COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.277   2.122  -0.303  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.453  -3.578   0.356  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.486   0.775  -0.226  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.781   0.260  -0.043  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.864   1.102   0.062  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.674   2.492  -0.014  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.542   4.632   0.017  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.865  -1.588  -1.034  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.934  -3.117  -1.010  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.364   3.004  -0.193  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.283   5.200  -0.165  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.181   4.398  -0.269  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.709   3.333   0.086  1.00  0.00           N  
HETATM   14  N   UNL     1      -1.971  -1.120   0.033  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.531  -3.037   1.452  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.473  -1.511   1.357  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.871  -3.046   0.572  1.00  0.00           C  
HETATM   18  N   UNL     1      -5.778  -3.659  -0.408  1.00  0.00           N  
HETATM   19  N   UNL     1       0.600  -0.101  -0.331  1.00  0.00           N  
HETATM   20  C   UNL     1       1.839   0.319  -0.008  1.00  0.00           C  
HETATM   21  O   UNL     1       2.000   1.426   0.471  1.00  0.00           O  
HETATM   22  C   UNL     1       2.992  -0.558  -0.232  1.00  0.00           C  
HETATM   23  C   UNL     1       2.965  -1.853  -0.780  1.00  0.00           C  
HETATM   24  N   UNL     1       4.187  -2.316  -0.822  1.00  0.00           N  
HETATM   25  N   UNL     1       5.068  -1.358  -0.310  1.00  0.00           N  
HETATM   26  C   UNL     1       4.339  -0.261   0.053  1.00  0.00           C  
HETATM   27  N   UNL     1       4.934   0.814   0.572  1.00  0.00           N  
HETATM   28  C   UNL     1       6.238   0.847   0.743  1.00  0.00           C  
HETATM   29  C   UNL     1       7.021  -0.255   0.380  1.00  0.00           C  
HETATM   30  C   UNL     1       6.421  -1.356  -0.140  1.00  0.00           C  
HETATM   31  H   UNL     1       0.722   2.508  -0.444  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.463  -4.667   0.392  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.855   0.697   0.203  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.402   5.279   0.102  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.483  -1.257  -1.999  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.863  -1.177  -0.878  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.940  -3.529  -1.179  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.610  -3.463  -1.791  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.177   6.273  -0.219  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.198   4.821  -0.405  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.918  -3.326   2.429  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.530  -3.448   1.321  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.807  -1.124   2.127  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.473  -1.100   1.501  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.203  -3.295   1.580  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.876  -1.964   0.444  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.742  -4.666  -0.354  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.722  -3.324  -0.286  1.00  0.00           H  
HETATM   49  H   UNL     1       0.461  -1.011  -0.638  1.00  0.00           H  
HETATM   50  H   UNL     1       2.081  -2.378  -1.110  1.00  0.00           H  
HETATM   51  H   UNL     1       6.704   1.725   1.164  1.00  0.00           H  
HETATM   52  H   UNL     1       8.092  -0.232   0.518  1.00  0.00           H  
HETATM   53  H   UNL     1       7.009  -2.215  -0.427  1.00  0.00           H  
CONECT    1   10   10    3   31                                       
CONECT    2   17    9   15   32                                       
CONECT    3    4    4    1   19                                       
CONECT    4    5   14    3    3                                       
CONECT    5    6    6    4   33                                       
CONECT    6   13    5    5   10                                       
CONECT    7   13   13   11   34                                       
CONECT    8   14    9   35   36                                       
CONECT    9    8    2   37   38                                       
CONECT   10    6   12    1    1                                       
CONECT   11    7   12   12   39                                       
CONECT   12   11   11   10   40                                       
CONECT   13    7    7    6                                            
CONECT   14    8    4   16                                            
CONECT   15   16    2   41   42                                       
CONECT   16   14   15   43   44                                       
CONECT   17   18    2   45   46                                       
CONECT   18   17   47   48                                            
CONECT   19    3   20   49                                            
CONECT   20   19   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   26   26   23                                       
CONECT   23   22   24   24   50                                       
CONECT   24   23   23   25                                            
CONECT   25   26   24   30                                            
CONECT   26   27   22   22   25                                       
CONECT   27   26   28   28                                            
CONECT   28   27   27   29   51                                       
CONECT   29   28   30   30   52                                       
CONECT   30   25   29   29   53                                       
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   23                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
