COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.654   1.037  -0.541  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.792   0.890  -0.139  1.00  0.00           C  
HETATM    3  N   UNL     1      -4.620   1.950  -0.054  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.148   3.280  -0.447  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.258   4.282  -0.259  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.061   5.347   0.479  1.00  0.00           C  
HETATM    7  N   UNL     1      -4.227  -0.335   0.217  1.00  0.00           N  
HETATM    8  C   UNL     1      -3.407  -1.453   0.025  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.036  -1.342   0.193  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.968  -2.674  -0.328  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.162  -3.781  -0.518  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.794  -3.680  -0.358  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.920  -4.890  -0.566  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.222  -2.459   0.002  1.00  0.00           C  
HETATM   15  C   UNL     1       0.242  -2.350   0.180  1.00  0.00           C  
HETATM   16  O   UNL     1       0.942  -3.338   0.077  1.00  0.00           O  
HETATM   17  N   UNL     1       0.800  -1.155   0.456  1.00  0.00           N  
HETATM   18  C   UNL     1       2.250  -1.046   0.632  1.00  0.00           C  
HETATM   19  C   UNL     1       2.625  -1.482   2.049  1.00  0.00           C  
HETATM   20  C   UNL     1       2.677   0.383   0.416  1.00  0.00           C  
HETATM   21  C   UNL     1       3.977   0.671  -0.034  1.00  0.00           C  
HETATM   22  C   UNL     1       4.905  -0.353  -0.287  1.00  0.00           C  
HETATM   23  C   UNL     1       6.155  -0.035  -0.723  1.00  0.00           C  
HETATM   24  C   UNL     1       6.530   1.292  -0.922  1.00  0.00           C  
HETATM   25  C   UNL     1       5.658   2.310  -0.687  1.00  0.00           C  
HETATM   26  C   UNL     1       4.358   2.021  -0.237  1.00  0.00           C  
HETATM   27  C   UNL     1       3.429   3.045   0.016  1.00  0.00           C  
HETATM   28  C   UNL     1       2.179   2.727   0.451  1.00  0.00           C  
HETATM   29  C   UNL     1       1.804   1.401   0.650  1.00  0.00           C  
HETATM   30  H   UNL     1      -5.527   1.832   0.266  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.296   3.561   0.173  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.846   3.265  -1.494  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.215   4.123  -0.733  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.857   6.065   0.614  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.104   5.506   0.953  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.110  -0.442   0.605  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.598  -0.395   0.471  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.037  -2.759  -0.454  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.603  -4.728  -0.792  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.504  -4.869  -1.573  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.109  -4.882   0.162  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.515  -5.795  -0.438  1.00  0.00           H  
HETATM   43  H   UNL     1       0.241  -0.366   0.538  1.00  0.00           H  
HETATM   44  H   UNL     1       2.753  -1.689  -0.091  1.00  0.00           H  
HETATM   45  H   UNL     1       2.123  -0.839   2.772  1.00  0.00           H  
HETATM   46  H   UNL     1       2.317  -2.516   2.206  1.00  0.00           H  
HETATM   47  H   UNL     1       3.705  -1.401   2.181  1.00  0.00           H  
HETATM   48  H   UNL     1       4.629  -1.386  -0.137  1.00  0.00           H  
HETATM   49  H   UNL     1       6.867  -0.824  -0.916  1.00  0.00           H  
HETATM   50  H   UNL     1       7.529   1.517  -1.268  1.00  0.00           H  
HETATM   51  H   UNL     1       5.962   3.334  -0.846  1.00  0.00           H  
HETATM   52  H   UNL     1       3.706   4.078  -0.134  1.00  0.00           H  
HETATM   53  H   UNL     1       1.467   3.516   0.644  1.00  0.00           H  
HETATM   54  H   UNL     1       0.804   1.176   0.991  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1    7                                       
CONECT    3    4    2   30                                            
CONECT    4    3    5   31   32                                       
CONECT    5    4    6    6   33                                       
CONECT    6    5    5   34   35                                       
CONECT    7    2    8   36                                            
CONECT    8    7    9    9   10                                       
CONECT    9    8    8   14   37                                       
CONECT   10    8   11   11   38                                       
CONECT   11   10   10   12   39                                       
CONECT   12   14   14   11   13                                       
CONECT   13   12   40   41   42                                       
CONECT   14    9   15   12   12                                       
CONECT   15   16   16   14   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   43                                            
CONECT   18   20   17   19   44                                       
CONECT   19   18   45   46   47                                       
CONECT   20   21   21   29   18                                       
CONECT   21   26   22   20   20                                       
CONECT   22   23   23   21   48                                       
CONECT   23   24   22   22   49                                       
CONECT   24   25   25   23   50                                       
CONECT   25   24   24   26   51                                       
CONECT   26   25   27   27   21                                       
CONECT   27   26   26   28   52                                       
CONECT   28   27   29   29   53                                       
CONECT   29   28   28   20   54                                       
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
