COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.306  -0.274   0.613  1.00  0.00           C  
HETATM    2  C   UNL     1       2.907   0.042   0.903  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.316   2.273  -1.629  1.00  0.00           C  
HETATM    4  C   UNL     1       6.430   0.554  -0.013  1.00  0.00           C  
HETATM    5  C   UNL     1       6.352   0.450  -1.537  1.00  0.00           C  
HETATM    6  C   UNL     1       6.502  -1.013  -1.957  1.00  0.00           C  
HETATM    7  F   UNL     1      -7.544  -0.453  -1.432  1.00  0.00           F  
HETATM    8  C   UNL     1       5.378  -1.841  -1.331  1.00  0.00           C  
HETATM    9  C   UNL     1       5.456  -1.737   0.194  1.00  0.00           C  
HETATM   10  C   UNL     1       0.431   0.416   1.114  1.00  0.00           C  
HETATM   11  C   UNL     1       1.611   0.551   0.444  1.00  0.00           C  
HETATM   12  N   UNL     1      -4.194   0.553   1.261  1.00  0.00           N  
HETATM   13  C   UNL     1      -3.125   0.313   0.435  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.024   0.967   0.999  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.466   1.593   2.167  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.747   1.349   2.322  1.00  0.00           N  
HETATM   17  C   UNL     1      -5.419   0.033   0.952  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.553  -0.718  -0.168  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.435  -0.946  -0.983  1.00  0.00           C  
HETATM   20  N   UNL     1      -3.270  -0.429  -0.668  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.643   0.991   0.456  1.00  0.00           C  
HETATM   22  S   UNL     1       1.340   1.429  -1.054  1.00  0.00           S  
HETATM   23  C   UNL     1      -0.327   1.580  -0.727  1.00  0.00           C  
HETATM   24  N   UNL     1       4.011   0.235   0.154  1.00  0.00           N  
HETATM   25  F   UNL     1       6.693  -2.223   0.632  1.00  0.00           F  
HETATM   26  O   UNL     1       2.986  -0.556   1.961  1.00  0.00           O  
HETATM   27  F   UNL     1       4.428  -2.494   0.766  1.00  0.00           F  
HETATM   28  N   UNL     1       6.285   1.960   0.390  1.00  0.00           N  
HETATM   29  C   UNL     1      -6.892  -1.305  -0.534  1.00  0.00           C  
HETATM   30  F   UNL     1      -7.669  -1.448   0.620  1.00  0.00           F  
HETATM   31  F   UNL     1      -6.706  -2.557  -1.130  1.00  0.00           F  
HETATM   32  C   UNL     1      -1.404   3.752  -1.248  1.00  0.00           C  
HETATM   33  H   UNL     1       5.361  -0.199   1.699  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.988   2.183  -2.665  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.296   1.810  -1.516  1.00  0.00           H  
HETATM   36  H   UNL     1       7.393   0.176   0.329  1.00  0.00           H  
HETATM   37  H   UNL     1       5.388   0.829  -1.878  1.00  0.00           H  
HETATM   38  H   UNL     1       7.153   1.040  -1.983  1.00  0.00           H  
HETATM   39  H   UNL     1       6.447  -1.087  -3.043  1.00  0.00           H  
HETATM   40  H   UNL     1       7.466  -1.392  -1.615  1.00  0.00           H  
HETATM   41  H   UNL     1       4.415  -1.463  -1.672  1.00  0.00           H  
HETATM   42  H   UNL     1       5.485  -2.884  -1.630  1.00  0.00           H  
HETATM   43  H   UNL     1       0.342  -0.094   2.062  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.854   2.182   2.834  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.270   0.219   1.591  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.533  -1.544  -1.877  1.00  0.00           H  
HETATM   47  H   UNL     1       3.948   0.711  -0.688  1.00  0.00           H  
HETATM   48  H   UNL     1       7.016   2.528  -0.011  1.00  0.00           H  
HETATM   49  H   UNL     1       5.374   2.315   0.142  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.119   4.253  -1.901  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.732   3.842  -0.213  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.424   4.215  -1.361  1.00  0.00           H  
CONECT    1    4    9   24   33                                       
CONECT    2   24   26   26   11                                       
CONECT    3   23   32   34   35                                       
CONECT    4    5   28    1   36                                       
CONECT    5    6    4   37   38                                       
CONECT    6    5    8   39   40                                       
CONECT    7   29                                                      
CONECT    8    6    9   41   42                                       
CONECT    9    8   25    1   27                                       
CONECT   10   11   11   21   43                                       
CONECT   11    2   10   10   22                                       
CONECT   12   13   17   16                                            
CONECT   13   20   12   14   14                                       
CONECT   14   13   13   21   15                                       
CONECT   15   14   16   16   44                                       
CONECT   16   12   15   15                                            
CONECT   17   18   18   12   45                                       
CONECT   18   29   19   17   17                                       
CONECT   19   18   20   20   46                                       
CONECT   20   19   19   13                                            
CONECT   21   10   14   23   23                                       
CONECT   22   11   23                                                 
CONECT   23   21   21   22    3                                       
CONECT   24    1    2   47                                            
CONECT   25    9                                                      
CONECT   26    2    2                                                 
CONECT   27    9                                                      
CONECT   28    4   48   49                                            
CONECT   29    7   30   31   18                                       
CONECT   30   29                                                      
CONECT   31   29                                                      
CONECT   32    3   50   51   52                                       
CONECT   33    1                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43   10                                                      
CONECT   44   15                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   24                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   32                                                      
CONECT   51   32                                                      
CONECT   52   32                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
