COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.188   2.924   0.087  1.00  0.00           C  
HETATM    2  C   UNL     1       3.582   0.558  -0.131  1.00  0.00           C  
HETATM    3  C   UNL     1       4.456   1.056   0.818  1.00  0.00           C  
HETATM    4  C   UNL     1       3.913   3.289   0.145  1.00  0.00           C  
HETATM    5  C   UNL     1       2.879   1.425  -0.946  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.114  -2.510  -0.292  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.920  -1.607  -0.117  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.660  -2.153   0.046  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.552  -1.315   0.208  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.725   0.070   0.205  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.992   0.605   0.041  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.087  -0.235  -0.126  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.772   4.144   0.063  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.157   3.957  -0.005  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.204  -1.893   0.383  1.00  0.00           C  
HETATM   16  C   UNL     1       4.621   2.421   0.956  1.00  0.00           C  
HETATM   17  C   UNL     1       3.045   2.790  -0.808  1.00  0.00           C  
HETATM   18  F   UNL     1      -2.500  -3.495   0.049  1.00  0.00           F  
HETATM   19  N   UNL     1      -3.170   1.996   0.037  1.00  0.00           N  
HETATM   20  N   UNL     1      -4.397   2.670  -0.020  1.00  0.00           N  
HETATM   21  N   UNL     1       0.862  -1.083   0.539  1.00  0.00           N  
HETATM   22  N   UNL     1       2.140  -1.632   0.705  1.00  0.00           N  
HETATM   23  O   UNL     1      -0.056  -3.100   0.386  1.00  0.00           O  
HETATM   24  O   UNL     1       2.902  -1.398  -1.630  1.00  0.00           O  
HETATM   25  O   UNL     1       4.552  -1.784   0.207  1.00  0.00           O  
HETATM   26  S   UNL     1       3.371  -1.183  -0.307  1.00  0.00           S  
HETATM   27  H   UNL     1      -1.127   2.727   0.133  1.00  0.00           H  
HETATM   28  H   UNL     1       5.009   0.378   1.451  1.00  0.00           H  
HETATM   29  H   UNL     1       4.042   4.356   0.253  1.00  0.00           H  
HETATM   30  H   UNL     1       2.200   1.036  -1.690  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.540  -2.742   0.684  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.862  -2.008  -0.905  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.802  -3.433  -0.782  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.874   0.722   0.330  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.073   0.186  -0.258  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.260   5.095   0.091  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.901   4.740  -0.037  1.00  0.00           H  
HETATM   38  H   UNL     1       5.299   2.811   1.701  1.00  0.00           H  
HETATM   39  H   UNL     1       2.492   3.468  -1.442  1.00  0.00           H  
HETATM   40  H   UNL     1       0.743  -0.120   0.537  1.00  0.00           H  
HETATM   41  H   UNL     1       2.304  -2.274   1.413  1.00  0.00           H  
CONECT    1   19   13   13   27                                       
CONECT    2    3    3    5   26                                       
CONECT    3   16    2    2   28                                       
CONECT    4   16   16   17   29                                       
CONECT    5   17   17    2   30                                       
CONECT    6    7   31   32   33                                       
CONECT    7    6    8    8   12                                       
CONECT    8   18    7    7    9                                       
CONECT    9    8   15   10   10                                       
CONECT   10    9    9   11   34                                       
CONECT   11   12   12   10   19                                       
CONECT   12    7   11   11   35                                       
CONECT   13    1    1   14   36                                       
CONECT   14   13   20   20   37                                       
CONECT   15   21    9   23   23                                       
CONECT   16    4    4    3   38                                       
CONECT   17    4    5    5   39                                       
CONECT   18    8                                                      
CONECT   19   11    1   20                                            
CONECT   20   19   14   14                                            
CONECT   21   22   15   40                                            
CONECT   22   26   21   41                                            
CONECT   23   15   15                                                 
CONECT   24   26   26                                                 
CONECT   25   26   26                                                 
CONECT   26    2   24   24   25                                       
CONECT   26   25   22                                                 
CONECT   27    1                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
