COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1       7.242  -0.977  -0.972  1.00  0.00          Cl  
HETATM    2  C   UNL     1       6.241   0.330  -0.423  1.00  0.00           C  
HETATM    3  C   UNL     1       6.802   1.386   0.282  1.00  0.00           C  
HETATM    4  O   UNL     1       8.136   1.399   0.542  1.00  0.00           O  
HETATM    5  C   UNL     1       8.644   2.517   1.272  1.00  0.00           C  
HETATM    6  C   UNL     1       5.999   2.429   0.720  1.00  0.00           C  
HETATM    7  C   UNL     1       4.643   2.414   0.454  1.00  0.00           C  
HETATM    8  C   UNL     1       4.885   0.323  -0.691  1.00  0.00           C  
HETATM    9  C   UNL     1       4.086   1.361  -0.248  1.00  0.00           C  
HETATM   10  C   UNL     1       2.608   1.351  -0.542  1.00  0.00           C  
HETATM   11  C   UNL     1       1.868   0.637   0.591  1.00  0.00           C  
HETATM   12  C   UNL     1       0.390   0.627   0.297  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.261  -0.348  -0.392  1.00  0.00           N  
HETATM   14  C   UNL     1       0.342  -1.553  -0.970  1.00  0.00           C  
HETATM   15  C   UNL     1       0.312  -2.682   0.062  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.082  -3.046   0.350  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.727  -3.640  -0.830  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.191  -3.948  -0.504  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.249  -4.808   0.637  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.631  -4.260   1.804  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.162  -3.956   1.502  1.00  0.00           C  
HETATM   22  C   UNL     1       1.051  -3.901  -0.496  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.595   0.006  -0.446  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.725  -0.578  -1.003  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.949   0.039  -0.883  1.00  0.00           C  
HETATM   26  N   UNL     1      -0.450   1.548   0.671  1.00  0.00           N  
HETATM   27  C   UNL     1      -1.698   1.229   0.239  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.943   1.850   0.358  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.063   1.256  -0.204  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.389   1.913  -0.081  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.111   2.149   1.054  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.721   1.792   2.465  1.00  0.00           C  
HETATM   33  O   UNL     1      -7.236   2.763   0.661  1.00  0.00           O  
HETATM   34  N   UNL     1      -7.270   2.917  -0.537  1.00  0.00           N  
HETATM   35  C   UNL     1      -6.204   2.450  -1.117  1.00  0.00           C  
HETATM   36  C   UNL     1      -5.894   2.470  -2.592  1.00  0.00           C  
HETATM   37  H   UNL     1       9.719   2.402   1.411  1.00  0.00           H  
HETATM   38  H   UNL     1       8.445   3.434   0.717  1.00  0.00           H  
HETATM   39  H   UNL     1       8.156   2.568   2.245  1.00  0.00           H  
HETATM   40  H   UNL     1       6.433   3.251   1.269  1.00  0.00           H  
HETATM   41  H   UNL     1       4.018   3.225   0.795  1.00  0.00           H  
HETATM   42  H   UNL     1       4.448  -0.496  -1.243  1.00  0.00           H  
HETATM   43  H   UNL     1       2.247   2.376  -0.623  1.00  0.00           H  
HETATM   44  H   UNL     1       2.428   0.827  -1.480  1.00  0.00           H  
HETATM   45  H   UNL     1       2.229  -0.388   0.672  1.00  0.00           H  
HETATM   46  H   UNL     1       2.048   1.161   1.530  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.222  -1.852  -1.853  1.00  0.00           H  
HETATM   48  H   UNL     1       1.374  -1.344  -1.250  1.00  0.00           H  
HETATM   49  H   UNL     1       0.798  -2.350   0.979  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.679  -2.939  -1.663  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.212  -4.563  -1.099  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.718  -3.019  -0.286  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.657  -4.441  -1.356  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.142  -3.340   2.089  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.694  -4.979   2.621  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.638  -4.883   1.270  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.701  -3.485   2.371  1.00  0.00           H  
HETATM   58  H   UNL     1       2.086  -3.631  -0.710  1.00  0.00           H  
HETATM   59  H   UNL     1       1.030  -4.706   0.239  1.00  0.00           H  
HETATM   60  H   UNL     1       0.565  -4.233  -1.413  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.643  -1.518  -1.529  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.826  -0.418  -1.317  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.034   2.786   0.888  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.165   2.618   2.908  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.619   1.601   3.053  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.096   0.899   2.454  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.282   1.563  -3.056  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.363   3.341  -3.049  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.815   2.520  -2.736  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    8    1    3    3                                       
CONECT    3    2    2    6    4                                       
CONECT    4    3    5                                                 
CONECT    5    4   37   38   39                                       
CONECT    6    7    7    3   40                                       
CONECT    7    9    6    6   41                                       
CONECT    8    9    9    2   42                                       
CONECT    9   10    8    8    7                                       
CONECT   10   11    9   43   44                                       
CONECT   11   10   12   45   46                                       
CONECT   12   26   26   11   13                                       
CONECT   13   12   23   14                                            
CONECT   14   13   15   47   48                                       
CONECT   15   14   22   16   49                                       
CONECT   16   15   21   17                                            
CONECT   17   16   18   50   51                                       
CONECT   18   17   19   52   53                                       
CONECT   19   20   18                                                 
CONECT   20   21   19   54   55                                       
CONECT   21   16   20   56   57                                       
CONECT   22   15   58   59   60                                       
CONECT   23   27   13   24   24                                       
CONECT   24   23   23   25   61                                       
CONECT   25   29   29   24   62                                       
CONECT   26   27   12   12                                            
CONECT   27   26   28   28   23                                       
CONECT   28   27   27   29   63                                       
CONECT   29   28   30   25   25                                       
CONECT   30   31   31   29   35                                       
CONECT   31   32   33   30   30                                       
CONECT   32   31   64   65   66                                       
CONECT   33   31   34                                                 
CONECT   34   33   35   35                                            
CONECT   35   34   34   30   36                                       
CONECT   36   35   67   68   69                                       
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   28                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   36                                                      
CONECT   68   36                                                      
CONECT   69   36                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
