COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -2.131   4.607   2.883  1.00  0.00          Cl  
HETATM    2  C   UNL     1      -1.633   3.256   1.911  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.605   1.985   2.456  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.209   0.910   1.682  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.271   3.451   0.590  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.875   2.375  -0.183  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.841   1.106   0.364  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.409  -0.066  -0.479  1.00  0.00           C  
HETATM    9  N   UNL     1       0.759  -0.692   0.127  1.00  0.00           N  
HETATM   10  C   UNL     1       1.790   0.183   0.693  1.00  0.00           C  
HETATM   11  C   UNL     1       0.948  -2.010   0.201  1.00  0.00           C  
HETATM   12  O   UNL     1       1.980  -2.415   0.693  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.048  -3.019  -0.293  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.806  -3.610   0.897  1.00  0.00           C  
HETATM   15  C   UNL     1       0.169  -4.280   1.830  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.273  -4.872   2.951  1.00  0.00           O  
HETATM   17  O   UNL     1       1.349  -4.285   1.570  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.041  -2.348  -1.246  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.561  -1.067  -0.580  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.670  -0.479  -1.413  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.432  -0.120  -2.727  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.450   0.419  -3.492  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.706   0.599  -2.943  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.944   0.240  -1.629  1.00  0.00           C  
HETATM   25 CL   UNL     1      -6.522   0.466  -0.939  1.00  0.00          Cl  
HETATM   26  C   UNL     1      -3.927  -0.305  -0.865  1.00  0.00           C  
HETATM   27  C   UNL     1       2.380  -0.469   1.945  1.00  0.00           C  
HETATM   28  C   UNL     1       1.265  -1.153   2.738  1.00  0.00           C  
HETATM   29  C   UNL     1       0.687  -4.139  -1.032  1.00  0.00           C  
HETATM   30  C   UNL     1       4.898   1.362  -0.876  1.00  0.00           C  
HETATM   31  C   UNL     1       4.867   0.799  -2.139  1.00  0.00           C  
HETATM   32  C   UNL     1       3.791   0.002  -2.497  1.00  0.00           C  
HETATM   33  C   UNL     1       2.782  -0.200  -1.568  1.00  0.00           C  
HETATM   34  C   UNL     1       2.881   0.395  -0.325  1.00  0.00           C  
HETATM   35  N   UNL     1       3.923   1.143  -0.016  1.00  0.00           N  
HETATM   36  C   UNL     1       7.437   1.877  -1.050  1.00  0.00           C  
HETATM   37  C   UNL     1       6.692   3.112  -1.558  1.00  0.00           C  
HETATM   38  C   UNL     1       6.063   2.230  -0.476  1.00  0.00           C  
HETATM   39  H   UNL     1      -1.892   1.832   3.486  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.186  -0.082   2.108  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.296   4.442   0.163  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.592   2.527  -1.214  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.148   0.285  -1.478  1.00  0.00           H  
HETATM   44  H   UNL     1       1.347   1.143   0.957  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.327  -2.813   1.428  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.529  -4.343   0.540  1.00  0.00           H  
HETATM   47  H   UNL     1       0.389  -5.289   3.518  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.540  -2.098  -2.181  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.873  -3.023  -1.444  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.934  -1.297   0.417  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.451  -0.260  -3.156  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.264   0.699  -4.518  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.501   1.021  -3.541  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.114  -0.589   0.160  1.00  0.00           H  
HETATM   55  H   UNL     1       3.125  -1.209   1.653  1.00  0.00           H  
HETATM   56  H   UNL     1       2.851   0.295   2.564  1.00  0.00           H  
HETATM   57  H   UNL     1       1.574  -1.263   3.778  1.00  0.00           H  
HETATM   58  H   UNL     1       0.361  -0.546   2.691  1.00  0.00           H  
HETATM   59  H   UNL     1       1.066  -2.136   2.312  1.00  0.00           H  
HETATM   60  H   UNL     1       1.389  -4.623  -0.353  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.035  -4.872  -1.391  1.00  0.00           H  
HETATM   62  H   UNL     1       1.231  -3.720  -1.879  1.00  0.00           H  
HETATM   63  H   UNL     1       5.671   0.979  -2.837  1.00  0.00           H  
HETATM   64  H   UNL     1       3.740  -0.450  -3.476  1.00  0.00           H  
HETATM   65  H   UNL     1       1.928  -0.815  -1.813  1.00  0.00           H  
HETATM   66  H   UNL     1       7.498   1.016  -1.716  1.00  0.00           H  
HETATM   67  H   UNL     1       8.306   2.040  -0.412  1.00  0.00           H  
HETATM   68  H   UNL     1       7.069   4.088  -1.254  1.00  0.00           H  
HETATM   69  H   UNL     1       6.262   3.065  -2.559  1.00  0.00           H  
HETATM   70  H   UNL     1       6.028   2.626   0.539  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    5    1    3    3                                       
CONECT    3    2    2    4   39                                       
CONECT    4    7    7    3   40                                       
CONECT    5    6    6    2   41                                       
CONECT    6    5    5    7   42                                       
CONECT    7    6    8    4    4                                       
CONECT    8    9    7   19   43                                       
CONECT    9   10    8   11                                            
CONECT   10   34   27    9   44                                       
CONECT   11    9   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   29   18   14                                       
CONECT   14   13   15   45   46                                       
CONECT   15   14   17   17   16                                       
CONECT   16   15   47                                                 
CONECT   17   15   15                                                 
CONECT   18   19   13   48   49                                       
CONECT   19    8   20   18   50                                       
CONECT   20   21   19   26   26                                       
CONECT   21   22   22   20   51                                       
CONECT   22   21   21   23   52                                       
CONECT   23   22   24   24   53                                       
CONECT   24   23   23   26   25                                       
CONECT   25   24                                                      
CONECT   26   20   20   24   54                                       
CONECT   27   10   28   55   56                                       
CONECT   28   27   57   58   59                                       
CONECT   29   13   60   61   62                                       
CONECT   30   31   38   35   35                                       
CONECT   31   32   32   30   63                                       
CONECT   32   31   31   33   64                                       
CONECT   33   32   34   34   65                                       
CONECT   34   33   33   35   10                                       
CONECT   35   30   30   34                                            
CONECT   36   38   37   66   67                                       
CONECT   37   38   36   68   69                                       
CONECT   38   30   37   36   70                                       
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   29                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   36                                                      
CONECT   67   36                                                      
CONECT   68   37                                                      
CONECT   69   37                                                      
CONECT   70   38                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
