COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.288   2.702  -1.422  1.00  0.00           C  
HETATM    2  O   UNL     1       1.178   1.898  -0.646  1.00  0.00           O  
HETATM    3  C   UNL     1      -0.969   1.895  -1.754  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.699   1.592  -0.516  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.914   0.817  -0.797  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.645   0.521   0.514  1.00  0.00           C  
HETATM    7  F   UNL     1      -2.807  -0.214   1.360  1.00  0.00           F  
HETATM    8  F   UNL     1      -3.993   1.725   1.136  1.00  0.00           F  
HETATM    9  N   UNL     1       3.544   3.077   1.757  1.00  0.00           N  
HETATM   10  C   UNL     1      -4.892  -0.274   0.226  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.842  -1.656   0.211  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.985  -2.386  -0.054  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.180  -1.734  -0.304  1.00  0.00           C  
HETATM   14  F   UNL     1      -8.298  -2.447  -0.562  1.00  0.00           F  
HETATM   15  C   UNL     1      -7.229  -0.350  -0.288  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.086   0.378  -0.018  1.00  0.00           C  
HETATM   17  N   UNL     1       5.216  -0.679  -1.003  1.00  0.00           N  
HETATM   18  C   UNL     1       2.229   3.256   1.089  1.00  0.00           C  
HETATM   19  C   UNL     1       4.151  -0.860  -0.245  1.00  0.00           C  
HETATM   20  C   UNL     1       2.390   2.561  -0.280  1.00  0.00           C  
HETATM   21  C   UNL     1       4.072  -1.931   0.622  1.00  0.00           C  
HETATM   22  C   UNL     1       3.523   1.533  -0.077  1.00  0.00           C  
HETATM   23  C   UNL     1       5.131  -2.826   0.695  1.00  0.00           C  
HETATM   24  C   UNL     1       3.950   1.694   1.398  1.00  0.00           C  
HETATM   25  C   UNL     1       6.234  -2.611  -0.111  1.00  0.00           C  
HETATM   26  C   UNL     1       6.246  -1.510  -0.962  1.00  0.00           C  
HETATM   27  N   UNL     1       7.348  -1.282  -1.778  1.00  0.00           N  
HETATM   28  C   UNL     1       3.005   0.115  -0.328  1.00  0.00           C  
HETATM   29  C   UNL     1       5.080  -4.006   1.631  1.00  0.00           C  
HETATM   30  H   UNL     1       0.010   3.589  -0.853  1.00  0.00           H  
HETATM   31  H   UNL     1       0.781   3.003  -2.346  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.608   2.476  -2.420  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.684   0.965  -2.245  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.107   1.110   0.144  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.567   1.390  -1.455  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.643  -0.121  -1.281  1.00  0.00           H  
HETATM   37  H   UNL     1       3.458   3.180   2.757  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.909  -2.164   0.406  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.945  -3.465  -0.066  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.161   0.160  -0.483  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.125   1.457  -0.001  1.00  0.00           H  
HETATM   42  H   UNL     1       1.440   2.776   1.668  1.00  0.00           H  
HETATM   43  H   UNL     1       2.013   4.315   0.954  1.00  0.00           H  
HETATM   44  H   UNL     1       2.669   3.287  -1.043  1.00  0.00           H  
HETATM   45  H   UNL     1       3.196  -2.071   1.238  1.00  0.00           H  
HETATM   46  H   UNL     1       4.358   1.753  -0.741  1.00  0.00           H  
HETATM   47  H   UNL     1       5.029   1.577   1.496  1.00  0.00           H  
HETATM   48  H   UNL     1       3.430   0.970   2.026  1.00  0.00           H  
HETATM   49  H   UNL     1       7.076  -3.287  -0.079  1.00  0.00           H  
HETATM   50  H   UNL     1       8.105  -1.888  -1.752  1.00  0.00           H  
HETATM   51  H   UNL     1       7.360  -0.516  -2.373  1.00  0.00           H  
HETATM   52  H   UNL     1       2.555   0.063  -1.320  1.00  0.00           H  
HETATM   53  H   UNL     1       2.257  -0.138   0.424  1.00  0.00           H  
HETATM   54  H   UNL     1       4.637  -4.859   1.117  1.00  0.00           H  
HETATM   55  H   UNL     1       6.090  -4.260   1.952  1.00  0.00           H  
HETATM   56  H   UNL     1       4.475  -3.753   2.501  1.00  0.00           H  
CONECT    1    2    3   30   31                                       
CONECT    2    1   20                                                 
CONECT    3    1    4   32   33                                       
CONECT    4    3    5   34                                            
CONECT    5    4    6   35   36                                       
CONECT    6    5    8    7   10                                       
CONECT    7    6                                                      
CONECT    8    6                                                      
CONECT    9   24   18   37                                            
CONECT   10    6   16   16   11                                       
CONECT   11   10   12   12   38                                       
CONECT   12   11   11   13   39                                       
CONECT   13   12   15   15   14                                       
CONECT   14   13                                                      
CONECT   15   13   13   16   40                                       
CONECT   16   10   10   15   41                                       
CONECT   17   26   26   19                                            
CONECT   18    9   20   42   43                                       
CONECT   19   17   21   21   28                                       
CONECT   20    2   18   22   44                                       
CONECT   21   19   19   23   45                                       
CONECT   22   20   24   28   46                                       
CONECT   23   21   29   25   25                                       
CONECT   24    9   22   47   48                                       
CONECT   25   23   23   26   49                                       
CONECT   26   17   17   25   27                                       
CONECT   27   26   50   51                                            
CONECT   28   19   22   52   53                                       
CONECT   29   23   54   55   56                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
