COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.532   2.206   0.740  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.225   1.162  -0.302  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.829   1.618  -0.001  1.00  0.00           C  
HETATM    4  C   UNL     1       0.302   0.413  -0.300  1.00  0.00           C  
HETATM    5  C   UNL     1       1.613   0.752  -0.175  1.00  0.00           C  
HETATM    6  C   UNL     1       2.540  -0.155   0.368  1.00  0.00           C  
HETATM    7  C   UNL     1       2.134  -1.412   0.785  1.00  0.00           C  
HETATM    8  C   UNL     1       0.785  -1.779   0.663  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.891  -3.354   0.942  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.860  -2.502   0.408  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.145  -1.977  -0.024  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.559  -1.059  -1.098  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.615  -0.112  -1.650  1.00  0.00           C  
HETATM   14  C   UNL     1       5.760   1.225   1.771  1.00  0.00           C  
HETATM   15  C   UNL     1       6.679   1.010   0.797  1.00  0.00           C  
HETATM   16  C   UNL     1       6.308   0.387  -0.414  1.00  0.00           C  
HETATM   17  C   UNL     1       4.907  -0.023  -0.594  1.00  0.00           C  
HETATM   18  C   UNL     1       3.468   1.121   2.771  1.00  0.00           C  
HETATM   19 CL   UNL     1       2.148   2.321  -0.690  1.00  0.00          Cl  
HETATM   20  C   UNL     1       3.961   0.235   0.493  1.00  0.00           C  
HETATM   21  C   UNL     1       4.822  -0.596  -1.844  1.00  0.00           C  
HETATM   22  N   UNL     1       6.042  -0.554  -2.401  1.00  0.00           N  
HETATM   23  N   UNL     1       6.947   0.049  -1.519  1.00  0.00           N  
HETATM   24  C   UNL     1       4.425   0.852   1.639  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.137  -0.854   0.114  1.00  0.00           C  
HETATM   26  N   UNL     1       0.364  -2.987   1.057  1.00  0.00           N  
HETATM   27  C   UNL     1      -1.493  -1.235  -0.006  1.00  0.00           C  
HETATM   28  O   UNL     1      -3.142  -2.949   0.303  1.00  0.00           O  
HETATM   29  N   UNL     1      -2.421  -0.331  -0.523  1.00  0.00           N  
HETATM   30  C   UNL     1      -2.848   0.581   0.551  1.00  0.00           C  
HETATM   31  N   UNL     1      -4.946   0.900  -0.637  1.00  0.00           N  
HETATM   32  O   UNL     1      -7.128   0.557  -0.839  1.00  0.00           O  
HETATM   33  C   UNL     1      -8.047   2.305   0.931  1.00  0.00           C  
HETATM   34  H   UNL     1      -6.065   1.925   1.684  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.143   3.170   0.414  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.205   2.239   0.812  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.326   2.244  -0.739  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.401   1.119  -0.717  1.00  0.00           H  
HETATM   39  H   UNL     1       2.850  -2.104   1.201  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.181  -4.341   1.270  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.400  -1.396   0.862  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.035  -2.476  -0.408  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.198  -1.673  -1.922  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.230   0.380  -2.543  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.511  -0.677  -1.904  1.00  0.00           H  
HETATM   46  H   UNL     1       6.077   1.700   2.687  1.00  0.00           H  
HETATM   47  H   UNL     1       7.703   1.318   0.949  1.00  0.00           H  
HETATM   48  H   UNL     1       3.020   2.106   2.642  1.00  0.00           H  
HETATM   49  H   UNL     1       2.685   0.363   2.773  1.00  0.00           H  
HETATM   50  H   UNL     1       4.007   1.088   3.718  1.00  0.00           H  
HETATM   51  H   UNL     1       3.931  -1.006  -2.297  1.00  0.00           H  
HETATM   52  H   UNL     1       6.264  -0.892  -3.282  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.976   1.091   0.961  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.335   0.008   1.340  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.270   3.060   1.685  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.515   2.585  -0.013  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.436   1.340   1.257  1.00  0.00           H  
CONECT    1    2   33   34   35                                       
CONECT    2   31    1   32   32                                       
CONECT    3   30   31   36   37                                       
CONECT    4   25   25    5   38                                       
CONECT    5    6    6    4   19                                       
CONECT    6    7   20    5    5                                       
CONECT    7    8    8    6   39                                       
CONECT    8   26    7    7   25                                       
CONECT    9   26   26   10   40                                       
CONECT   10    9   28   27   27                                       
CONECT   11   28   12   41   42                                       
CONECT   12   11   29   13   43                                       
CONECT   13   12   31   44   45                                       
CONECT   14   15   15   24   46                                       
CONECT   15   16   14   14   47                                       
CONECT   16   23   23   17   15                                       
CONECT   17   21   21   16   20                                       
CONECT   18   24   48   49   50                                       
CONECT   19    5                                                      
CONECT   20   17    6   24   24                                       
CONECT   21   22   17   17   51                                       
CONECT   22   23   21   52                                            
CONECT   23   22   16   16                                            
CONECT   24   20   20   14   18                                       
CONECT   25    8   27    4    4                                       
CONECT   26    9    9    8                                            
CONECT   27   10   10   25   29                                       
CONECT   28   10   11                                                 
CONECT   29   27   12   30                                            
CONECT   30   29    3   53   54                                       
CONECT   31   13    3    2                                            
CONECT   32    2    2                                                 
CONECT   33    1   55   56   57                                       
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   33                                                      
CONECT   56   33                                                      
CONECT   57   33                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
