COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.089   1.660   1.885  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.910   2.529   2.579  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.739   2.702   3.940  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.749   2.006   4.607  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.931   1.134   3.913  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.098   0.965   2.551  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.203   0.017   1.794  1.00  0.00           C  
HETATM    8  N   UNL     1       0.127   0.596   0.490  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.916  -1.295   1.595  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.557  -2.397   2.348  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.211  -3.601   2.165  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.223  -3.703   1.229  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.582  -2.601   0.477  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.931  -1.395   0.663  1.00  0.00           C  
HETATM   15  C   UNL     1       1.329   0.298  -0.109  1.00  0.00           C  
HETATM   16  N   UNL     1       2.182  -0.480   0.493  1.00  0.00           N  
HETATM   17  C   UNL     1       3.500  -0.719  -0.098  1.00  0.00           C  
HETATM   18  C   UNL     1       4.566  -0.143   0.797  1.00  0.00           C  
HETATM   19  O   UNL     1       4.256   0.410   1.825  1.00  0.00           O  
HETATM   20  O   UNL     1       5.860  -0.245   0.453  1.00  0.00           O  
HETATM   21  N   UNL     1       1.630   0.823  -1.346  1.00  0.00           N  
HETATM   22  C   UNL     1       0.737   0.667  -2.405  1.00  0.00           C  
HETATM   23  C   UNL     1       0.961   1.332  -3.606  1.00  0.00           C  
HETATM   24  C   UNL     1       0.082   1.180  -4.655  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.037   0.356  -4.511  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.954   0.196  -5.599  1.00  0.00           C  
HETATM   27  N   UNL     1      -2.682   0.069  -6.463  1.00  0.00           N  
HETATM   28  C   UNL     1      -1.260  -0.310  -3.303  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.373  -0.158  -2.261  1.00  0.00           C  
HETATM   30  H   UNL     1      -2.222   1.525   0.822  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.684   3.073   2.059  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.380   3.382   4.483  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.615   2.141   5.670  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.157   0.590   4.434  1.00  0.00           H  
HETATM   35  H   UNL     1       0.712  -0.148   2.361  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.500   1.189   0.049  1.00  0.00           H  
HETATM   37  H   UNL     1       0.233  -2.317   3.079  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.930  -4.462   2.753  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.733  -4.644   1.086  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.373  -2.680  -0.254  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.212  -0.534   0.075  1.00  0.00           H  
HETATM   42  H   UNL     1       3.551  -0.242  -1.077  1.00  0.00           H  
HETATM   43  H   UNL     1       3.660  -1.792  -0.209  1.00  0.00           H  
HETATM   44  H   UNL     1       6.543   0.124   1.028  1.00  0.00           H  
HETATM   45  H   UNL     1       2.463   1.301  -1.480  1.00  0.00           H  
HETATM   46  H   UNL     1       1.827   1.969  -3.716  1.00  0.00           H  
HETATM   47  H   UNL     1       0.257   1.698  -5.586  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.124  -0.948  -3.189  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.545  -0.673  -1.328  1.00  0.00           H  
CONECT    1    2    6    6   30                                       
CONECT    2    1    3    3   31                                       
CONECT    3    2    2    4   32                                       
CONECT    4    3    5    5   33                                       
CONECT    5    4    4    6   34                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6    8    9   35                                       
CONECT    8    7   15   36                                            
CONECT    9    7   10   10   14                                       
CONECT   10    9    9   11   37                                       
CONECT   11   10   12   12   38                                       
CONECT   12   11   11   13   39                                       
CONECT   13   12   14   14   40                                       
CONECT   14    9   13   13   41                                       
CONECT   15    8   16   16   21                                       
CONECT   16   15   15   17                                            
CONECT   17   16   18   42   43                                       
CONECT   18   17   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   44                                                 
CONECT   21   15   22   45                                            
CONECT   22   21   23   29   29                                       
CONECT   23   22   24   24   46                                       
CONECT   24   23   23   25   47                                       
CONECT   25   24   26   28   28                                       
CONECT   26   25   27   27   27                                       
CONECT   27   26   26   26                                            
CONECT   28   25   25   29   48                                       
CONECT   29   22   22   28   49                                       
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   28                                                      
CONECT   49   29                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
