COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.083   0.275   0.248  1.00  0.00           C  
HETATM    2  C   UNL     1       7.628  -0.064   0.055  1.00  0.00           C  
HETATM    3  C   UNL     1       5.335   0.571   0.077  1.00  0.00           C  
HETATM    4  C   UNL     1       4.849  -0.722   0.219  1.00  0.00           C  
HETATM    5  C   UNL     1       3.522  -0.993  -0.048  1.00  0.00           C  
HETATM    6  C   UNL     1       2.676   0.022  -0.456  1.00  0.00           C  
HETATM    7  C   UNL     1       1.227  -0.277  -0.745  1.00  0.00           C  
HETATM    8  O   UNL     1       7.309  -1.157  -0.362  1.00  0.00           O  
HETATM    9  O   UNL     1       0.459  -0.113   0.448  1.00  0.00           O  
HETATM   10  O   UNL     1      -4.935  -1.057   0.089  1.00  0.00           O  
HETATM   11  O   UNL     1      -7.218  -0.626  -0.248  1.00  0.00           O  
HETATM   12  O   UNL     1      -6.727   1.626  -0.696  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.877  -0.347   0.359  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.682  -0.206   1.480  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.040  -0.444   1.390  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.599  -0.822   0.178  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.794  -0.962  -0.943  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.437  -0.719  -0.854  1.00  0.00           C  
HETATM   19  C   UNL     1       3.156   1.311  -0.598  1.00  0.00           C  
HETATM   20  C   UNL     1       4.482   1.590  -0.328  1.00  0.00           C  
HETATM   21  N   UNL     1       6.680   0.849   0.346  1.00  0.00           N  
HETATM   22  S   UNL     1      -5.831   0.285  -0.304  1.00  0.00           S  
HETATM   23  H   UNL     1       9.696  -0.581  -0.038  1.00  0.00           H  
HETATM   24  H   UNL     1       9.343   1.131  -0.374  1.00  0.00           H  
HETATM   25  H   UNL     1       9.264   0.517   1.295  1.00  0.00           H  
HETATM   26  H   UNL     1       5.510  -1.515   0.536  1.00  0.00           H  
HETATM   27  H   UNL     1       3.144  -1.998   0.062  1.00  0.00           H  
HETATM   28  H   UNL     1       0.861   0.408  -1.510  1.00  0.00           H  
HETATM   29  H   UNL     1       1.132  -1.303  -1.101  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.024  -0.127  -0.444  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.230   1.536  -1.517  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.247   0.088   2.424  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.667  -0.334   2.262  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.229  -1.257  -1.887  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.810  -0.828  -1.727  1.00  0.00           H  
HETATM   36  H   UNL     1       2.493   2.102  -0.917  1.00  0.00           H  
HETATM   37  H   UNL     1       4.856   2.596  -0.439  1.00  0.00           H  
HETATM   38  H   UNL     1       6.929   1.698   0.743  1.00  0.00           H  
HETATM   39  F   UNL     1      -5.301   1.027   1.023  1.00  0.00           F  
CONECT    1    2   23   24   25                                       
CONECT    2    1    8    8   21                                       
CONECT    3   20   20    4   21                                       
CONECT    4    5    5    3   26                                       
CONECT    5    6    4    4   27                                       
CONECT    6    7   19   19    5                                       
CONECT    7    9    6   28   29                                       
CONECT    8    2    2                                                 
CONECT    9   13    7                                                 
CONECT   10   22   16                                                 
CONECT   11   22   30                                                 
CONECT   12   22   31                                                 
CONECT   13   18   18   14    9                                       
CONECT   14   15   15   13   32                                       
CONECT   15   16   14   14   33                                       
CONECT   16   10   17   17   15                                       
CONECT   17   16   16   18   34                                       
CONECT   18   17   13   13   35                                       
CONECT   19    6    6   20   36                                       
CONECT   20   19    3    3   37                                       
CONECT   21    2    3   38                                            
CONECT   22   12   10   11   39                                       
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29    7                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
