COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -4.319  -1.329   2.418  1.00  0.00           N  
HETATM    2  N   UNL     1       0.705   1.116   0.373  1.00  0.00           N  
HETATM    3  C   UNL     1       1.960  -2.036   2.950  1.00  0.00           C  
HETATM    4  C   UNL     1       0.978  -2.335   1.810  1.00  0.00           C  
HETATM    5  C   UNL     1       1.181  -1.287   0.713  1.00  0.00           C  
HETATM    6  C   UNL     1       0.433  -1.720  -0.549  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.036  -1.859  -0.241  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.116  -2.111  -3.592  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.324  -2.398  -0.923  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.214  -2.277   1.463  1.00  0.00           C  
HETATM   11  C   UNL     1       0.644   0.040   1.182  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.980   4.687   1.672  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.941   4.450   0.289  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.448   5.374  -0.639  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.823   3.902  -2.427  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.370   3.238  -0.179  1.00  0.00           C  
HETATM   17  C   UNL     1       3.030  -0.555  -0.785  1.00  0.00           C  
HETATM   18  O   UNL     1       0.157   0.141   2.289  1.00  0.00           O  
HETATM   19  C   UNL     1       0.132   2.325   0.774  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.321   2.982  -1.556  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.384   5.093  -1.970  1.00  0.00           C  
HETATM   22  N   UNL     1      -0.496   3.798   2.508  1.00  0.00           N  
HETATM   23  C   UNL     1       0.044   2.655   2.110  1.00  0.00           C  
HETATM   24  O   UNL     1       3.289  -2.213   2.457  1.00  0.00           O  
HETATM   25  C   UNL     1       2.651  -1.154   0.405  1.00  0.00           C  
HETATM   26  C   UNL     1       3.616  -1.614   1.283  1.00  0.00           C  
HETATM   27  C   UNL     1       4.963  -1.468   0.965  1.00  0.00           C  
HETATM   28  C   UNL     1       5.336  -0.869  -0.221  1.00  0.00           C  
HETATM   29  C   UNL     1       4.369  -0.412  -1.098  1.00  0.00           C  
HETATM   30 CL   UNL     1       4.836   0.340  -2.592  1.00  0.00          Cl  
HETATM   31  O   UNL     1      -1.460  -1.533   0.847  1.00  0.00           O  
HETATM   32  N   UNL     1      -1.878  -2.344  -1.175  1.00  0.00           N  
HETATM   33  C   UNL     1      -4.051  -1.686  -2.068  1.00  0.00           C  
HETATM   34  C   UNL     1      -3.622  -2.302  -3.401  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.367  -2.828  -2.464  1.00  0.00           C  
HETATM   36  C   UNL     1      -3.636  -1.708   0.380  1.00  0.00           C  
HETATM   37  C   UNL     1      -3.379  -0.368   0.684  1.00  0.00           C  
HETATM   38  N   UNL     1      -3.788  -0.139   1.905  1.00  0.00           N  
HETATM   39  H   UNL     1      -4.700  -1.450   3.303  1.00  0.00           H  
HETATM   40  H   UNL     1       1.146   1.050  -0.489  1.00  0.00           H  
HETATM   41  H   UNL     1       1.828  -1.008   3.287  1.00  0.00           H  
HETATM   42  H   UNL     1       1.782  -2.721   3.779  1.00  0.00           H  
HETATM   43  H   UNL     1       1.173  -3.330   1.409  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.045  -2.284   2.184  1.00  0.00           H  
HETATM   45  H   UNL     1       0.572  -0.971  -1.329  1.00  0.00           H  
HETATM   46  H   UNL     1       0.824  -2.678  -0.893  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.814  -2.530  -4.552  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.878  -1.048  -3.569  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.648  -3.438  -0.875  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.535  -3.305   1.548  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.406   5.605   2.049  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.885   6.301  -0.299  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.785   3.705  -3.489  1.00  0.00           H  
HETATM   54  H   UNL     1       2.276  -0.197  -1.471  1.00  0.00           H  
HETATM   55  H   UNL     1       0.111   2.064  -1.923  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.775   5.804  -2.682  1.00  0.00           H  
HETATM   57  H   UNL     1       0.424   1.966   2.849  1.00  0.00           H  
HETATM   58  H   UNL     1       5.719  -1.824   1.649  1.00  0.00           H  
HETATM   59  H   UNL     1       6.382  -0.756  -0.464  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.128  -1.802  -1.944  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.796  -0.626  -2.058  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.156  -1.814  -4.216  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.856  -3.367  -3.401  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.531  -3.903  -2.542  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.301  -2.613  -2.539  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.921   0.355   0.024  1.00  0.00           H  
CONECT    1   10   38   39                                            
CONECT    2   19   11   40                                            
CONECT    3    4   24   41   42                                       
CONECT    4    5    3   43   44                                       
CONECT    5    6   11    4   25                                       
CONECT    6    7    5   45   46                                       
CONECT    7   31   31   32    6                                       
CONECT    8   34   35   47   48                                       
CONECT    9   36   33   32   49                                       
CONECT   10    1   36   36   50                                       
CONECT   11    2    5   18   18                                       
CONECT   12   13   13   22   51                                       
CONECT   13   14   12   12   16                                       
CONECT   14   21   21   13   52                                       
CONECT   15   21   20   20   53                                       
CONECT   16   13   20   19   19                                       
CONECT   17   25   25   29   54                                       
CONECT   18   11   11                                                 
CONECT   19   16   16   23    2                                       
CONECT   20   15   15   16   55                                       
CONECT   21   14   14   15   56                                       
CONECT   22   12   23   23                                            
CONECT   23   22   22   19   57                                       
CONECT   24    3   26                                                 
CONECT   25    5   17   17   26                                       
CONECT   26   25   24   27   27                                       
CONECT   27   26   26   28   58                                       
CONECT   28   29   29   27   59                                       
CONECT   29   17   30   28   28                                       
CONECT   30   29                                                      
CONECT   31    7    7                                                 
CONECT   32    9    7   35                                            
CONECT   33    9   34   60   61                                       
CONECT   34   33    8   62   63                                       
CONECT   35   32    8   64   65                                       
CONECT   36   10   10   37    9                                       
CONECT   37   38   38   36   66                                       
CONECT   38    1   37   37                                            
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   12                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   17                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   23                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
CONECT   64   35                                                      
CONECT   65   35                                                      
CONECT   66   37                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
