COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.387   4.578   0.024  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.780   3.625   0.067  1.00  0.00           C  
HETATM    3  N   UNL     1      -2.029   3.980   0.154  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.816   2.875   0.169  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.198   2.672   0.247  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.668   1.386   0.238  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.768   0.322   0.152  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.282  -1.069   0.141  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.656  -1.328   0.211  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.096  -2.634   0.199  1.00  0.00           C  
HETATM   11  N   UNL     1      -5.242  -3.638   0.123  1.00  0.00           N  
HETATM   12  C   UNL     1      -3.934  -3.441   0.056  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.077  -4.533  -0.022  1.00  0.00           N  
HETATM   14  C   UNL     1      -3.410  -2.154   0.056  1.00  0.00           C  
HETATM   15  N   UNL     1      -2.462   0.534   0.078  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.962   1.758   0.084  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.681   2.267   0.015  1.00  0.00           N  
HETATM   18  C   UNL     1       0.504   1.523  -0.086  1.00  0.00           C  
HETATM   19  C   UNL     1       1.430   1.549   0.947  1.00  0.00           C  
HETATM   20  C   UNL     1       2.598   0.817   0.849  1.00  0.00           C  
HETATM   21  C   UNL     1       2.846   0.055  -0.285  1.00  0.00           C  
HETATM   22  N   UNL     1       4.032  -0.682  -0.387  1.00  0.00           N  
HETATM   23  C   UNL     1       4.134  -1.669   0.697  1.00  0.00           C  
HETATM   24  C   UNL     1       5.401  -2.505   0.505  1.00  0.00           C  
HETATM   25  N   UNL     1       6.573  -1.618   0.491  1.00  0.00           N  
HETATM   26  C   UNL     1       6.747  -0.956   1.791  1.00  0.00           C  
HETATM   27  C   UNL     1       6.471  -0.632  -0.593  1.00  0.00           C  
HETATM   28  C   UNL     1       5.203   0.205  -0.401  1.00  0.00           C  
HETATM   29  C   UNL     1       1.918   0.029  -1.321  1.00  0.00           C  
HETATM   30  F   UNL     1       2.159  -0.713  -2.424  1.00  0.00           F  
HETATM   31  C   UNL     1       0.748   0.757  -1.218  1.00  0.00           C  
HETATM   32  H   UNL     1       0.731   4.777   1.039  1.00  0.00           H  
HETATM   33  H   UNL     1       1.198   4.134  -0.554  1.00  0.00           H  
HETATM   34  H   UNL     1       0.076   5.512  -0.444  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.877   3.509   0.313  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.730   1.195   0.297  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.363  -0.513   0.274  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.155  -2.839   0.253  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.438  -5.433  -0.027  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.119  -4.394  -0.072  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.343  -1.997  -0.004  1.00  0.00           H  
HETATM   42  H   UNL     1       1.238   2.142   1.829  1.00  0.00           H  
HETATM   43  H   UNL     1       3.318   0.838   1.653  1.00  0.00           H  
HETATM   44  H   UNL     1       4.182  -1.152   1.656  1.00  0.00           H  
HETATM   45  H   UNL     1       3.261  -2.321   0.679  1.00  0.00           H  
HETATM   46  H   UNL     1       5.494  -3.218   1.324  1.00  0.00           H  
HETATM   47  H   UNL     1       5.341  -3.043  -0.441  1.00  0.00           H  
HETATM   48  H   UNL     1       5.892  -0.309   1.986  1.00  0.00           H  
HETATM   49  H   UNL     1       6.820  -1.709   2.575  1.00  0.00           H  
HETATM   50  H   UNL     1       7.658  -0.358   1.775  1.00  0.00           H  
HETATM   51  H   UNL     1       7.344   0.021  -0.575  1.00  0.00           H  
HETATM   52  H   UNL     1       6.423  -1.149  -1.552  1.00  0.00           H  
HETATM   53  H   UNL     1       5.110   0.918  -1.220  1.00  0.00           H  
HETATM   54  H   UNL     1       5.263   0.743   0.545  1.00  0.00           H  
HETATM   55  H   UNL     1       0.027   0.737  -2.022  1.00  0.00           H  
CONECT    1    2   32   33   34                                       
CONECT    2    1   17    3    3                                       
CONECT    3    2    2    4                                            
CONECT    4   16    3    5    5                                       
CONECT    5    4    4    6   35                                       
CONECT    6    7    7    5   36                                       
CONECT    7   15    8    6    6                                       
CONECT    8    9    7   14   14                                       
CONECT    9   10   10    8   37                                       
CONECT   10    9    9   11   38                                       
CONECT   11   10   12   12                                            
CONECT   12   11   11   14   13                                       
CONECT   13   12   39   40                                            
CONECT   14    8    8   12   41                                       
CONECT   15   16   16    7                                            
CONECT   16   17   15   15    4                                       
CONECT   17   18    2   16                                            
CONECT   18   31   31   19   17                                       
CONECT   19   20   20   18   42                                       
CONECT   20   21   19   19   43                                       
CONECT   21   22   29   29   20                                       
CONECT   22   28   23   21                                            
CONECT   23   24   22   44   45                                       
CONECT   24   25   23   46   47                                       
CONECT   25   26   27   24                                            
CONECT   26   25   48   49   50                                       
CONECT   27   25   28   51   52                                       
CONECT   28   27   22   53   54                                       
CONECT   29   30   21   21   31                                       
CONECT   30   29                                                      
CONECT   31   29   18   18   55                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
