COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.703  -0.759  -0.072  1.00  0.00           C  
HETATM    2  C   UNL     1       1.565  -0.028  -0.520  1.00  0.00           C  
HETATM    3  C   UNL     1       1.069  -1.019   0.356  1.00  0.00           C  
HETATM    4  C   UNL     1       1.985  -1.869   0.994  1.00  0.00           C  
HETATM    5  C   UNL     1       8.894  -1.565  -1.739  1.00  0.00           C  
HETATM    6  C   UNL     1       7.224  -1.690  -0.050  1.00  0.00           C  
HETATM    7  C   UNL     1       8.112  -2.449   0.694  1.00  0.00           C  
HETATM    8  C   UNL     1       7.745  -2.918   1.942  1.00  0.00           C  
HETATM    9  C   UNL     1       6.492  -2.631   2.451  1.00  0.00           C  
HETATM   10  C   UNL     1       5.600  -1.874   1.715  1.00  0.00           C  
HETATM   11  C   UNL     1       5.964  -1.395   0.464  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.321  -1.145   0.572  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.175  -0.293  -0.078  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.627   0.723  -0.980  1.00  0.00           C  
HETATM   15  C   UNL     1       1.235   1.846  -2.068  1.00  0.00           C  
HETATM   16  C   UNL     1       1.502   3.132  -1.284  1.00  0.00           C  
HETATM   17  C   UNL     1       2.749   4.012   0.562  1.00  0.00           C  
HETATM   18  C   UNL     1       1.450   4.527   1.191  1.00  0.00           C  
HETATM   19  C   UNL     1       0.431   4.788   0.077  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.637  -0.400   0.127  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.211   0.063   1.312  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.571  -0.037   1.503  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.376  -0.599   0.512  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.804  -1.062  -0.673  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.443  -0.959  -0.867  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.839  -0.710   0.721  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.406  -0.247   1.908  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.773  -0.357   2.088  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.531  -0.928   1.075  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.904  -1.368  -0.076  1.00  0.00           C  
HETATM   31  C   UNL     1      -9.723  -1.988  -1.178  1.00  0.00           C  
HETATM   32  N   UNL     1       3.273  -1.703   0.758  1.00  0.00           N  
HETATM   33  N   UNL     1       2.878   0.064  -0.701  1.00  0.00           N  
HETATM   34  N   UNL     1       5.062  -0.628  -0.283  1.00  0.00           N  
HETATM   35  N   UNL     1       0.703   0.824  -1.163  1.00  0.00           N  
HETATM   36  N   UNL     1       1.717   5.775   1.919  1.00  0.00           N  
HETATM   37  N   UNL     1      -7.601  -1.246  -0.225  1.00  0.00           N  
HETATM   38  O   UNL     1       7.584  -1.228  -1.278  1.00  0.00           O  
HETATM   39  O   UNL     1      -1.379   1.484  -1.563  1.00  0.00           O  
HETATM   40  O   UNL     1       2.452   2.871  -0.249  1.00  0.00           O  
HETATM   41  O   UNL     1       0.281   3.598  -0.704  1.00  0.00           O  
HETATM   42 CL   UNL     1      -2.731  -1.533  -2.342  1.00  0.00          Cl  
HETATM   43  H   UNL     1       1.643  -2.639   1.671  1.00  0.00           H  
HETATM   44  H   UNL     1       9.053  -1.135  -2.728  1.00  0.00           H  
HETATM   45  H   UNL     1       9.636  -1.166  -1.047  1.00  0.00           H  
HETATM   46  H   UNL     1       8.993  -2.649  -1.793  1.00  0.00           H  
HETATM   47  H   UNL     1       9.092  -2.676   0.299  1.00  0.00           H  
HETATM   48  H   UNL     1       8.439  -3.510   2.520  1.00  0.00           H  
HETATM   49  H   UNL     1       6.209  -3.000   3.426  1.00  0.00           H  
HETATM   50  H   UNL     1       4.622  -1.652   2.115  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.705  -1.901   1.241  1.00  0.00           H  
HETATM   52  H   UNL     1       0.510   2.045  -2.858  1.00  0.00           H  
HETATM   53  H   UNL     1       2.166   1.490  -2.510  1.00  0.00           H  
HETATM   54  H   UNL     1       1.897   3.893  -1.957  1.00  0.00           H  
HETATM   55  H   UNL     1       3.191   4.794  -0.055  1.00  0.00           H  
HETATM   56  H   UNL     1       3.449   3.728   1.349  1.00  0.00           H  
HETATM   57  H   UNL     1       1.055   3.780   1.879  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.529   5.059   0.516  1.00  0.00           H  
HETATM   59  H   UNL     1       0.785   5.600  -0.559  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.589   0.498   2.080  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.015   0.321   2.421  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.428  -1.497  -1.439  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.786   0.193   2.675  1.00  0.00           H  
HETATM   64  H   UNL     1      -9.240  -0.007   2.997  1.00  0.00           H  
HETATM   65  H   UNL     1     -10.600  -1.033   1.187  1.00  0.00           H  
HETATM   66  H   UNL     1     -10.051  -1.211  -1.868  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.117  -2.718  -1.714  1.00  0.00           H  
HETATM   68  H   UNL     1     -10.594  -2.484  -0.749  1.00  0.00           H  
HETATM   69  H   UNL     1       5.391  -0.004  -0.949  1.00  0.00           H  
HETATM   70  H   UNL     1       0.874   6.134   2.342  1.00  0.00           H  
HETATM   71  H   UNL     1       2.440   5.643   2.610  1.00  0.00           H  
CONECT    1   33   33   32   34                                       
CONECT    2   35    3    3   33                                       
CONECT    3   12    2    2    4                                       
CONECT    4    3   32   32   43                                       
CONECT    5   38   44   45   46                                       
CONECT    6   11   11    7   38                                       
CONECT    7    8    8    6   47                                       
CONECT    8    9    7    7   48                                       
CONECT    9   10   10    8   49                                       
CONECT   10    9    9   11   50                                       
CONECT   11   10   34    6    6                                       
CONECT   12   13   13    3   51                                       
CONECT   13   20   14   12   12                                       
CONECT   14   39   39   13   35                                       
CONECT   15   16   35   52   53                                       
CONECT   16   41   15   40   54                                       
CONECT   17   18   40   55   56                                       
CONECT   18   19   36   17   57                                       
CONECT   19   41   18   58   59                                       
CONECT   20   25   25   21   13                                       
CONECT   21   22   22   20   60                                       
CONECT   22   23   21   21   61                                       
CONECT   23   26   24   24   22                                       
CONECT   24   23   23   25   62                                       
CONECT   25   24   42   20   20                                       
CONECT   26   37   37   27   23                                       
CONECT   27   28   28   26   63                                       
CONECT   28   29   27   27   64                                       
CONECT   29   30   30   28   65                                       
CONECT   30   31   29   29   37                                       
CONECT   31   30   66   67   68                                       
CONECT   32    4    4    1                                            
CONECT   33    2    1    1                                            
CONECT   34    1   11   69                                            
CONECT   35   14   15    2                                            
CONECT   36   18   70   71                                            
CONECT   37   30   26   26                                            
CONECT   38    6    5                                                 
CONECT   39   14   14                                                 
CONECT   40   16   17                                                 
CONECT   41   19   16                                                 
CONECT   42   25                                                      
CONECT   43    4                                                      
CONECT   44    5                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   12                                                      
CONECT   52   15                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   17                                                      
CONECT   57   18                                                      
CONECT   58   19                                                      
CONECT   59   19                                                      
CONECT   60   21                                                      
CONECT   61   22                                                      
CONECT   62   24                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   29                                                      
CONECT   66   31                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   34                                                      
CONECT   70   36                                                      
CONECT   71   36                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
