COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.385   1.312  -1.943  1.00  0.00           N  
HETATM    2  O   UNL     1       2.809   1.956  -1.619  1.00  0.00           O  
HETATM    3  O   UNL     1       3.301  -1.224   0.703  1.00  0.00           O  
HETATM    4  O   UNL     1      -6.678   0.452  -1.979  1.00  0.00           O  
HETATM    5  O   UNL     1      -7.267  -1.552  -0.654  1.00  0.00           O  
HETATM    6  O   UNL     1       1.492  -2.957   1.501  1.00  0.00           O  
HETATM    7  F   UNL     1      10.245  -0.463   1.041  1.00  0.00           F  
HETATM    8  F   UNL     1       6.033   1.542   1.871  1.00  0.00           F  
HETATM    9  C   UNL     1      -8.592   2.331   2.321  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.002   2.899   1.208  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.572   0.959   2.490  1.00  0.00           C  
HETATM   12  C   UNL     1       8.812   0.048  -0.776  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.394   2.095   0.262  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.964   0.155   1.544  1.00  0.00           C  
HETATM   15  C   UNL     1       7.616   0.559  -1.244  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.288  -2.452   0.124  1.00  0.00           C  
HETATM   17  C   UNL     1       8.142   0.539   1.473  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.721  -0.515  -1.156  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.096  -1.316  -1.196  1.00  0.00           C  
HETATM   20  C   UNL     1       5.380   1.618  -0.868  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.881  -0.439  -0.219  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.047  -2.575   0.545  1.00  0.00           N  
HETATM   23  N   UNL     1       4.302   0.663  -0.600  1.00  0.00           N  
HETATM   24  C   UNL     1       3.039   0.951  -0.973  1.00  0.00           C  
HETATM   25  C   UNL     1       9.076   0.037   0.584  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.667  -1.429  -0.732  1.00  0.00           C  
HETATM   27  C   UNL     1       0.650   0.266  -1.101  1.00  0.00           C  
HETATM   28  C   UNL     1       6.945   1.052   1.003  1.00  0.00           C  
HETATM   29  C   UNL     1       6.683   1.061  -0.356  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.376   0.723   0.430  1.00  0.00           C  
HETATM   31  C   UNL     1       1.942   0.052  -0.600  1.00  0.00           C  
HETATM   32  C   UNL     1       2.177  -1.041   0.270  1.00  0.00           C  
HETATM   33  C   UNL     1      -0.408  -0.665  -0.695  1.00  0.00           C  
HETATM   34  C   UNL     1      -0.096  -1.728   0.172  1.00  0.00           C  
HETATM   35  N   UNL     1       1.194  -1.882   0.629  1.00  0.00           N  
HETATM   36  S   UNL     1      -6.602  -0.302  -0.777  1.00  0.00           S  
HETATM   37  H   UNL     1       1.077   1.963  -2.141  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.493   1.401  -2.345  1.00  0.00           H  
HETATM   39  H   UNL     1       2.418  -2.996   1.776  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.062   2.959   3.063  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.017   3.970   1.076  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.032   0.515   3.360  1.00  0.00           H  
HETATM   43  H   UNL     1       9.538  -0.348  -1.470  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.934   2.538  -0.609  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.950  -0.917   1.675  1.00  0.00           H  
HETATM   46  H   UNL     1       7.411   0.567  -2.304  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.029  -3.167   0.450  1.00  0.00           H  
HETATM   48  H   UNL     1       8.348   0.532   2.534  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.987   0.292  -1.823  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.545  -2.308  -1.235  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.121  -0.866  -2.188  1.00  0.00           H  
HETATM   52  H   UNL     1       5.455   1.789  -1.942  1.00  0.00           H  
HETATM   53  H   UNL     1       5.165   2.560  -0.364  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.856  -0.889   0.774  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.432   0.553  -0.179  1.00  0.00           H  
HETATM   56  H   UNL     1       4.497  -0.176  -0.154  1.00  0.00           H  
CONECT    1   27   37   38                                            
CONECT    2   24   24                                                 
CONECT    3   32   32                                                 
CONECT    4   36   36                                                 
CONECT    5   36   36                                                 
CONECT    6   35   39                                                 
CONECT    7   25                                                      
CONECT    8   28                                                      
CONECT    9   10   10   11   40                                       
CONECT   10    9    9   13   41                                       
CONECT   11    9   14   14   42                                       
CONECT   12   15   15   25   43                                       
CONECT   13   10   30   30   44                                       
CONECT   14   11   11   30   45                                       
CONECT   15   12   12   29   46                                       
CONECT   16   22   22   26   47                                       
CONECT   17   25   25   28   48                                       
CONECT   18   26   26   33   49                                       
CONECT   19   21   26   50   51                                       
CONECT   20   23   29   52   53                                       
CONECT   21   19   36   54   55                                       
CONECT   22   16   16   34                                            
CONECT   23   20   24   56                                            
CONECT   24    2    2   23   31                                       
CONECT   25    7   12   17   17                                       
CONECT   26   16   18   18   19                                       
CONECT   27    1   31   31   33                                       
CONECT   28    8   17   29   29                                       
CONECT   29   15   20   28   28                                       
CONECT   30   13   13   14   36                                       
CONECT   31   24   27   27   32                                       
CONECT   32    3    3   31   35                                       
CONECT   33   18   27   34   34                                       
CONECT   34   22   33   33   35                                       
CONECT   35    6   32   34                                            
CONECT   36    4    4    5    5                                       
CONECT   36   21   30                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    6                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   23                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
