COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.092  -1.498  -0.558  1.00  0.00           C  
HETATM    2  C   UNL     1       4.858   1.034   0.421  1.00  0.00           C  
HETATM    3  C   UNL     1       7.383   0.174  -1.868  1.00  0.00           C  
HETATM    4  C   UNL     1       4.781   1.167   1.920  1.00  0.00           C  
HETATM    5  C   UNL     1       1.407   0.883   0.039  1.00  0.00           C  
HETATM    6  C   UNL     1       1.482  -0.291  -0.700  1.00  0.00           C  
HETATM    7  C   UNL     1       0.349  -1.058  -0.891  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.858  -0.658  -0.348  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.936   0.510   0.388  1.00  0.00           C  
HETATM   10  C   UNL     1       0.192   1.282   0.583  1.00  0.00           C  
HETATM   11  C   UNL     1       4.074  -0.968   2.747  1.00  0.00           C  
HETATM   12  C   UNL     1       5.727   2.277   2.382  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.923  -2.841   0.155  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.379  -0.595   1.433  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.219  -0.343  -0.840  1.00  0.00           C  
HETATM   16  N   UNL     1       5.004   0.801  -2.300  1.00  0.00           N  
HETATM   17  C   UNL     1       3.765   1.281  -0.352  1.00  0.00           C  
HETATM   18  C   UNL     1       3.867   1.155  -1.750  1.00  0.00           C  
HETATM   19  N   UNL     1       2.551   1.659   0.239  1.00  0.00           N  
HETATM   20  C   UNL     1       6.085   0.555  -1.548  1.00  0.00           C  
HETATM   21  N   UNL     1       6.028   0.667  -0.183  1.00  0.00           N  
HETATM   22  N   UNL     1       7.295   0.353   0.323  1.00  0.00           N  
HETATM   23  C   UNL     1       8.093   0.062  -0.682  1.00  0.00           C  
HETATM   24 CL   UNL     1       9.763  -0.391  -0.544  1.00  0.00          Cl  
HETATM   25  N   UNL     1      -3.258  -0.799  -0.013  1.00  0.00           N  
HETATM   26  O   UNL     1       5.162  -0.068   2.529  1.00  0.00           O  
HETATM   27  F   UNL     1      -0.809  -3.509  -0.366  1.00  0.00           F  
HETATM   28  F   UNL     1      -1.736  -2.622   1.524  1.00  0.00           F  
HETATM   29  F   UNL     1      -3.068  -3.621  -0.040  1.00  0.00           F  
HETATM   30  O   UNL     1      -4.172  -0.601  -2.024  1.00  0.00           O  
HETATM   31  C   UNL     1      -5.352   0.487  -0.295  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.106   1.132  -1.454  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.092   2.174  -0.921  1.00  0.00           C  
HETATM   34  S   UNL     1      -8.339   1.340   0.104  1.00  0.00           S  
HETATM   35  C   UNL     1      -7.288   0.453   1.291  1.00  0.00           C  
HETATM   36  C   UNL     1      -6.282  -0.406   0.521  1.00  0.00           C  
HETATM   37  O   UNL     1      -9.085   2.325   0.804  1.00  0.00           O  
HETATM   38  O   UNL     1      -9.023   0.387  -0.698  1.00  0.00           O  
HETATM   39  H   UNL     1      -2.237  -1.669  -1.625  1.00  0.00           H  
HETATM   40  H   UNL     1       7.769  -0.003  -2.861  1.00  0.00           H  
HETATM   41  H   UNL     1       3.760   1.416   2.210  1.00  0.00           H  
HETATM   42  H   UNL     1       2.424  -0.603  -1.125  1.00  0.00           H  
HETATM   43  H   UNL     1       0.406  -1.970  -1.466  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.881   0.819   0.811  1.00  0.00           H  
HETATM   45  H   UNL     1       0.131   2.192   1.162  1.00  0.00           H  
HETATM   46  H   UNL     1       3.605  -1.211   1.794  1.00  0.00           H  
HETATM   47  H   UNL     1       4.446  -1.881   3.212  1.00  0.00           H  
HETATM   48  H   UNL     1       3.341  -0.499   3.404  1.00  0.00           H  
HETATM   49  H   UNL     1       5.436   3.220   1.918  1.00  0.00           H  
HETATM   50  H   UNL     1       5.671   2.374   3.467  1.00  0.00           H  
HETATM   51  H   UNL     1       6.748   2.029   2.092  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.851  -1.467   1.885  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.388  -0.454   1.865  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.988   0.289   1.626  1.00  0.00           H  
HETATM   55  H   UNL     1       3.006   1.349  -2.372  1.00  0.00           H  
HETATM   56  H   UNL     1       2.506   2.458   0.786  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.947   1.268   0.349  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.395   1.616  -2.124  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.654   0.365  -2.000  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.557   2.908  -0.318  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.581   2.675  -1.757  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.755   1.171   1.914  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.908  -0.187   1.920  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.818  -1.079  -0.148  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.693  -0.992   1.226  1.00  0.00           H  
CONECT    1   25   13    8   39                                       
CONECT    2    4   17   17   21                                       
CONECT    3   23   20   20   40                                       
CONECT    4   12   26    2   41                                       
CONECT    5    6    6   10   19                                       
CONECT    6    7    5    5   42                                       
CONECT    7    8    8    6   43                                       
CONECT    8    1    7    7    9                                       
CONECT    9    8   10   10   44                                       
CONECT   10    9    9    5   45                                       
CONECT   11   26   46   47   48                                       
CONECT   12    4   49   50   51                                       
CONECT   13   29   27    1   28                                       
CONECT   14   25   52   53   54                                       
CONECT   15   31   25   30   30                                       
CONECT   16   18   18   20                                            
CONECT   17   19    2    2   18                                       
CONECT   18   17   16   16   55                                       
CONECT   19    5   17   56                                            
CONECT   20   21   16    3    3                                       
CONECT   21    2   22   20                                            
CONECT   22   21   23   23                                            
CONECT   23   22   22   24    3                                       
CONECT   24   23                                                      
CONECT   25   14   15    1                                            
CONECT   26    4   11                                                 
CONECT   27   13                                                      
CONECT   28   13                                                      
CONECT   29   13                                                      
CONECT   30   15   15                                                 
CONECT   31   36   32   15   57                                       
CONECT   32   33   31   58   59                                       
CONECT   33   34   32   60   61                                       
CONECT   34   37   37   35   33                                       
CONECT   34   38   38                                                 
CONECT   35   34   36   62   63                                       
CONECT   36   35   31   64   65                                       
CONECT   37   34   34                                                 
CONECT   38   34   34                                                 
CONECT   39    1                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
CONECT   62   35                                                      
CONECT   63   35                                                      
CONECT   64   36                                                      
CONECT   65   36                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
