COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.778   0.657   0.723  1.00  0.00           N  
HETATM    2  C   UNL     1       4.491  -0.643   0.932  1.00  0.00           C  
HETATM    3  O   UNL     1       5.260  -1.342   1.570  1.00  0.00           O  
HETATM    4  C   UNL     1       3.921   1.443   0.017  1.00  0.00           C  
HETATM    5  C   UNL     1       1.196  -0.956  -0.852  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.068  -0.416  -0.729  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.366  -1.041  -1.492  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.062  -1.613  -0.254  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.577  -1.441  -0.399  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.748   0.646   0.117  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.443  -0.058   1.254  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.185   0.650  -1.766  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.674   0.454  -1.606  1.00  0.00           C  
HETATM   14  C   UNL     1       1.071  -2.142  -1.609  1.00  0.00           C  
HETATM   15  C   UNL     1       4.481   2.718  -0.032  1.00  0.00           C  
HETATM   16  C   UNL     1       3.922   3.869  -0.674  1.00  0.00           C  
HETATM   17  C   UNL     1       5.704   2.660   0.673  1.00  0.00           C  
HETATM   18  C   UNL     1       3.309  -1.194   0.418  1.00  0.00           C  
HETATM   19  C   UNL     1       2.984  -2.647   0.650  1.00  0.00           C  
HETATM   20  C   UNL     1       4.049  -3.521  -0.015  1.00  0.00           C  
HETATM   21  C   UNL     1       2.958  -2.930   2.154  1.00  0.00           C  
HETATM   22  C   UNL     1       2.445  -0.396  -0.302  1.00  0.00           C  
HETATM   23  N   UNL     1       2.754   0.928  -0.494  1.00  0.00           N  
HETATM   24  N   UNL     1       3.478   4.783  -1.183  1.00  0.00           N  
HETATM   25  N   UNL     1       5.867   1.445   1.117  1.00  0.00           N  
HETATM   26  N   UNL     1      -0.919  -1.234  -1.372  1.00  0.00           N  
HETATM   27  N   UNL     1      -4.869  -0.023  -0.654  1.00  0.00           N  
HETATM   28  N   UNL     1      -0.188  -2.299  -1.910  1.00  0.00           N  
HETATM   29  O   UNL     1      -5.981   1.816  -0.104  1.00  0.00           O  
HETATM   30 CL   UNL     1      -7.548   1.094   2.091  1.00  0.00          Cl  
HETATM   31  H   UNL     1      -0.326   0.496  -0.211  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.729  -1.555  -2.382  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.823  -2.672  -0.160  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.718  -1.083   0.634  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.935  -2.044  -1.233  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.070  -1.758   0.520  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.020  -0.897   0.864  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.699  -0.427   1.961  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.419   1.714  -1.749  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.511   0.217  -2.712  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.334   0.965  -0.706  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.159   0.866  -2.475  1.00  0.00           H  
HETATM   43  H   UNL     1       1.878  -2.804  -1.888  1.00  0.00           H  
HETATM   44  H   UNL     1       6.386   3.484   0.822  1.00  0.00           H  
HETATM   45  H   UNL     1       2.008  -2.874   0.221  1.00  0.00           H  
HETATM   46  H   UNL     1       3.814  -4.572   0.153  1.00  0.00           H  
HETATM   47  H   UNL     1       4.067  -3.319  -1.086  1.00  0.00           H  
HETATM   48  H   UNL     1       5.025  -3.293   0.414  1.00  0.00           H  
HETATM   49  H   UNL     1       2.199  -2.307   2.628  1.00  0.00           H  
HETATM   50  H   UNL     1       2.723  -3.981   2.322  1.00  0.00           H  
HETATM   51  H   UNL     1       3.934  -2.703   2.583  1.00  0.00           H  
HETATM   52  H   UNL     1       2.150   1.500  -0.993  1.00  0.00           H  
CONECT    1    4    2   25                                            
CONECT    2   18    1    3    3                                       
CONECT    3    2    2                                                 
CONECT    4   23   15   15    1                                       
CONECT    5   14    6    6   22                                       
CONECT    6   26    5    5   31                                       
CONECT    7   13   26    8   32                                       
CONECT    8    7    9   33   34                                       
CONECT    9   27    8   35   36                                       
CONECT   10   11   27   29   29                                       
CONECT   11   10   30   37   38                                       
CONECT   12   13   27   39   40                                       
CONECT   13   12    7   41   42                                       
CONECT   14   28   28    5   43                                       
CONECT   15   16    4    4   17                                       
CONECT   16   24   24   24   15                                       
CONECT   17   15   25   25   44                                       
CONECT   18   22   22   19    2                                       
CONECT   19   21   18   20   45                                       
CONECT   20   19   46   47   48                                       
CONECT   21   19   49   50   51                                       
CONECT   22    5   23   18   18                                       
CONECT   23   22    4   52                                            
CONECT   24   16   16   16                                            
CONECT   25    1   17   17                                            
CONECT   26    7   28    6                                            
CONECT   27   12   10    9                                            
CONECT   28   26   14   14                                            
CONECT   29   10   10                                                 
CONECT   30   11                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   17                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   23                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
