COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.745   2.576   1.378  1.00  0.00           C  
HETATM    2  C   UNL     1      -9.193   0.286  -1.050  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.482   1.038   0.989  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.301  -0.172   0.344  1.00  0.00           C  
HETATM    5  C   UNL     1       7.158   0.920  -0.186  1.00  0.00           C  
HETATM    6  C   UNL     1       6.950   2.288  -0.200  1.00  0.00           C  
HETATM    7  C   UNL     1       6.357   4.969   0.058  1.00  0.00           C  
HETATM    8  C   UNL     1       5.322   3.999  -0.452  1.00  0.00           C  
HETATM    9  C   UNL     1       0.904  -6.487   0.258  1.00  0.00           C  
HETATM   10  C   UNL     1       1.892  -3.921   1.271  1.00  0.00           C  
HETATM   11  C   UNL     1       0.781  -3.991   0.221  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.175  -1.084   0.758  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.928  -0.763  -0.069  1.00  0.00           C  
HETATM   14  C   UNL     1       2.929  -1.544  -0.428  1.00  0.00           C  
HETATM   15  C   UNL     1       5.013  -0.319  -0.288  1.00  0.00           C  
HETATM   16  C   UNL     1       8.950   1.208   1.382  1.00  0.00           C  
HETATM   17  C   UNL     1       8.160   0.383   0.603  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.159  -0.550  -0.671  1.00  0.00           C  
HETATM   19  C   UNL     1       7.743   3.119   0.590  1.00  0.00           C  
HETATM   20  C   UNL     1      -9.369   1.501  -0.414  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.512   1.878   0.607  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.249  -2.027  -0.788  1.00  0.00           C  
HETATM   23  C   UNL     1       2.014  -6.417   1.309  1.00  0.00           C  
HETATM   24  C   UNL     1       1.828  -5.162   2.164  1.00  0.00           C  
HETATM   25  C   UNL     1       0.967  -5.246  -0.635  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.496  -2.315   0.006  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.615  -1.371  -0.441  1.00  0.00           C  
HETATM   28  C   UNL     1       2.089  -2.459  -1.322  1.00  0.00           C  
HETATM   29  C   UNL     1       6.303   0.018  -1.038  1.00  0.00           C  
HETATM   30  N   UNL     1       7.515   4.502   0.574  1.00  0.00           N  
HETATM   31  N   UNL     1      -3.831  -1.652   0.334  1.00  0.00           N  
HETATM   32  N   UNL     1       4.179  -1.199  -1.118  1.00  0.00           N  
HETATM   33  N   UNL     1       0.842  -2.803  -0.634  1.00  0.00           N  
HETATM   34  O   UNL     1       6.150   6.163   0.006  1.00  0.00           O  
HETATM   35  O   UNL     1      -0.226  -1.097  -1.566  1.00  0.00           O  
HETATM   36  O   UNL     1       5.970   2.833  -0.969  1.00  0.00           O  
HETATM   37  O   UNL     1       7.017  -1.187  -1.321  1.00  0.00           O  
HETATM   38 CL   UNL     1     -10.662   2.555  -0.895  1.00  0.00          Cl  
HETATM   39 CL   UNL     1      -8.740   3.397   1.416  1.00  0.00          Cl  
HETATM   40  H   UNL     1       9.360   3.218   1.990  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.861  -0.008  -1.847  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.814   1.330   1.786  1.00  0.00           H  
HETATM   43  H   UNL     1       4.657   3.714   0.363  1.00  0.00           H  
HETATM   44  H   UNL     1       4.742   4.472  -1.245  1.00  0.00           H  
HETATM   45  H   UNL     1       1.036  -7.380  -0.351  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.065  -6.527   0.756  1.00  0.00           H  
HETATM   47  H   UNL     1       2.861  -3.881   0.773  1.00  0.00           H  
HETATM   48  H   UNL     1       1.760  -3.027   1.881  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.187  -4.031   0.719  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.958  -0.937   1.816  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.466  -2.121   0.587  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.146  -0.910  -1.127  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.637   0.274   0.101  1.00  0.00           H  
HETATM   54  H   UNL     1       2.369  -0.634  -0.213  1.00  0.00           H  
HETATM   55  H   UNL     1       3.159  -2.059   0.505  1.00  0.00           H  
HETATM   56  H   UNL     1       5.257  -0.826   0.646  1.00  0.00           H  
HETATM   57  H   UNL     1       4.468   0.600  -0.071  1.00  0.00           H  
HETATM   58  H   UNL     1       9.731   0.783   1.996  1.00  0.00           H  
HETATM   59  H   UNL     1       8.325  -0.684   0.610  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.022  -1.499  -1.168  1.00  0.00           H  
HETATM   61  H   UNL     1       1.969  -7.300   1.945  1.00  0.00           H  
HETATM   62  H   UNL     1       2.983  -6.377   0.811  1.00  0.00           H  
HETATM   63  H   UNL     1       2.620  -5.112   2.912  1.00  0.00           H  
HETATM   64  H   UNL     1       0.860  -5.202   2.662  1.00  0.00           H  
HETATM   65  H   UNL     1       1.936  -5.206  -1.133  1.00  0.00           H  
HETATM   66  H   UNL     1       0.176  -5.296  -1.383  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.804  -3.348  -0.162  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.295  -2.164   1.067  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.307  -0.339  -0.273  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.816  -1.523  -1.501  1.00  0.00           H  
HETATM   71  H   UNL     1       1.860  -1.944  -2.255  1.00  0.00           H  
HETATM   72  H   UNL     1       2.649  -3.369  -1.538  1.00  0.00           H  
HETATM   73  H   UNL     1       6.059   0.524  -1.972  1.00  0.00           H  
HETATM   74  H   UNL     1       8.179   5.115   0.928  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.653  -1.581   1.324  1.00  0.00           H  
HETATM   76  H   UNL     1       3.993  -0.778  -2.016  1.00  0.00           H  
HETATM   77  H   UNL     1       7.268  -1.690  -0.535  1.00  0.00           H  
CONECT    1   16   16   19   40                                       
CONECT    2   18   20   20   41                                       
CONECT    3    4   21   21   42                                       
CONECT    4   12   18   18    3                                       
CONECT    5   29   17   17    6                                       
CONECT    6    5   36   19   19                                       
CONECT    7   30    8   34   34                                       
CONECT    8   36    7   43   44                                       
CONECT    9   25   23   45   46                                       
CONECT   10   11   24   47   48                                       
CONECT   11   33   25   10   49                                       
CONECT   12   13    4   50   51                                       
CONECT   13   12   31   52   53                                       
CONECT   14   32   28   54   55                                       
CONECT   15   29   32   56   57                                       
CONECT   16   17    1    1   58                                       
CONECT   17    5    5   16   59                                       
CONECT   18    4    4    2   60                                       
CONECT   19    6    6    1   30                                       
CONECT   20    2    2   21   38                                       
CONECT   21    3    3   20   39                                       
CONECT   22   35   35   26   33                                       
CONECT   23    9   24   61   62                                       
CONECT   24   10   23   63   64                                       
CONECT   25   11    9   65   66                                       
CONECT   26   27   22   67   68                                       
CONECT   27   31   26   69   70                                       
CONECT   28   33   14   71   72                                       
CONECT   29   37    5   15   73                                       
CONECT   30   19    7   74                                            
CONECT   31   13   27   75                                            
CONECT   32   15   14   76                                            
CONECT   33   22   28   11                                            
CONECT   34    7    7                                                 
CONECT   35   22   22                                                 
CONECT   36    6    8                                                 
CONECT   37   29   77                                                 
CONECT   38   20                                                      
CONECT   39   21                                                      
CONECT   40    1                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   14                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   17                                                      
CONECT   60   18                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   25                                                      
CONECT   67   26                                                      
CONECT   68   26                                                      
CONECT   69   27                                                      
CONECT   70   27                                                      
CONECT   71   28                                                      
CONECT   72   28                                                      
CONECT   73   29                                                      
CONECT   74   30                                                      
CONECT   75   31                                                      
CONECT   76   32                                                      
CONECT   77   37                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
