COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.136   0.817  -1.419  1.00  0.00           N  
HETATM    2  O   UNL     1       5.310  -0.462   0.684  1.00  0.00           O  
HETATM    3  O   UNL     1       4.645   1.947   0.720  1.00  0.00           O  
HETATM    4  F   UNL     1       0.895  -2.836  -0.069  1.00  0.00           F  
HETATM    5  F   UNL     1      -0.368   1.740  -0.008  1.00  0.00           F  
HETATM    6  F   UNL     1       3.529  -2.105   0.038  1.00  0.00           F  
HETATM    7  F   UNL     1       2.269   2.461   0.112  1.00  0.00           F  
HETATM    8  C   UNL     1      -2.173  -0.076  -0.124  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.756   1.622   0.340  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.669   0.318   1.136  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.250   1.384  -1.084  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.215  -0.154   1.184  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.795   0.911  -1.036  1.00  0.00           C  
HETATM   14  N   UNL     1      -2.845  -2.124  -0.208  1.00  0.00           N  
HETATM   15  N   UNL     1      -1.561  -2.131  -0.149  1.00  0.00           N  
HETATM   16  C   UNL     1       1.232  -1.528  -0.026  1.00  0.00           C  
HETATM   17  C   UNL     1       0.592   0.790   0.002  1.00  0.00           C  
HETATM   18  C   UNL     1       2.566  -1.158   0.028  1.00  0.00           C  
HETATM   19  C   UNL     1       1.927   1.155   0.063  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.276  -0.858  -0.192  1.00  0.00           C  
HETATM   21  C   UNL     1       0.242  -0.554  -0.042  1.00  0.00           C  
HETATM   22  C   UNL     1       2.912   0.182   0.073  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.709  -0.392  -0.240  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.110  -0.926  -0.103  1.00  0.00           N  
HETATM   25  S   UNL     1       4.610   0.649   0.142  1.00  0.00           S  
HETATM   26  H   UNL     1       6.055   1.074  -1.596  1.00  0.00           H  
HETATM   27  H   UNL     1       4.527   0.656  -2.156  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.142   1.003  -0.098  1.00  0.00           H  
HETATM   29  H   UNL     1      -7.792   1.958   0.305  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.142   2.383   0.821  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.030   0.488   2.151  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.283  -0.443   0.655  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.863   0.622  -1.566  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.312   2.312  -1.652  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.601   0.607   1.666  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.153  -1.083   1.752  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.435   0.742  -2.051  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.182   1.673  -0.555  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.322  -1.154  -0.721  1.00  0.00           H  
CONECT    1   25   26   27                                            
CONECT    2   25   25                                                 
CONECT    3   25   25                                                 
CONECT    4   16                                                      
CONECT    5   17                                                      
CONECT    6   18                                                      
CONECT    7   19                                                      
CONECT    8   20   20   24   28                                       
CONECT    9   10   11   29   30                                       
CONECT   10    9   12   31   32                                       
CONECT   11    9   13   33   34                                       
CONECT   12   10   23   35   36                                       
CONECT   13   11   23   37   38                                       
CONECT   14   20   15   15                                            
CONECT   15   14   14   24                                            
CONECT   16    4   21   21   18                                       
CONECT   17    5   21   19   19                                       
CONECT   18    6   16   22   22                                       
CONECT   19    7   17   17   22                                       
CONECT   20    8    8   14   23                                       
CONECT   21   16   16   17   24                                       
CONECT   22   18   18   19   25                                       
CONECT   23   12   13   20   39                                       
CONECT   24    8   15   21                                            
CONECT   25    1    2    2    3                                       
CONECT   25    3   22                                                 
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   23                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
