COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.263  -1.589   1.629  1.00  0.00           C  
HETATM    2  C   UNL     1       0.883  -2.880   1.935  1.00  0.00           C  
HETATM    3  C   UNL     1       1.483  -3.951   1.298  1.00  0.00           C  
HETATM    4  C   UNL     1       2.468  -3.737   0.350  1.00  0.00           C  
HETATM    5  C   UNL     1       2.857  -2.451   0.034  1.00  0.00           C  
HETATM    6  C   UNL     1       2.250  -1.365   0.669  1.00  0.00           C  
HETATM    7  C   UNL     1       2.662   0.016   0.335  1.00  0.00           C  
HETATM    8 CL   UNL     1       4.093  -2.183  -1.155  1.00  0.00          Cl  
HETATM    9  N   UNL     1       3.877   0.401   0.016  1.00  0.00           N  
HETATM   10  C   UNL     1       3.875   1.718  -0.222  1.00  0.00           C  
HETATM   11  C   UNL     1       2.620   2.179  -0.048  1.00  0.00           C  
HETATM   12  N   UNL     1       1.843   1.107   0.301  1.00  0.00           N  
HETATM   13  C   UNL     1       5.071   2.544  -0.617  1.00  0.00           C  
HETATM   14  C   UNL     1       2.159   3.605  -0.210  1.00  0.00           C  
HETATM   15  N   UNL     1       0.470   1.128   0.577  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.360   0.285  -0.069  1.00  0.00           C  
HETATM   17  C   UNL     1       1.003   3.655  -1.211  1.00  0.00           C  
HETATM   18  C   UNL     1       1.688   4.146   1.141  1.00  0.00           C  
HETATM   19  O   UNL     1       0.093  -0.564  -0.812  1.00  0.00           O  
HETATM   20  C   UNL     1      -1.819   0.393   0.125  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.336   1.281   1.072  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.698   1.378   1.252  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.563   0.597   0.494  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.054  -0.289  -0.452  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.688  -0.388  -0.641  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.136  -1.343  -1.668  1.00  0.00           C  
HETATM   27  O   UNL     1      -5.904   0.707   0.692  1.00  0.00           O  
HETATM   28  C   UNL     1      -6.751   0.190  -0.339  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.233  -1.200  -0.735  1.00  0.00           C  
HETATM   30  O   UNL     1      -4.888  -1.058  -1.205  1.00  0.00           O  
HETATM   31  H   UNL     1       0.793  -0.754   2.127  1.00  0.00           H  
HETATM   32  H   UNL     1       0.115  -3.054   2.675  1.00  0.00           H  
HETATM   33  H   UNL     1       1.182  -4.959   1.542  1.00  0.00           H  
HETATM   34  H   UNL     1       2.933  -4.578  -0.143  1.00  0.00           H  
HETATM   35  H   UNL     1       5.104   2.641  -1.702  1.00  0.00           H  
HETATM   36  H   UNL     1       4.995   3.533  -0.166  1.00  0.00           H  
HETATM   37  H   UNL     1       5.982   2.056  -0.269  1.00  0.00           H  
HETATM   38  H   UNL     1       2.984   4.214  -0.578  1.00  0.00           H  
HETATM   39  H   UNL     1       0.116   1.748   1.233  1.00  0.00           H  
HETATM   40  H   UNL     1       0.142   3.127  -0.800  1.00  0.00           H  
HETATM   41  H   UNL     1       0.733   4.694  -1.403  1.00  0.00           H  
HETATM   42  H   UNL     1       1.308   3.181  -2.144  1.00  0.00           H  
HETATM   43  H   UNL     1       1.354   5.177   1.023  1.00  0.00           H  
HETATM   44  H   UNL     1       0.862   3.536   1.509  1.00  0.00           H  
HETATM   45  H   UNL     1       2.512   4.110   1.854  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.668   1.890   1.663  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.096   2.065   1.985  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.856  -2.278  -1.181  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.894  -1.540  -2.425  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.257  -0.902  -2.139  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.773   0.108   0.032  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.726   0.852  -1.204  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.251  -1.860   0.132  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.858  -1.614  -1.526  1.00  0.00           H  
CONECT    1    6    6    2   31                                       
CONECT    2    1    3    3   32                                       
CONECT    3    2    2    4   33                                       
CONECT    4    3    5    5   34                                       
CONECT    5    4    4    6    8                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6    9    9   12                                       
CONECT    8    5                                                      
CONECT    9    7    7   10                                            
CONECT   10    9   13   11   11                                       
CONECT   11   10   10   14   12                                       
CONECT   12    7   11   15                                            
CONECT   13   10   35   36   37                                       
CONECT   14   11   17   18   38                                       
CONECT   15   12   16   39                                            
CONECT   16   15   19   19   20                                       
CONECT   17   14   40   41   42                                       
CONECT   18   14   43   44   45                                       
CONECT   19   16   16                                                 
CONECT   20   16   25   25   21                                       
CONECT   21   20   22   22   46                                       
CONECT   22   21   21   23   47                                       
CONECT   23   22   24   24   27                                       
CONECT   24   23   23   25   30                                       
CONECT   25   20   20   24   26                                       
CONECT   26   25   48   49   50                                       
CONECT   27   23   28                                                 
CONECT   28   27   29   51   52                                       
CONECT   29   28   30   53   54                                       
CONECT   30   24   29                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
