COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.244  -0.468   1.708  1.00  0.00           C  
HETATM    2  C   UNL     1       6.748   3.225   1.176  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.576  -0.146   1.543  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.224  -0.458   0.350  1.00  0.00           C  
HETATM    5  C   UNL     1       4.219   3.133   1.759  1.00  0.00           C  
HETATM    6  C   UNL     1       5.979   3.603  -0.092  1.00  0.00           C  
HETATM    7  C   UNL     1       1.903  -1.445   0.874  1.00  0.00           C  
HETATM    8  C   UNL     1       0.449  -1.095   0.688  1.00  0.00           C  
HETATM    9  C   UNL     1       4.300   1.210  -2.255  1.00  0.00           C  
HETATM   10  C   UNL     1       4.256  -0.294  -2.530  1.00  0.00           C  
HETATM   11  C   UNL     1       5.046  -0.604  -3.803  1.00  0.00           C  
HETATM   12  C   UNL     1       4.875  -1.046  -1.350  1.00  0.00           C  
HETATM   13  C   UNL     1       4.029  -0.813  -0.096  1.00  0.00           C  
HETATM   14  C   UNL     1       4.100   0.641   0.294  1.00  0.00           C  
HETATM   15  O   UNL     1       3.082   1.292   0.392  1.00  0.00           O  
HETATM   16  N   UNL     1       5.294   1.216   0.536  1.00  0.00           N  
HETATM   17  C   UNL     1       5.363   2.630   0.915  1.00  0.00           C  
HETATM   18  N   UNL     1       3.213   3.695   1.203  1.00  0.00           N  
HETATM   19  N   UNL     1       2.634  -1.179  -0.372  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.522  -1.096  -0.672  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.188  -1.403  -0.501  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.656  -0.115   0.167  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.304  -0.428  -1.026  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.636  -0.106  -1.190  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.328   0.525  -0.173  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.690   0.838   1.014  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.359   0.517   1.191  1.00  0.00           C  
HETATM   28  S   UNL     1      -8.028   0.933  -0.389  1.00  0.00           S  
HETATM   29  O   UNL     1      -8.236   2.040   0.477  1.00  0.00           O  
HETATM   30  O   UNL     1      -8.180   1.066  -1.796  1.00  0.00           O  
HETATM   31  C   UNL     1      -8.924  -0.525   0.213  1.00  0.00           C  
HETATM   32  C   UNL     1       2.029  -2.927   1.233  1.00  0.00           C  
HETATM   33  F   UNL     1       1.596  -3.707   0.154  1.00  0.00           F  
HETATM   34  F   UNL     1       3.366  -3.226   1.517  1.00  0.00           F  
HETATM   35  F   UNL     1       1.240  -3.204   2.354  1.00  0.00           F  
HETATM   36  F   UNL     1       2.927  -0.700  -2.695  1.00  0.00           F  
HETATM   37  H   UNL     1       0.258  -0.226   2.632  1.00  0.00           H  
HETATM   38  H   UNL     1       7.608   2.565   1.065  1.00  0.00           H  
HETATM   39  H   UNL     1       6.832   3.980   1.958  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.116   0.348   2.338  1.00  0.00           H  
HETATM   41  H   UNL     1       4.249   3.019   2.832  1.00  0.00           H  
HETATM   42  H   UNL     1       5.558   4.607  -0.144  1.00  0.00           H  
HETATM   43  H   UNL     1       6.334   3.191  -1.037  1.00  0.00           H  
HETATM   44  H   UNL     1       2.322  -0.840   1.678  1.00  0.00           H  
HETATM   45  H   UNL     1       4.031   1.753  -3.162  1.00  0.00           H  
HETATM   46  H   UNL     1       3.594   1.456  -1.462  1.00  0.00           H  
HETATM   47  H   UNL     1       5.306   1.494  -1.947  1.00  0.00           H  
HETATM   48  H   UNL     1       6.081  -0.289  -3.674  1.00  0.00           H  
HETATM   49  H   UNL     1       5.014  -1.676  -3.998  1.00  0.00           H  
HETATM   50  H   UNL     1       4.604  -0.069  -4.643  1.00  0.00           H  
HETATM   51  H   UNL     1       4.906  -2.112  -1.574  1.00  0.00           H  
HETATM   52  H   UNL     1       5.888  -0.682  -1.178  1.00  0.00           H  
HETATM   53  H   UNL     1       4.411  -1.428   0.719  1.00  0.00           H  
HETATM   54  H   UNL     1       6.109   0.695   0.458  1.00  0.00           H  
HETATM   55  H   UNL     1       2.477   4.018   1.745  1.00  0.00           H  
HETATM   56  H   UNL     1       2.584  -1.970  -0.996  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.019  -1.341  -1.599  1.00  0.00           H  
HETATM   58  H   UNL     1       0.359  -1.893  -1.293  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.764  -0.921  -1.821  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.139  -0.348  -2.115  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.235   1.332   1.805  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.862   0.762   2.118  1.00  0.00           H  
HETATM   63  H   UNL     1      -8.677  -0.695   1.261  1.00  0.00           H  
HETATM   64  H   UNL     1      -9.997  -0.358   0.115  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.636  -1.396  -0.375  1.00  0.00           H  
CONECT    1    8    3    3   37                                       
CONECT    2    6   17   38   39                                       
CONECT    3    1    1    4   40                                       
CONECT    4   20   20    3   22                                       
CONECT    5   17   18   18   41                                       
CONECT    6    2   17   42   43                                       
CONECT    7   32    8   19   44                                       
CONECT    8    7   21   21    1                                       
CONECT    9   10   45   46   47                                       
CONECT   10    9   11   12   36                                       
CONECT   11   10   48   49   50                                       
CONECT   12   13   10   51   52                                       
CONECT   13   19   14   12   53                                       
CONECT   14   13   16   15   15                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   54                                            
CONECT   17    6   16    2    5                                       
CONECT   18    5    5   55                                            
CONECT   19    7   13   56                                            
CONECT   20   21    4    4   57                                       
CONECT   21    8    8   20   58                                       
CONECT   22   27    4   23   23                                       
CONECT   23   22   22   24   59                                       
CONECT   24   25   25   23   60                                       
CONECT   25   26   28   24   24                                       
CONECT   26   27   27   25   61                                       
CONECT   27   26   26   22   62                                       
CONECT   28   29   29   25   30                                       
CONECT   28   30   31                                                 
CONECT   29   28   28                                                 
CONECT   30   28   28                                                 
CONECT   31   28   63   64   65                                       
CONECT   32   33   34   35    7                                       
CONECT   33   32                                                      
CONECT   34   32                                                      
CONECT   35   32                                                      
CONECT   36   10                                                      
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   12                                                      
CONECT   52   12                                                      
CONECT   53   13                                                      
CONECT   54   16                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   31                                                      
CONECT   64   31                                                      
CONECT   65   31                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
