COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.025   2.166  -0.738  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.243   2.789   0.237  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.123   2.151   0.733  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.772   0.897   0.267  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.544   0.271  -0.703  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.669   0.901  -1.207  1.00  0.00           C  
HETATM    7  O   UNL     1      -3.195  -0.962  -1.157  1.00  0.00           O  
HETATM    8  C   UNL     1      -6.190   2.822  -1.251  1.00  0.00           C  
HETATM    9 CL   UNL     1      -2.152   2.927   1.945  1.00  0.00          Cl  
HETATM   10  C   UNL     1      -2.026  -1.493  -0.721  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.796  -0.906  -1.077  1.00  0.00           C  
HETATM   12  C   UNL     1       0.360  -1.446  -0.636  1.00  0.00           C  
HETATM   13  N   UNL     1       0.359  -2.555   0.153  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.794  -3.147   0.516  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.023  -2.619   0.087  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.232  -3.227   0.467  1.00  0.00           N  
HETATM   17  O   UNL     1      -0.772  -4.142   1.225  1.00  0.00           O  
HETATM   18  C   UNL     1      -4.094  -3.841  -0.547  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.631  -3.246   1.876  1.00  0.00           C  
HETATM   20  C   UNL     1       1.671  -0.812  -1.023  1.00  0.00           C  
HETATM   21  N   UNL     1      -7.115   3.341  -1.658  1.00  0.00           N  
HETATM   22  C   UNL     1       2.112   0.133   0.065  1.00  0.00           C  
HETATM   23  O   UNL     1       1.429   0.277   1.057  1.00  0.00           O  
HETATM   24  N   UNL     1       3.265   0.818  -0.064  1.00  0.00           N  
HETATM   25  C   UNL     1       4.114   0.667  -1.250  1.00  0.00           C  
HETATM   26  C   UNL     1       5.024   1.209   1.560  1.00  0.00           C  
HETATM   27  C   UNL     1       3.721   1.754   0.978  1.00  0.00           C  
HETATM   28  C   UNL     1       5.973   0.797   0.458  1.00  0.00           C  
HETATM   29  C   UNL     1       5.557   0.544  -0.830  1.00  0.00           C  
HETATM   30  C   UNL     1       6.482   0.161  -1.793  1.00  0.00           C  
HETATM   31  C   UNL     1       7.818   0.040  -1.471  1.00  0.00           C  
HETATM   32  C   UNL     1       8.239   0.302  -0.181  1.00  0.00           C  
HETATM   33  C   UNL     1       7.321   0.678   0.777  1.00  0.00           C  
HETATM   34  H   UNL     1      -4.514   3.769   0.602  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.895   0.403   0.658  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.271   0.414  -1.961  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.778  -0.026  -1.703  1.00  0.00           H  
HETATM   38  H   UNL     1       1.202  -2.925   0.457  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.762  -4.862  -0.735  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.123  -3.854  -0.189  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.037  -3.264  -1.470  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.810  -2.226   2.217  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.543  -3.832   1.988  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.836  -3.694   2.473  1.00  0.00           H  
HETATM   45  H   UNL     1       2.424  -1.588  -1.157  1.00  0.00           H  
HETATM   46  H   UNL     1       1.547  -0.260  -1.955  1.00  0.00           H  
HETATM   47  H   UNL     1       3.818  -0.228  -1.797  1.00  0.00           H  
HETATM   48  H   UNL     1       3.997   1.539  -1.894  1.00  0.00           H  
HETATM   49  H   UNL     1       5.494   1.980   2.171  1.00  0.00           H  
HETATM   50  H   UNL     1       4.803   0.343   2.184  1.00  0.00           H  
HETATM   51  H   UNL     1       3.896   2.737   0.540  1.00  0.00           H  
HETATM   52  H   UNL     1       2.968   1.827   1.763  1.00  0.00           H  
HETATM   53  H   UNL     1       6.152  -0.043  -2.801  1.00  0.00           H  
HETATM   54  H   UNL     1       8.532  -0.259  -2.224  1.00  0.00           H  
HETATM   55  H   UNL     1       9.284   0.212   0.077  1.00  0.00           H  
HETATM   56  H   UNL     1       7.652   0.885   1.784  1.00  0.00           H  
CONECT    1    2    2    6    8                                       
CONECT    2    1    1    3   34                                       
CONECT    3    2    4    4    9                                       
CONECT    4    3    3    5   35                                       
CONECT    5    4    6    6    7                                       
CONECT    6    1    5    5   36                                       
CONECT    7    5   10                                                 
CONECT    8    1   21   21   21                                       
CONECT    9    3                                                      
CONECT   10    7   11   15   15                                       
CONECT   11   10   12   12   37                                       
CONECT   12   11   11   13   20                                       
CONECT   13   12   14   38                                            
CONECT   14   13   15   17   17                                       
CONECT   15   10   10   14   16                                       
CONECT   16   15   18   19                                            
CONECT   17   14   14                                                 
CONECT   18   16   39   40   41                                       
CONECT   19   16   42   43   44                                       
CONECT   20   12   22   45   46                                       
CONECT   21    8    8    8                                            
CONECT   22   20   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   27                                            
CONECT   25   24   29   47   48                                       
CONECT   26   27   28   49   50                                       
CONECT   27   24   26   51   52                                       
CONECT   28   26   29   29   33                                       
CONECT   29   25   28   28   30                                       
CONECT   30   29   31   31   53                                       
CONECT   31   30   30   32   54                                       
CONECT   32   31   33   33   55                                       
CONECT   33   28   32   32   56                                       
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   32                                                      
CONECT   56   33                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
