COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.998  -2.701  -2.069  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.895  -0.793   0.572  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.543   0.091   0.283  1.00  0.00           C  
HETATM    4  C   UNL     1       9.339   0.819   0.249  1.00  0.00           C  
HETATM    5  C   UNL     1       7.847   1.031   0.297  1.00  0.00           C  
HETATM    6  C   UNL     1       7.332   2.314   0.279  1.00  0.00           C  
HETATM    7  C   UNL     1       5.966   2.512   0.322  1.00  0.00           C  
HETATM    8  C   UNL     1       5.109   1.420   0.384  1.00  0.00           C  
HETATM    9  C   UNL     1       2.715  -0.024   0.513  1.00  0.00           C  
HETATM   10  C   UNL     1       2.583  -2.064  -0.741  1.00  0.00           C  
HETATM   11  C   UNL     1       1.058  -2.102  -0.611  1.00  0.00           C  
HETATM   12  C   UNL     1       0.647  -1.410   0.692  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.621  -0.440   0.233  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.145  -0.082   0.202  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.380  -0.572   0.629  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.483   1.243  -0.493  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.253   1.734  -0.920  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.087   1.077  -0.572  1.00  0.00           C  
HETATM   19  C   UNL     1       1.195   0.021   0.693  1.00  0.00           C  
HETATM   20  C   UNL     1       5.631   0.132   0.403  1.00  0.00           C  
HETATM   21  C   UNL     1       6.997  -0.059   0.353  1.00  0.00           C  
HETATM   22  F   UNL     1      -5.439  -1.694   1.379  1.00  0.00           F  
HETATM   23  F   UNL     1      -7.739  -0.383   0.696  1.00  0.00           F  
HETATM   24  F   UNL     1      -5.198   2.853  -1.674  1.00  0.00           F  
HETATM   25  F   UNL     1      -2.893   1.554  -0.987  1.00  0.00           F  
HETATM   26  N   UNL     1      -0.815  -1.374   0.788  1.00  0.00           N  
HETATM   27  N   UNL     1      -7.662   1.910  -0.847  1.00  0.00           N  
HETATM   28  N   UNL     1      -2.791  -1.917   1.303  1.00  0.00           N  
HETATM   29  N   UNL     1      -1.548  -2.226   1.414  1.00  0.00           N  
HETATM   30  O   UNL     1       3.030  -0.707  -0.702  1.00  0.00           O  
HETATM   31  O   UNL     1       4.423  -2.770  -2.139  1.00  0.00           O  
HETATM   32  O   UNL     1       0.468  -1.421  -1.720  1.00  0.00           O  
HETATM   33  O   UNL     1       0.880   0.652   1.935  1.00  0.00           O  
HETATM   34  S   UNL     1       3.366   1.668   0.441  1.00  0.00           S  
HETATM   35  H   UNL     1       2.581  -3.706  -2.136  1.00  0.00           H  
HETATM   36  H   UNL     1       2.622  -2.096  -2.895  1.00  0.00           H  
HETATM   37  H   UNL     1       9.735   0.797   1.264  1.00  0.00           H  
HETATM   38  H   UNL     1       9.556  -0.128  -0.246  1.00  0.00           H  
HETATM   39  H   UNL     1       9.804   1.634  -0.305  1.00  0.00           H  
HETATM   40  H   UNL     1       7.999   3.162   0.231  1.00  0.00           H  
HETATM   41  H   UNL     1       5.565   3.514   0.308  1.00  0.00           H  
HETATM   42  H   UNL     1       3.165  -0.551   1.354  1.00  0.00           H  
HETATM   43  H   UNL     1       3.031  -2.618   0.084  1.00  0.00           H  
HETATM   44  H   UNL     1       0.719  -3.138  -0.597  1.00  0.00           H  
HETATM   45  H   UNL     1       1.055  -1.957   1.541  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.318   0.412  -0.358  1.00  0.00           H  
HETATM   47  H   UNL     1       0.748   0.583  -0.127  1.00  0.00           H  
HETATM   48  H   UNL     1       4.967  -0.719   0.451  1.00  0.00           H  
HETATM   49  H   UNL     1       7.403  -1.060   0.363  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.520   1.569  -0.550  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.621   2.714  -1.388  1.00  0.00           H  
HETATM   52  H   UNL     1       4.758  -3.164  -2.956  1.00  0.00           H  
HETATM   53  H   UNL     1       0.690  -1.803  -2.580  1.00  0.00           H  
HETATM   54  H   UNL     1       1.202   1.561   2.007  1.00  0.00           H  
CONECT    1   10   31   35   36                                       
CONECT    2   28   13   13   14                                       
CONECT    3   15   15   16   23                                       
CONECT    4    5   37   38   39                                       
CONECT    5    4    6    6   21                                       
CONECT    6    5    5    7   40                                       
CONECT    7    6    8    8   41                                       
CONECT    8    7    7   20   34                                       
CONECT    9   34   19   30   42                                       
CONECT   10   30   11    1   43                                       
CONECT   11   12   10   32   44                                       
CONECT   12   26   19   11   45                                       
CONECT   13   26    2    2   46                                       
CONECT   14    2   18   18   15                                       
CONECT   15   14   22    3    3                                       
CONECT   16   17   17   27    3                                       
CONECT   17   24   18   16   16                                       
CONECT   18   25   14   14   17                                       
CONECT   19   33    9   12   47                                       
CONECT   20   21   21    8   48                                       
CONECT   21    5   20   20   49                                       
CONECT   22   15                                                      
CONECT   23    3                                                      
CONECT   24   17                                                      
CONECT   25   18                                                      
CONECT   26   29   12   13                                            
CONECT   27   16   50   51                                            
CONECT   28   29   29    2                                            
CONECT   29   28   28   26                                            
CONECT   30    9   10                                                 
CONECT   31    1   52                                                 
CONECT   32   11   53                                                 
CONECT   33   19   54                                                 
CONECT   34    8    9                                                 
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
CONECT   54   33                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
