COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.433  -4.013  -0.851  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.958  -4.085  -0.953  1.00  0.00           C  
HETATM    3  N   UNL     1      -6.558  -3.123  -0.020  1.00  0.00           N  
HETATM    4  C   UNL     1      -6.166  -1.747  -0.351  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.647  -1.605  -0.232  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.971  -2.593  -1.187  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.475  -2.500  -1.030  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.884  -2.758   0.191  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.575  -2.680   0.338  1.00  0.00           N  
HETATM   10  C   UNL     1       0.219  -2.353  -0.668  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.307  -2.080  -1.924  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.676  -2.160  -2.113  1.00  0.00           C  
HETATM   13  O   UNL     1       1.559  -2.284  -0.471  1.00  0.00           O  
HETATM   14  C   UNL     1       2.038  -2.576   0.844  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.243  -0.199  -0.593  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.486  -0.005  -1.520  1.00  0.00           O  
HETATM   17  N   UNL     1      -4.724   0.843   0.115  1.00  0.00           N  
HETATM   18  C   UNL     1       3.563  -2.447   0.871  1.00  0.00           C  
HETATM   19  O   UNL     1       3.931  -1.088   0.628  1.00  0.00           O  
HETATM   20  C   UNL     1       5.259  -0.800   0.619  1.00  0.00           C  
HETATM   21  C   UNL     1       5.979  -0.876  -0.565  1.00  0.00           C  
HETATM   22  C   UNL     1       7.330  -0.583  -0.571  1.00  0.00           C  
HETATM   23  C   UNL     1       7.964  -0.215   0.601  1.00  0.00           C  
HETATM   24  C   UNL     1       7.250  -0.140   1.782  1.00  0.00           C  
HETATM   25  C   UNL     1       5.897  -0.426   1.793  1.00  0.00           C  
HETATM   26 CL   UNL     1       5.184  -1.338  -2.038  1.00  0.00          Cl  
HETATM   27 CL   UNL     1       4.999  -0.323   3.275  1.00  0.00          Cl  
HETATM   28  C   UNL     1       9.437   0.104   0.591  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.270   2.203  -0.185  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.700   0.615   1.183  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.837   2.363   0.255  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.819   2.320  -0.678  1.00  0.00           C  
HETATM   33  C   UNL     1      -0.504   2.467  -0.275  1.00  0.00           C  
HETATM   34  C   UNL     1      -0.208   2.655   1.062  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.226   2.697   1.996  1.00  0.00           C  
HETATM   36  C   UNL     1      -2.542   2.558   1.592  1.00  0.00           C  
HETATM   37 CL   UNL     1      -3.821   2.619   2.765  1.00  0.00          Cl  
HETATM   38  C   UNL     1       0.605   2.420  -1.293  1.00  0.00           C  
HETATM   39  N   UNL     1       0.866   3.776  -1.796  1.00  0.00           N  
HETATM   40  C   UNL     1      -7.120   1.143   0.967  1.00  0.00           C  
HETATM   41  C   UNL     1      -6.189   1.835   1.965  1.00  0.00           C  
HETATM   42  C   UNL     1       1.945   3.769  -2.793  1.00  0.00           C  
HETATM   43  C   UNL     1       2.736   5.064  -2.986  1.00  0.00           C  
HETATM   44  C   UNL     1       1.744   4.607  -4.057  1.00  0.00           C  
HETATM   45  H   UNL     1      -4.124  -4.267   0.163  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.988  -4.717  -1.555  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.266  -3.845  -1.971  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.292  -5.092  -0.701  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.563  -3.218   0.001  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.473  -1.518  -1.372  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.651  -1.055   0.338  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.341  -1.821   0.792  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.246  -2.353  -2.214  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.500  -3.027   1.035  1.00  0.00           H  
HETATM   55  H   UNL     1       0.344  -1.814  -2.744  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.112  -1.958  -3.080  1.00  0.00           H  
HETATM   57  H   UNL     1       1.601  -1.873   1.553  1.00  0.00           H  
HETATM   58  H   UNL     1       1.754  -3.592   1.117  1.00  0.00           H  
HETATM   59  H   UNL     1       3.935  -2.755   1.848  1.00  0.00           H  
HETATM   60  H   UNL     1       3.995  -3.085   0.100  1.00  0.00           H  
HETATM   61  H   UNL     1       7.891  -0.641  -1.492  1.00  0.00           H  
HETATM   62  H   UNL     1       7.748   0.147   2.697  1.00  0.00           H  
HETATM   63  H   UNL     1       9.578   1.167   0.396  1.00  0.00           H  
HETATM   64  H   UNL     1       9.870  -0.148   1.559  1.00  0.00           H  
HETATM   65  H   UNL     1       9.930  -0.477  -0.189  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.343   2.382  -1.258  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.895   2.920   0.347  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.589  -0.322   1.729  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.050   2.172  -1.723  1.00  0.00           H  
HETATM   70  H   UNL     1       0.819   2.769   1.376  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.994   2.844   3.041  1.00  0.00           H  
HETATM   72  H   UNL     1       1.509   2.025  -0.829  1.00  0.00           H  
HETATM   73  H   UNL     1       0.312   1.776  -2.122  1.00  0.00           H  
HETATM   74  H   UNL     1       0.027   4.188  -2.174  1.00  0.00           H  
HETATM   75  H   UNL     1      -7.327   1.660   0.030  1.00  0.00           H  
HETATM   76  H   UNL     1      -7.943   0.554   1.371  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.400   1.702   3.026  1.00  0.00           H  
HETATM   78  H   UNL     1      -5.785   2.808   1.685  1.00  0.00           H  
HETATM   79  H   UNL     1       2.486   2.828  -2.894  1.00  0.00           H  
HETATM   80  H   UNL     1       2.457   5.921  -2.373  1.00  0.00           H  
HETATM   81  H   UNL     1       3.799   4.975  -3.214  1.00  0.00           H  
HETATM   82  H   UNL     1       2.153   4.218  -4.990  1.00  0.00           H  
HETATM   83  H   UNL     1       0.811   5.164  -4.149  1.00  0.00           H  
CONECT    1    2    6   45   46                                       
CONECT    2    1    3   47   48                                       
CONECT    3    2    4   49                                            
CONECT    4    3    5   50   51                                       
CONECT    5    4    6   15   52                                       
CONECT    6    1    5    7   53                                       
CONECT    7    6    8    8   12                                       
CONECT    8    7    7    9   54                                       
CONECT    9    8   10   10                                            
CONECT   10    9    9   11   13                                       
CONECT   11   10   12   12   55                                       
CONECT   12    7   11   11   56                                       
CONECT   13   10   14                                                 
CONECT   14   13   18   57   58                                       
CONECT   15    5   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   29   30                                            
CONECT   18   14   19   59   60                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   21   25                                       
CONECT   21   20   20   22   26                                       
CONECT   22   21   23   23   61                                       
CONECT   23   22   22   24   28                                       
CONECT   24   23   25   25   62                                       
CONECT   25   20   24   24   27                                       
CONECT   26   21                                                      
CONECT   27   25                                                      
CONECT   28   23   63   64   65                                       
CONECT   29   17   31   66   67                                       
CONECT   30   17   40   41   68                                       
CONECT   31   29   32   32   36                                       
CONECT   32   31   31   33   69                                       
CONECT   33   32   34   34   38                                       
CONECT   34   33   33   35   70                                       
CONECT   35   34   36   36   71                                       
CONECT   36   31   35   35   37                                       
CONECT   37   36                                                      
CONECT   38   33   39   72   73                                       
CONECT   39   38   42   74                                            
CONECT   40   30   41   75   76                                       
CONECT   41   30   40   77   78                                       
CONECT   42   39   43   44   79                                       
CONECT   43   42   44   80   81                                       
CONECT   44   42   43   82   83                                       
CONECT   45    1                                                      
CONECT   46    1                                                      
CONECT   47    2                                                      
CONECT   48    2                                                      
CONECT   49    3                                                      
CONECT   50    4                                                      
CONECT   51    4                                                      
CONECT   52    5                                                      
CONECT   53    6                                                      
CONECT   54    8                                                      
CONECT   55   11                                                      
CONECT   56   12                                                      
CONECT   57   14                                                      
CONECT   58   14                                                      
CONECT   59   18                                                      
CONECT   60   18                                                      
CONECT   61   22                                                      
CONECT   62   24                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   32                                                      
CONECT   70   34                                                      
CONECT   71   35                                                      
CONECT   72   38                                                      
CONECT   73   38                                                      
CONECT   74   39                                                      
CONECT   75   40                                                      
CONECT   76   40                                                      
CONECT   77   41                                                      
CONECT   78   41                                                      
CONECT   79   42                                                      
CONECT   80   43                                                      
CONECT   81   43                                                      
CONECT   82   44                                                      
CONECT   83   44                                                      
MASTER        0    0    0    0    0    0    0    0   83    0   83    0
END
