COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.897   1.000   0.066  1.00  0.00           N  
HETATM    2  C   UNL     1      -4.395   0.376  -0.156  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.130  -0.138   0.114  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.006   0.646  -0.107  1.00  0.00           C  
HETATM    5  O   UNL     1     -10.431  -0.945  -0.009  1.00  0.00           O  
HETATM    6  C   UNL     1      -5.469  -1.753   0.574  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.849  -2.024   0.539  1.00  0.00           C  
HETATM    8  C   UNL     1      -9.342  -0.184  -0.230  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.995  -0.725   0.047  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.866   0.061  -0.181  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.602  -0.455   0.083  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.734   0.134   0.162  1.00  0.00           N  
HETATM   13  C   UNL     1      -6.591  -2.529   0.798  1.00  0.00           C  
HETATM   14  O   UNL     1      -9.467   0.946  -0.658  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.147   1.939  -0.596  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.404   2.447  -0.863  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.527   1.674  -0.646  1.00  0.00           C  
HETATM   18  C   UNL     1       0.452   0.962  -0.072  1.00  0.00           C  
HETATM   19  C   UNL     1       1.707   0.170   0.300  1.00  0.00           C  
HETATM   20  C   UNL     1       4.124   0.271   0.413  1.00  0.00           C  
HETATM   21  C   UNL     1       5.338   1.165   0.156  1.00  0.00           C  
HETATM   22  C   UNL     1       6.601   0.378   0.395  1.00  0.00           C  
HETATM   23  C   UNL     1       7.299  -0.148  -0.675  1.00  0.00           C  
HETATM   24  C   UNL     1       8.459  -0.871  -0.456  1.00  0.00           C  
HETATM   25  C   UNL     1       8.919  -1.066   0.834  1.00  0.00           C  
HETATM   26  C   UNL     1       8.219  -0.539   1.903  1.00  0.00           C  
HETATM   27  C   UNL     1       7.064   0.187   1.684  1.00  0.00           C  
HETATM   28  O   UNL     1       5.301   2.285   1.043  1.00  0.00           O  
HETATM   29 CL   UNL     1       9.337  -1.533  -1.800  1.00  0.00          Cl  
HETATM   30  H   UNL     1       2.837   1.869   0.574  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.023  -1.143   0.494  1.00  0.00           H  
HETATM   32  H   UNL     1     -11.291  -0.548  -0.205  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.488  -2.155   0.775  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.722  -2.635   0.716  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.973   1.066  -0.561  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.637  -0.768   0.503  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.482  -3.534   1.178  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.272   2.548  -0.767  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.508   3.453  -1.243  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.507   2.076  -0.852  1.00  0.00           H  
HETATM   41  H   UNL     1       0.498   1.242  -1.124  1.00  0.00           H  
HETATM   42  H   UNL     1       0.394   1.861   0.542  1.00  0.00           H  
HETATM   43  H   UNL     1       1.765  -0.729  -0.313  1.00  0.00           H  
HETATM   44  H   UNL     1       1.661  -0.110   1.352  1.00  0.00           H  
HETATM   45  H   UNL     1       4.095  -0.009   1.466  1.00  0.00           H  
HETATM   46  H   UNL     1       4.198  -0.628  -0.200  1.00  0.00           H  
HETATM   47  H   UNL     1       5.319   1.517  -0.875  1.00  0.00           H  
HETATM   48  H   UNL     1       6.940   0.004  -1.682  1.00  0.00           H  
HETATM   49  H   UNL     1       9.823  -1.630   1.006  1.00  0.00           H  
HETATM   50  H   UNL     1       8.580  -0.687   2.911  1.00  0.00           H  
HETATM   51  H   UNL     1       6.518   0.599   2.520  1.00  0.00           H  
HETATM   52  H   UNL     1       5.315   2.046   1.980  1.00  0.00           H  
CONECT    1   20   19   30                                            
CONECT    2    3    3   17   11                                       
CONECT    3    4    2    2   31                                       
CONECT    4   12   15   15    3                                       
CONECT    5    8   32                                                 
CONECT    6   11   11   13   33                                       
CONECT    7   13   13    9   34                                       
CONECT    8    9   14   14    5                                       
CONECT    9   10   10    7    8                                       
CONECT   10   11    9    9   35                                       
CONECT   11    2    6    6   10                                       
CONECT   12   18    4   36                                            
CONECT   13    6    7    7   37                                       
CONECT   14    8    8                                                 
CONECT   15    4    4   16   38                                       
CONECT   16   15   17   17   39                                       
CONECT   17   16   16    2   40                                       
CONECT   18   19   12   41   42                                       
CONECT   19    1   18   43   44                                       
CONECT   20   21    1   45   46                                       
CONECT   21   28   22   20   47                                       
CONECT   22   27   21   23   23                                       
CONECT   23   22   22   24   48                                       
CONECT   24   25   25   23   29                                       
CONECT   25   26   24   24   49                                       
CONECT   26   27   27   25   50                                       
CONECT   27   26   26   22   51                                       
CONECT   28   21   52                                                 
CONECT   29   24                                                      
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35   10                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   23                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
