COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.987  -1.300  -0.435  1.00  0.00           C  
HETATM    2  C   UNL     1       4.560  -2.614  -0.382  1.00  0.00           C  
HETATM    3  O   UNL     1       1.037   0.135   2.103  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.336   0.730   0.784  1.00  0.00           C  
HETATM    5  C   UNL     1       5.461  -3.720  -0.868  1.00  0.00           C  
HETATM    6  C   UNL     1       3.306  -2.913   0.118  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.879   0.403   1.298  1.00  0.00           C  
HETATM    8  C   UNL     1       4.162  -0.286   0.016  1.00  0.00           C  
HETATM    9  C   UNL     1       0.750   3.461  -0.835  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.506   0.341   1.689  1.00  0.00           O  
HETATM   11  N   UNL     1       0.855   1.114  -0.155  1.00  0.00           N  
HETATM   12  C   UNL     1      -4.506  -2.229  -1.464  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.223  -3.590  -0.824  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.938  -0.597  -0.423  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.594   0.163   0.695  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.419   0.543  -0.243  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.766  -0.211  -1.357  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.024  -0.777  -1.447  1.00  0.00           C  
HETATM   19  O   UNL     1       2.697   1.833   1.321  1.00  0.00           O  
HETATM   20  C   UNL     1       2.911  -0.586   0.520  1.00  0.00           C  
HETATM   21  C   UNL     1       2.840  -4.345   0.176  1.00  0.00           C  
HETATM   22  C   UNL     1       2.479  -1.899   0.563  1.00  0.00           C  
HETATM   23  C   UNL     1       1.299   2.073  -1.170  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.219  -1.166  -0.497  1.00  0.00           N  
HETATM   25  C   UNL     1      -5.184  -0.718   0.336  1.00  0.00           C  
HETATM   26  O   UNL     1      -6.290  -1.215   0.311  1.00  0.00           O  
HETATM   27  F   UNL     1       1.121   3.807   0.468  1.00  0.00           F  
HETATM   28  F   UNL     1       1.272   4.398  -1.733  1.00  0.00           F  
HETATM   29  F   UNL     1      -0.646   3.447  -0.935  1.00  0.00           F  
HETATM   30  S   UNL     1       1.860   0.706   1.096  1.00  0.00           S  
HETATM   31  H   UNL     1       5.966  -1.067  -0.825  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.067   1.319   1.649  1.00  0.00           H  
HETATM   33  H   UNL     1       6.075  -4.077  -0.041  1.00  0.00           H  
HETATM   34  H   UNL     1       4.854  -4.540  -1.251  1.00  0.00           H  
HETATM   35  H   UNL     1       6.104  -3.341  -1.662  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.512   0.306   2.180  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.076   1.359   0.813  1.00  0.00           H  
HETATM   38  H   UNL     1       4.496   0.740  -0.026  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.874  -2.102  -2.342  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.554  -2.178  -1.760  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.175  -3.641  -0.528  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.856  -3.717   0.054  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.437  -4.380  -1.544  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.052  -0.354  -2.154  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.293  -1.362  -2.314  1.00  0.00           H  
HETATM   46  H   UNL     1       3.125  -4.781   1.134  1.00  0.00           H  
HETATM   47  H   UNL     1       1.755  -4.379   0.070  1.00  0.00           H  
HETATM   48  H   UNL     1       3.302  -4.911  -0.633  1.00  0.00           H  
HETATM   49  H   UNL     1       1.501  -2.133   0.958  1.00  0.00           H  
HETATM   50  H   UNL     1       0.932   1.763  -2.148  1.00  0.00           H  
HETATM   51  H   UNL     1       2.388   2.107  -1.185  1.00  0.00           H  
CONECT    1    8    2    2   31                                       
CONECT    2    1    1    6    5                                       
CONECT    3   30   30                                                 
CONECT    4   16   15   15   32                                       
CONECT    5    2   33   34   35                                       
CONECT    6   22   22   21    2                                       
CONECT    7   25   10   36   37                                       
CONECT    8   20   20    1   38                                       
CONECT    9   29   28   23   27                                       
CONECT   10   15    7                                                 
CONECT   11   23   16   30                                            
CONECT   12   24   13   39   40                                       
CONECT   13   12   41   42   43                                       
CONECT   14   18   18   15   24                                       
CONECT   15    4    4   14   10                                       
CONECT   16   11   17   17    4                                       
CONECT   17   16   16   18   44                                       
CONECT   18   17   14   14   45                                       
CONECT   19   30   30                                                 
CONECT   20   30    8    8   22                                       
CONECT   21    6   46   47   48                                       
CONECT   22   20    6    6   49                                       
CONECT   23    9   11   50   51                                       
CONECT   24   14   12   25                                            
CONECT   25   24    7   26   26                                       
CONECT   26   25   25                                                 
CONECT   27    9                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30   11    3    3   19                                       
CONECT   30   19   20                                                 
CONECT   31    1                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
