COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.250  -0.137  -0.270  1.00  0.00           O  
HETATM    2  C   UNL     1       3.082   0.667   0.104  1.00  0.00           C  
HETATM    3  N   UNL     1       4.357   0.275   0.299  1.00  0.00           N  
HETATM    4  C   UNL     1       4.740  -1.119   0.061  1.00  0.00           C  
HETATM    5  C   UNL     1       6.231  -1.296   0.355  1.00  0.00           C  
HETATM    6  C   UNL     1       6.630  -2.752   0.106  1.00  0.00           C  
HETATM    7  C   UNL     1       6.352  -3.115  -1.354  1.00  0.00           C  
HETATM    8  C   UNL     1       8.121  -2.929   0.400  1.00  0.00           C  
HETATM    9  C   UNL     1       5.817  -3.668   1.023  1.00  0.00           C  
HETATM   10  N   UNL     1       2.731   1.951   0.318  1.00  0.00           N  
HETATM   11  C   UNL     1       1.431   2.380   0.022  1.00  0.00           C  
HETATM   12  C   UNL     1       0.359   1.522   0.208  1.00  0.00           C  
HETATM   13  C   UNL     1       1.215   3.670  -0.452  1.00  0.00           C  
HETATM   14  F   UNL     1       2.260   4.508  -0.628  1.00  0.00           F  
HETATM   15  C   UNL     1      -0.068   4.097  -0.745  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.140   3.245  -0.567  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.536   3.714  -0.888  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.932   1.953  -0.087  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.084   1.039   0.110  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.249  -0.068  -0.714  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.354  -0.898  -0.482  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.605  -2.041  -1.264  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.012   1.282   1.133  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.824   2.482   2.025  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.040   0.493   1.332  1.00  0.00           N  
HETATM   26  C   UNL     1      -4.253  -0.582   0.570  1.00  0.00           C  
HETATM   27  N   UNL     1      -5.303  -1.388   0.774  1.00  0.00           N  
HETATM   28  C   UNL     1      -5.489  -2.447   0.010  1.00  0.00           C  
HETATM   29  N   UNL     1      -4.665  -2.771  -0.985  1.00  0.00           N  
HETATM   30  N   UNL     1      -6.584  -3.253   0.252  1.00  0.00           N  
HETATM   31  C   UNL     1      -6.820  -4.437  -0.578  1.00  0.00           C  
HETATM   32  H   UNL     1       5.021   0.916   0.597  1.00  0.00           H  
HETATM   33  H   UNL     1       4.161  -1.771   0.714  1.00  0.00           H  
HETATM   34  H   UNL     1       4.541  -1.377  -0.979  1.00  0.00           H  
HETATM   35  H   UNL     1       6.810  -0.643  -0.299  1.00  0.00           H  
HETATM   36  H   UNL     1       6.429  -1.037   1.395  1.00  0.00           H  
HETATM   37  H   UNL     1       6.931  -2.462  -2.007  1.00  0.00           H  
HETATM   38  H   UNL     1       6.636  -4.152  -1.531  1.00  0.00           H  
HETATM   39  H   UNL     1       5.289  -2.988  -1.564  1.00  0.00           H  
HETATM   40  H   UNL     1       8.700  -2.276  -0.254  1.00  0.00           H  
HETATM   41  H   UNL     1       8.320  -2.670   1.440  1.00  0.00           H  
HETATM   42  H   UNL     1       8.406  -3.966   0.223  1.00  0.00           H  
HETATM   43  H   UNL     1       6.102  -4.705   0.846  1.00  0.00           H  
HETATM   44  H   UNL     1       6.016  -3.409   2.063  1.00  0.00           H  
HETATM   45  H   UNL     1       4.755  -3.541   0.814  1.00  0.00           H  
HETATM   46  H   UNL     1       3.379   2.577   0.676  1.00  0.00           H  
HETATM   47  H   UNL     1       0.524   0.522   0.579  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.232   5.099  -1.113  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.797   3.412  -1.902  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.240   3.268  -0.184  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.582   4.800  -0.809  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.547  -0.281  -1.507  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.944  -2.313  -2.073  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.413   3.315   1.643  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.152   2.238   3.036  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.770   2.760   2.043  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.197  -3.036   0.972  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.941  -4.134  -1.618  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.970  -5.115  -0.494  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.723  -4.945  -0.240  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   10                                       
CONECT    3    4    2   32                                            
CONECT    4    5    3   33   34                                       
CONECT    5    6    4   35   36                                       
CONECT    6    9    8    7    5                                       
CONECT    7    6   37   38   39                                       
CONECT    8    6   40   41   42                                       
CONECT    9    6   43   44   45                                       
CONECT   10    2   11   46                                            
CONECT   11   10   12   12   13                                       
CONECT   12   11   11   18   47                                       
CONECT   13   11   14   15   15                                       
CONECT   14   13                                                      
CONECT   15   13   13   16   48                                       
CONECT   16   18   18   15   17                                       
CONECT   17   16   49   50   51                                       
CONECT   18   12   19   16   16                                       
CONECT   19   18   23   23   20                                       
CONECT   20   19   21   21   52                                       
CONECT   21   20   20   26   22                                       
CONECT   22   21   29   29   53                                       
CONECT   23   24   19   19   25                                       
CONECT   24   23   54   55   56                                       
CONECT   25   23   26   26                                            
CONECT   26   25   25   21   27                                       
CONECT   27   26   28   28                                            
CONECT   28   27   27   29   30                                       
CONECT   29   22   22   28                                            
CONECT   30   28   31   57                                            
CONECT   31   30   58   59   60                                       
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   12                                                      
CONECT   48   15                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   20                                                      
CONECT   53   22                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   30                                                      
CONECT   58   31                                                      
CONECT   59   31                                                      
CONECT   60   31                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
