COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.328   1.226  -2.849  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.901   1.972  -1.671  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.527   3.188  -1.862  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.053   3.873  -0.782  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.953   3.344   0.491  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.328   2.129   0.689  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.804   1.435  -0.394  1.00  0.00           C  
HETATM    8  N   UNL     1      -3.174   0.199  -0.199  1.00  0.00           N  
HETATM    9  C   UNL     1      -3.901  -0.940  -0.257  1.00  0.00           C  
HETATM   10  O   UNL     1      -5.098  -0.916  -0.478  1.00  0.00           O  
HETATM   11  C   UNL     1      -3.190  -2.209  -0.045  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.846  -3.438  -0.085  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.328  -3.499  -0.352  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.130  -4.597   0.121  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.764  -4.549   0.367  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.097  -3.345   0.411  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.801  -2.157   0.206  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.183  -0.949   0.240  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.836   0.155   0.043  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.075   1.455   0.092  1.00  0.00           C  
HETATM   21  N   UNL     1       0.339   1.183   0.363  1.00  0.00           N  
HETATM   22  N   UNL     1       1.319   0.957  -0.610  1.00  0.00           N  
HETATM   23  C   UNL     1       0.905   1.116   1.601  1.00  0.00           C  
HETATM   24  N   UNL     1       0.447   1.253   2.845  1.00  0.00           N  
HETATM   25  C   UNL     1       1.255   1.130   3.875  1.00  0.00           C  
HETATM   26  N   UNL     1       2.544   0.869   3.744  1.00  0.00           N  
HETATM   27  C   UNL     1       3.094   0.715   2.543  1.00  0.00           C  
HETATM   28  N   UNL     1       4.442   0.442   2.412  1.00  0.00           N  
HETATM   29  C   UNL     1       2.271   0.837   1.412  1.00  0.00           C  
HETATM   30  C   UNL     1       2.479   0.746  -0.033  1.00  0.00           C  
HETATM   31  C   UNL     1       3.763   0.469  -0.720  1.00  0.00           C  
HETATM   32  C   UNL     1       4.600  -0.545  -0.255  1.00  0.00           C  
HETATM   33  C   UNL     1       5.795  -0.800  -0.897  1.00  0.00           C  
HETATM   34  F   UNL     1       6.606  -1.783  -0.448  1.00  0.00           F  
HETATM   35  C   UNL     1       6.164  -0.046  -2.006  1.00  0.00           C  
HETATM   36  O   UNL     1       7.341  -0.299  -2.637  1.00  0.00           O  
HETATM   37  C   UNL     1       5.332   0.963  -2.470  1.00  0.00           C  
HETATM   38  C   UNL     1       4.135   1.219  -1.835  1.00  0.00           C  
HETATM   39  H   UNL     1      -2.292   1.529  -3.002  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.368   0.154  -2.654  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.909   1.454  -3.742  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.607   3.604  -2.855  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.542   4.824  -0.934  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.365   3.882   1.333  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.250   1.716   1.684  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.505  -3.465  -1.427  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.733  -4.426   0.054  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.818  -2.649   0.123  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.635  -5.551   0.091  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.218  -5.467   0.527  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.035  -3.320   0.604  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.169   1.967  -0.866  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.481   2.085   0.882  1.00  0.00           H  
HETATM   54  H   UNL     1       0.850   1.248   4.869  1.00  0.00           H  
HETATM   55  H   UNL     1       4.951   0.132   3.178  1.00  0.00           H  
HETATM   56  H   UNL     1       4.880   0.562   1.555  1.00  0.00           H  
HETATM   57  H   UNL     1       4.313  -1.130   0.607  1.00  0.00           H  
HETATM   58  H   UNL     1       3.487   2.002  -2.199  1.00  0.00           H  
HETATM   59  H   UNL     1       7.274  -0.951  -3.348  1.00  0.00           H  
HETATM   60  H   UNL     1       5.622   1.546  -3.331  1.00  0.00           H  
CONECT    1    2   39   40   41                                       
CONECT    2    1    3    7    7                                       
CONECT    3    2    4    4   42                                       
CONECT    4    3    3    5   43                                       
CONECT    5    4    6    6   44                                       
CONECT    6    5    5    7   45                                       
CONECT    7    2    2    6    8                                       
CONECT    8    7    9   19                                            
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12   17   17                                       
CONECT   12   11   13   14   14                                       
CONECT   13   12   46   47   48                                       
CONECT   14   12   12   15   49                                       
CONECT   15   14   16   16   50                                       
CONECT   16   15   15   17   51                                       
CONECT   17   11   11   16   18                                       
CONECT   18   17   19   19                                            
CONECT   19    8   18   18   20                                       
CONECT   20   19   21   52   53                                       
CONECT   21   20   22   23                                            
CONECT   22   21   30   30                                            
CONECT   23   21   24   29   29                                       
CONECT   24   23   25   25                                            
CONECT   25   24   24   26   54                                       
CONECT   26   25   27   27                                            
CONECT   27   26   26   28   29                                       
CONECT   28   27   55   56                                            
CONECT   29   23   23   27   30                                       
CONECT   30   22   22   29   31                                       
CONECT   31   30   32   38   38                                       
CONECT   32   31   33   33   57                                       
CONECT   33   32   32   34   35                                       
CONECT   34   33                                                      
CONECT   35   33   36   37   37                                       
CONECT   36   35   59                                                 
CONECT   37   35   35   38   60                                       
CONECT   38   31   31   37   58                                       
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   25                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   32                                                      
CONECT   58   38                                                      
CONECT   59   36                                                      
CONECT   60   37                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
