COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.455   2.760  -0.367  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.917   1.573  -1.215  1.00  0.00           C  
HETATM    3  O   UNL     1       5.776   0.270   2.527  1.00  0.00           O  
HETATM    4  C   UNL     1      -4.166   0.384  -0.323  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.387   0.047   0.309  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.162  -1.116   1.028  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.260  -0.572   0.025  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.859  -0.626  -0.409  1.00  0.00           C  
HETATM    9  C   UNL     1       0.299  -1.625  -0.317  1.00  0.00           C  
HETATM   10  C   UNL     1       0.985  -0.422  -0.416  1.00  0.00           C  
HETATM   11  C   UNL     1       2.329  -0.419  -0.731  1.00  0.00           C  
HETATM   12  C   UNL     1       2.993  -1.615  -0.947  1.00  0.00           C  
HETATM   13  C   UNL     1       2.311  -2.815  -0.849  1.00  0.00           C  
HETATM   14  C   UNL     1       0.966  -2.823  -0.534  1.00  0.00           C  
HETATM   15  C   UNL     1       5.684   0.597   0.135  1.00  0.00           C  
HETATM   16  C   UNL     1       6.010  -0.376   1.274  1.00  0.00           C  
HETATM   17  C   UNL     1       4.009   1.682   1.679  1.00  0.00           C  
HETATM   18  C   UNL     1       4.417   0.655   2.742  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.180  -1.845   1.867  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.650   0.787   0.219  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.594   0.530  -0.927  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.883  -1.479   0.855  1.00  0.00           N  
HETATM   23  N   UNL     1      -1.063  -1.631   0.008  1.00  0.00           N  
HETATM   24  N   UNL     1       4.330   1.129   0.353  1.00  0.00           N  
HETATM   25  O   UNL     1      -6.934   1.606   1.067  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.416   0.236  -1.145  1.00  0.00           O  
HETATM   27  O   UNL     1       3.923   1.057  -2.080  1.00  0.00           O  
HETATM   28  O   UNL     1       2.264   2.131  -0.551  1.00  0.00           O  
HETATM   29  S   UNL     1       3.201   1.108  -0.858  1.00  0.00           S  
HETATM   30  F   UNL     1       4.309  -1.609  -1.256  1.00  0.00           F  
HETATM   31  H   UNL     1      -4.226   3.008   0.362  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.534   2.497   0.154  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.274   3.619  -1.013  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.838   1.836  -1.736  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.145   1.325  -1.944  1.00  0.00           H  
HETATM   36  H   UNL     1       0.467   0.511  -0.248  1.00  0.00           H  
HETATM   37  H   UNL     1       2.831  -3.747  -1.018  1.00  0.00           H  
HETATM   38  H   UNL     1       0.435  -3.760  -0.457  1.00  0.00           H  
HETATM   39  H   UNL     1       6.405   1.415   0.134  1.00  0.00           H  
HETATM   40  H   UNL     1       5.723   0.073  -0.819  1.00  0.00           H  
HETATM   41  H   UNL     1       7.056  -0.676   1.208  1.00  0.00           H  
HETATM   42  H   UNL     1       5.373  -1.257   1.194  1.00  0.00           H  
HETATM   43  H   UNL     1       2.938   1.875   1.747  1.00  0.00           H  
HETATM   44  H   UNL     1       4.560   2.609   1.834  1.00  0.00           H  
HETATM   45  H   UNL     1       3.773  -0.221   2.667  1.00  0.00           H  
HETATM   46  H   UNL     1       4.316   1.098   3.733  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.222  -1.397   2.860  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.160  -1.773   1.394  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.896  -2.894   1.954  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.215  -0.294  -1.532  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.578   0.271  -0.536  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.672   1.427  -1.541  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.463  -2.260   1.250  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.433  -2.358   0.532  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    4    1   34   35                                       
CONECT    3   16   18                                                 
CONECT    4    5    7    7    2                                       
CONECT    5    6    6   20    4                                       
CONECT    6   19   22    5    5                                       
CONECT    7   22    8    4    4                                       
CONECT    8   26   26    7   23                                       
CONECT    9   10   23   14   14                                       
CONECT   10   11   11    9   36                                       
CONECT   11   29   10   10   12                                       
CONECT   12   11   30   13   13                                       
CONECT   13   12   12   14   37                                       
CONECT   14    9    9   13   38                                       
CONECT   15   16   24   39   40                                       
CONECT   16    3   15   41   42                                       
CONECT   17   18   24   43   44                                       
CONECT   18    3   17   45   46                                       
CONECT   19    6   47   48   49                                       
CONECT   20   25   25    5   21                                       
CONECT   21   20   50   51   52                                       
CONECT   22    6    7   53                                            
CONECT   23    8    9   54                                            
CONECT   24   15   17   29                                            
CONECT   25   20   20                                                 
CONECT   26    8    8                                                 
CONECT   27   29   29                                                 
CONECT   28   29   29                                                 
CONECT   29   24   27   27   11                                       
CONECT   29   28   28                                                 
CONECT   30   12                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36   10                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
