COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.956  -1.904   0.506  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.134   0.272   0.305  1.00  0.00           C  
HETATM    3  C   UNL     1       5.918  -0.897   0.008  1.00  0.00           C  
HETATM    4  C   UNL     1       5.395  -0.077   1.189  1.00  0.00           C  
HETATM    5  C   UNL     1       0.143   2.584  -0.567  1.00  0.00           C  
HETATM    6  C   UNL     1       4.373   0.916   0.698  1.00  0.00           C  
HETATM    7  C   UNL     1       2.343   1.671   0.165  1.00  0.00           C  
HETATM    8  C   UNL     1       3.023   2.793  -0.154  1.00  0.00           C  
HETATM    9  C   UNL     1       0.875   1.548   0.017  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.216   2.471  -0.705  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.868   1.311  -0.275  1.00  0.00           C  
HETATM   12  N   UNL     1       3.108   0.688   0.619  1.00  0.00           N  
HETATM   13  N   UNL     1      -3.957   0.065  -0.019  1.00  0.00           N  
HETATM   14  C   UNL     1       8.605  -3.644  -0.199  1.00  0.00           C  
HETATM   15  C   UNL     1       6.341  -3.568  -1.254  1.00  0.00           C  
HETATM   16  C   UNL     1       7.479  -2.724  -0.675  1.00  0.00           C  
HETATM   17  S   UNL     1       4.729   2.503   0.175  1.00  0.00           S  
HETATM   18  C   UNL     1       0.224   0.392   0.451  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.329   1.183  -0.434  1.00  0.00           C  
HETATM   20  O   UNL     1      -3.967   2.087  -0.938  1.00  0.00           O  
HETATM   21  C   UNL     1      -5.408  -0.062  -0.177  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.864  -1.416   0.370  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.379  -1.548   0.206  1.00  0.00           C  
HETATM   24  F   UNL     1      -7.796  -2.787   0.706  1.00  0.00           F  
HETATM   25  F   UNL     1      -8.017  -0.522   0.911  1.00  0.00           F  
HETATM   26  F   UNL     1      -7.711  -1.458  -1.150  1.00  0.00           F  
HETATM   27  H   UNL     1       7.784  -1.372   0.973  1.00  0.00           H  
HETATM   28  H   UNL     1       6.495  -2.570   1.235  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.637  -0.622   0.641  1.00  0.00           H  
HETATM   30  H   UNL     1       6.379  -0.230  -0.721  1.00  0.00           H  
HETATM   31  H   UNL     1       5.090  -1.429  -0.460  1.00  0.00           H  
HETATM   32  H   UNL     1       4.934  -0.743   1.918  1.00  0.00           H  
HETATM   33  H   UNL     1       6.223   0.456   1.656  1.00  0.00           H  
HETATM   34  H   UNL     1       0.649   3.474  -0.911  1.00  0.00           H  
HETATM   35  H   UNL     1       2.596   3.706  -0.542  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.782   3.272  -1.156  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.448  -0.656   0.384  1.00  0.00           H  
HETATM   38  H   UNL     1       8.224  -4.317   0.570  1.00  0.00           H  
HETATM   39  H   UNL     1       8.977  -4.228  -1.040  1.00  0.00           H  
HETATM   40  H   UNL     1       9.415  -3.043   0.213  1.00  0.00           H  
HETATM   41  H   UNL     1       5.960  -4.240  -0.485  1.00  0.00           H  
HETATM   42  H   UNL     1       5.539  -2.912  -1.593  1.00  0.00           H  
HETATM   43  H   UNL     1       6.714  -4.152  -2.095  1.00  0.00           H  
HETATM   44  H   UNL     1       7.860  -2.052  -1.444  1.00  0.00           H  
HETATM   45  H   UNL     1       0.791  -0.409   0.903  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.905   0.738   0.373  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.666   0.009  -1.233  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.368  -2.216  -0.179  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.606  -1.486   1.427  1.00  0.00           H  
CONECT    1   16    3   27   28                                       
CONECT    2   11   11   18   29                                       
CONECT    3    4    1   30   31                                       
CONECT    4    6    3   32   33                                       
CONECT    5   10   10    9   34                                       
CONECT    6    4   12   12   17                                       
CONECT    7   12    9    8    8                                       
CONECT    8    7    7   17   35                                       
CONECT    9    5    7   18   18                                       
CONECT   10    5    5   11   36                                       
CONECT   11   10   19    2    2                                       
CONECT   12    6    6    7                                            
CONECT   13   19   21   37                                            
CONECT   14   16   38   39   40                                       
CONECT   15   16   41   42   43                                       
CONECT   16   14    1   15   44                                       
CONECT   17    6    8                                                 
CONECT   18    9    9    2   45                                       
CONECT   19   20   20   11   13                                       
CONECT   20   19   19                                                 
CONECT   21   22   13   46   47                                       
CONECT   22   23   21   48   49                                       
CONECT   23   25   24   26   22                                       
CONECT   24   23                                                      
CONECT   25   23                                                      
CONECT   26   23                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   18                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
