COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.597  -1.073  -0.563  1.00  0.00           C  
HETATM    2  C   UNL     1       6.667  -1.260   0.630  1.00  0.00           C  
HETATM    3  C   UNL     1       6.609  -0.222  -1.544  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.681   0.809  -0.023  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.560  -0.378  -0.039  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.341  -1.662   0.935  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.258  -2.437  -1.062  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.311   0.829  -0.229  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.944   2.248  -0.105  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.524   2.590  -0.278  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.099   0.287  -0.633  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.243   1.868  -0.716  1.00  0.00           C  
HETATM   13  C   UNL     1       0.468   1.791   0.636  1.00  0.00           C  
HETATM   14  C   UNL     1       3.112  -1.317  -0.641  1.00  0.00           C  
HETATM   15  C   UNL     1       5.306  -1.482   0.554  1.00  0.00           C  
HETATM   16  C   UNL     1       7.326  -0.625  -0.420  1.00  0.00           C  
HETATM   17  C   UNL     1       5.249  -0.447  -1.610  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.437   2.525   0.453  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.524  -0.551   0.956  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.207  -2.604  -0.069  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.434  -1.330  -1.053  1.00  0.00           C  
HETATM   22  C   UNL     1      -9.100  -3.818  -0.082  1.00  0.00           C  
HETATM   23  C   UNL     1       0.313   0.383   1.218  1.00  0.00           C  
HETATM   24  C   UNL     1       0.984  -0.626   0.283  1.00  0.00           C  
HETATM   25  C   UNL     1       1.957   2.097   0.449  1.00  0.00           C  
HETATM   26  C   UNL     1       2.580   1.038  -0.463  1.00  0.00           C  
HETATM   27  C   UNL     1       8.789  -0.385  -0.345  1.00  0.00           C  
HETATM   28  C   UNL     1      10.801  -0.324   0.321  1.00  0.00           C  
HETATM   29  N   UNL     1      -3.337  -0.075  -0.491  1.00  0.00           N  
HETATM   30  N   UNL     1      -1.668   1.575  -0.536  1.00  0.00           N  
HETATM   31  N   UNL     1       2.406  -0.291   0.138  1.00  0.00           N  
HETATM   32  N   UNL     1      -5.053   2.900   0.146  1.00  0.00           N  
HETATM   33  N   UNL     1      -6.059   2.101   0.192  1.00  0.00           N  
HETATM   34  N   UNL     1     -10.314  -3.525  -0.855  1.00  0.00           N  
HETATM   35  N   UNL     1       9.606  -0.721   0.679  1.00  0.00           N  
HETATM   36  N   UNL     1       9.530   0.186  -1.258  1.00  0.00           N  
HETATM   37  O   UNL     1      -2.135   3.740  -0.192  1.00  0.00           O  
HETATM   38  O   UNL     1      -0.107   2.744   1.533  1.00  0.00           O  
HETATM   39  O   UNL     1      10.685   0.230  -0.890  1.00  0.00           O  
HETATM   40 CL   UNL     1       4.482  -2.273   1.862  1.00  0.00          Cl  
HETATM   41  H   UNL     1       7.219  -1.578   1.502  1.00  0.00           H  
HETATM   42  H   UNL     1       7.116   0.267  -2.363  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.084  -1.799   1.707  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.159  -3.176  -1.843  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.367  -0.479  -0.841  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.128   2.869  -1.131  1.00  0.00           H  
HETATM   47  H   UNL     1       0.194   1.139  -1.399  1.00  0.00           H  
HETATM   48  H   UNL     1       2.790  -1.269  -1.681  1.00  0.00           H  
HETATM   49  H   UNL     1       2.884  -2.302  -0.235  1.00  0.00           H  
HETATM   50  H   UNL     1       4.692  -0.135  -2.481  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.930   2.761  -0.490  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.976   1.720   0.953  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.431   3.408   1.091  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.629   0.184   1.741  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.694  -1.201  -1.828  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.570  -4.654  -0.540  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.373  -4.079   0.940  1.00  0.00           H  
HETATM   58  H   UNL     1       0.786   0.341   2.199  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.746   0.143   1.314  1.00  0.00           H  
HETATM   60  H   UNL     1       0.888  -1.628   0.702  1.00  0.00           H  
HETATM   61  H   UNL     1       0.502  -0.593  -0.694  1.00  0.00           H  
HETATM   62  H   UNL     1       2.072   3.081  -0.004  1.00  0.00           H  
HETATM   63  H   UNL     1       2.089   1.063  -1.436  1.00  0.00           H  
HETATM   64  H   UNL     1      11.710  -0.426   0.895  1.00  0.00           H  
HETATM   65  H   UNL     1     -10.084  -3.219  -1.788  1.00  0.00           H  
HETATM   66  H   UNL     1     -10.929  -4.325  -0.878  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.050   2.610   1.697  1.00  0.00           H  
HETATM   68  H   UNL     1       2.455   2.082   1.418  1.00  0.00           H  
HETATM   69  H   UNL     1       3.643   1.245  -0.586  1.00  0.00           H  
CONECT    1   17   17   15   14                                       
CONECT    2   16   15   15   41                                       
CONECT    3   16   16   17   42                                       
CONECT    4   33    8    8    5                                       
CONECT    5    4   19   19   21                                       
CONECT    6   19   20   20   43                                       
CONECT    7   21   21   20   44                                       
CONECT    8    9    4    4   29                                       
CONECT    9   32   32   10    8                                       
CONECT   10   37   37    9   30                                       
CONECT   11   30   29   29   45                                       
CONECT   12   13   30   46   47                                       
CONECT   13   23   25   38   12                                       
CONECT   14    1   31   48   49                                       
CONECT   15    2    2    1   40                                       
CONECT   16   27    3    3    2                                       
CONECT   17    3    1    1   50                                       
CONECT   18   33   51   52   53                                       
CONECT   19    5    5    6   54                                       
CONECT   20    6    6    7   22                                       
CONECT   21    5    7    7   55                                       
CONECT   22   20   34   56   57                                       
CONECT   23   24   13   58   59                                       
CONECT   24   31   23   60   61                                       
CONECT   25   26   13   62   68                                       
CONECT   26   31   25   63   69                                       
CONECT   27   36   36   35   16                                       
CONECT   28   39   35   35   64                                       
CONECT   29    8   11   11                                            
CONECT   30   10   12   11                                            
CONECT   31   14   24   26                                            
CONECT   32   33    9    9                                            
CONECT   33   18   32    4                                            
CONECT   34   22   65   66                                            
CONECT   35   28   28   27                                            
CONECT   36   39   27   27                                            
CONECT   37   10   10                                                 
CONECT   38   13   67                                                 
CONECT   39   28   36                                                 
CONECT   40   15                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   28                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   38                                                      
CONECT   68   25                                                      
CONECT   69   26                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
