COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.164   2.863   0.121  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.930  -1.938   0.037  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.573  -0.098   1.487  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.943   0.078   0.884  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.832  -0.981   0.867  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.089  -0.820   0.314  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.457   0.401  -0.223  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.568   1.460  -0.206  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.312   1.299   0.353  1.00  0.00           C  
HETATM   10  C   UNL     1       1.593  -2.583  -1.966  1.00  0.00           C  
HETATM   11  C   UNL     1       2.343  -0.425  -1.728  1.00  0.00           C  
HETATM   12  C   UNL     1       2.490   1.006  -1.407  1.00  0.00           C  
HETATM   13  C   UNL     1       3.978   1.355  -1.464  1.00  0.00           C  
HETATM   14  C   UNL     1       4.695   0.684  -0.321  1.00  0.00           C  
HETATM   15  C   UNL     1       5.142  -0.618  -0.455  1.00  0.00           C  
HETATM   16  C   UNL     1       5.800  -1.234   0.594  1.00  0.00           C  
HETATM   17  C   UNL     1       1.394   0.797   0.830  1.00  0.00           C  
HETATM   18  C   UNL     1       6.011  -0.548   1.776  1.00  0.00           C  
HETATM   19  C   UNL     1       5.564   0.753   1.909  1.00  0.00           C  
HETATM   20  C   UNL     1       4.912   1.371   0.858  1.00  0.00           C  
HETATM   21  C   UNL     1       0.750  -0.511   0.940  1.00  0.00           C  
HETATM   22  C   UNL     1       1.470  -1.680   0.272  1.00  0.00           C  
HETATM   23  C   UNL     1       0.351  -2.766   0.278  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.636  -0.549   0.450  1.00  0.00           N  
HETATM   25  N   UNL     1       1.983   1.432  -0.137  1.00  0.00           N  
HETATM   26  N   UNL     1       1.841  -1.432  -1.094  1.00  0.00           N  
HETATM   27  O   UNL     1       2.787  -0.719  -2.817  1.00  0.00           O  
HETATM   28  O   UNL     1       1.372   1.426   1.867  1.00  0.00           O  
HETATM   29 CL   UNL     1      -6.205  -2.150   0.292  1.00  0.00          Cl  
HETATM   30 CL   UNL     1      -5.029   2.992  -0.879  1.00  0.00          Cl  
HETATM   31  H   UNL     1       1.334   3.419  -0.313  1.00  0.00           H  
HETATM   32  H   UNL     1       2.195   3.037   1.197  1.00  0.00           H  
HETATM   33  H   UNL     1       3.100   3.197  -0.327  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.195  -1.963  -1.020  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.749  -2.338   0.636  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.232   0.852   1.897  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.619  -0.841   2.283  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.544  -1.934   1.286  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.438   0.525  -0.659  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.618   2.126   0.366  1.00  0.00           H  
HETATM   41  H   UNL     1       0.521  -2.770  -2.024  1.00  0.00           H  
HETATM   42  H   UNL     1       1.980  -2.373  -2.963  1.00  0.00           H  
HETATM   43  H   UNL     1       2.093  -3.461  -1.558  1.00  0.00           H  
HETATM   44  H   UNL     1       1.981   1.579  -2.182  1.00  0.00           H  
HETATM   45  H   UNL     1       4.396   1.008  -2.409  1.00  0.00           H  
HETATM   46  H   UNL     1       4.102   2.435  -1.386  1.00  0.00           H  
HETATM   47  H   UNL     1       4.977  -1.154  -1.378  1.00  0.00           H  
HETATM   48  H   UNL     1       6.148  -2.251   0.490  1.00  0.00           H  
HETATM   49  H   UNL     1       6.524  -1.030   2.595  1.00  0.00           H  
HETATM   50  H   UNL     1       5.733   1.290   2.830  1.00  0.00           H  
HETATM   51  H   UNL     1       4.563   2.388   0.962  1.00  0.00           H  
HETATM   52  H   UNL     1       0.696  -0.748   2.002  1.00  0.00           H  
HETATM   53  H   UNL     1       2.335  -1.991   0.858  1.00  0.00           H  
HETATM   54  H   UNL     1       0.309  -3.271   1.244  1.00  0.00           H  
HETATM   55  H   UNL     1       0.505  -3.483  -0.527  1.00  0.00           H  
CONECT    1   25   31   32   33                                       
CONECT    2   24   23   34   35                                       
CONECT    3    4   24   36   37                                       
CONECT    4    9    9    5    3                                       
CONECT    5    6    6    4   38                                       
CONECT    6    7   29    5    5                                       
CONECT    7    8    8    6   39                                       
CONECT    8   30    7    7    9                                       
CONECT    9    8    4    4   40                                       
CONECT   10   26   41   42   43                                       
CONECT   11   12   26   27   27                                       
CONECT   12   25   13   11   44                                       
CONECT   13   14   12   45   46                                       
CONECT   14   20   13   15   15                                       
CONECT   15   14   14   16   47                                       
CONECT   16   18   18   15   48                                       
CONECT   17   21   28   28   25                                       
CONECT   18   19   16   16   49                                       
CONECT   19   20   20   18   50                                       
CONECT   20   19   19   14   51                                       
CONECT   21   24   22   17   52                                       
CONECT   22   23   21   26   53                                       
CONECT   23    2   22   54   55                                       
CONECT   24    3    2   21                                            
CONECT   25   17   12    1                                            
CONECT   26   22   11   10                                            
CONECT   27   11   11                                                 
CONECT   28   17   17                                                 
CONECT   29    6                                                      
CONECT   30    8                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
