  1.00  0.00           C  
HETATM    8  O   UNL     1       2.348  -2.723   0.500  1.00  0.00           O  
HETATM    9  O   UNL     1      -3.642  -2.357   1.248  1.00  0.00           O  
HETATM   10  O   UNL     1       0.706   0.234  -1.523  1.00  0.00           O  
HETATM   11  O   UNL     1       6.452   0.880  -0.672  1.00  0.00           O  
HETATM   12  C   UNL     1      -5.202  -1.008   0.133  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.367  -0.018  -0.862  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.641   0.032  -0.475  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.551  -0.937   0.513  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.316  -1.474   0.832  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.085  -0.041  -1.277  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.923   0.504  -2.065  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.446   1.260  -3.289  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.808   2.547  -0.564  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.154   2.169   0.854  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.339   1.517   1.135  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.843   1.446   3.383  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.643   2.101   3.179  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.284   2.467   1.892  1.00  0.00           C  
HETATM   26  C   UNL     1       0.175   1.219  -1.053  1.00  0.00           C  
HETATM   27  C   UNL     1       0.995   2.220  -0.280  1.00  0.00           C  
HETATM   28  C   UNL     1       2.455   1.862  -0.385  1.00  0.00           C  
HETATM   29  C   UNL     1       3.193   2.285  -1.475  1.00  0.00           C  
HETATM   30  C   UNL     1       4.532   1.958  -1.573  1.00  0.00           C  
HETATM   31  C   UNL     1       5.135   1.204  -0.577  1.00  0.00           C  
HETATM   32  C   UNL     1       4.392   0.780   0.515  1.00  0.00           C  
HETATM   33  C   UNL     1       3.056   1.115   0.612  1.00  0.00           C  
HETATM   34  C   UNL     1       7.003   0.089   0.383  1.00  0.00           C  
HETATM   35  C   UNL     1       0.447  -1.502   1.244  1.00  0.00           C  
HETATM   36  C   UNL     1      -3.848  -1.508   0.400  1.00  0.00           C  
HETATM   37  F   UNL     1       8.354  -0.161   0.121  1.00  0.00           F  
HETATM   38  F   UNL     1       6.883   0.778   1.594  1.00  0.00           F  
HETATM   39  F   UNL     1       6.311  -1.124   0.466  1.00  0.00           F  
HETATM   40  N   UNL     1      -2.836  -0.988  -0.335  1.00  0.00           N  
HETATM   41  N   UNL     1      -6.579   0.460  -1.124  1.00  0.00           N  
HETATM   42  N   UNL     1      -4.272   0.423  -1.529  1.00  0.00           N  
HETATM   43  N   UNL     1      -1.147   1.418  -1.222  1.00  0.00           N  
HETATM   44  N   UNL     1      -3.646   1.179   2.372  1.00  0.00           N  
HETATM   45  H   UNL     1       4.259  -4.498   0.815  1.00  0.00           H  
HETATM   46  H   UNL     1       4.782  -4.568  -0.885  1.00  0.00           H  
HETATM   47  H   UNL     1       4.991  -3.067   0.050  1.00  0.00           H  
HETATM   48  H   UNL     1       3.061  -2.823  -1.436  1.00  0.00           H  
HETATM   49  H   UNL     1       2.346  -4.326  -0.804  1.00  0.00           H  
HETATM   50  H   UNL     1       0.884  -3.284  -1.597  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.422  -2.510  -1.970  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.334  -0.446   1.773  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.609   0.446  -0.719  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.439  -1.270   1.030  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.218  -2.230   1.597  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.287  -0.318  -2.391  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.092   0.604  -3.872  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.013   2.132  -2.962  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.606   1.582  -3.903  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.720   2.800  -1.105  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.138   3.407  -0.558  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.022   1.281   0.332  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.130   1.157   4.384  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.993   2.324   4.013  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.349   2.973   1.701  1.00  0.00           H  
HETATM   66  H   UNL     1       0.835   3.216  -0.693  1.00  0.00           H  
HETATM   67  H   UNL     1       0.692   2.207   0.766  1.00  0.00           H  
HETATM   68  H   UNL     1       2.723   2.872  -2.250  1.00  0.00           H  
HETATM   69  H   UNL     1       5.108   2.289  -2.425  1.00  0.00           H  
HETATM   70  H   UNL     1       4.860   0.193   1.292  1.00  0.00           H  
HETATM   71  H   UNL     1       2.477   0.786   1.462  1.00  0.00           H  
HETATM   72  H   UNL     1       0.972  -1.220   2.145  1.00  0.00           H  
CONECT    1    2   45   46   47                                       
CONECT    2    1    8   48   49                                       
CONECT    3    8   35   35    4                                       
CONECT    4    3    5    5   50                                       
CONECT    5    4    4    6   51                                       
CONECT    6    7    7    5   40                                       
CONECT    7   35    6    6   52                                       
CONECT    8    2    3                                                 
CONECT    9   36   36                                                 
CONECT   10   26   26                                                 
CONECT   11   34   31                                                 
CONECT   12   36   16   16   13                                       
CONECT   13   12   42   41   41                                       
CONECT   14   15   15   41   53                                       
CONECT   15   16   14   14   54                                       
CONECT   16   12   12   15   55                                       
CONECT   17   40   18   42   42                                       
CONECT   18   43   17   19   56                                       
CONECT   19   18   57   58   59                                       
CONECT   20   21   43   60   61                                       
CONECT   21   22   22   25   20                                       
CONECT   22   44   21   21   62                                       
CONECT   23   44   44   24   63                                       
CONECT   24   23   25   25   64                                       
CONECT   25   24   24   21   65                                       
CONECT   26   10   10   27   43                                       
CONECT   27   28   26   66   67                                       
CONECT   28   33   33   29   27                                       
CONECT   29   30   30   28   68                                       
CONECT   30   31   29   29   69                                       
CONECT   31   11   32   32   30                                       
CONECT   32   31   31   33   70                                       
CONECT   33   32   28   28   71                                       
CONECT   34   38   11   39   37                                       
CONECT   35    3    3    7   72                                       
CONECT   36    9    9   40   12                                       
CONECT   37   34                                                      
CONECT   38   34                                                      
CONECT   39   34                                                      
CONECT   40    6   36   17                                            
CONECT   41   13   13   14                                            
CONECT   42   17   17   13                                            
CONECT   43   26   20   18                                            
CONECT   44   23   23   22                                            
CONECT   45    1                                                      
CONECT   46    1                                                      
CONECT   47    1                                                      
CONECT   48    2                                                      
CONECT   49    2                                                      
CONECT   50    4                                                      
CONECT   51    5                                                      
CONECT   52    7                                                      
CONECT   53   14                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   20                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   27                                                      
CONECT   67   27                                                      
CONECT   68   29                                                      
CONECT   69   30                                                      
CONECT   70   32                                                      
CONECT   71   33                                                      
CONECT   72   35                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
