COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.095  -0.750   0.428  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.811  -0.693   0.150  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.151   0.206   1.120  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.288   2.013  -0.448  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.746   0.252  -0.274  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.353   1.576  -0.360  1.00  0.00           C  
HETATM    7  C   UNL     1       2.876  -1.300   1.362  1.00  0.00           C  
HETATM    8  N   UNL     1       3.043   2.606  -0.146  1.00  0.00           N  
HETATM    9  C   UNL     1       3.258  -2.815  -0.312  1.00  0.00           C  
HETATM   10  C   UNL     1       3.797  -3.961  -0.981  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.247   0.985   0.365  1.00  0.00           C  
HETATM   12  C   UNL     1       1.284   0.506   0.623  1.00  0.00           C  
HETATM   13  C   UNL     1       1.020   1.245  -0.706  1.00  0.00           C  
HETATM   14  C   UNL     1       3.046   2.106   1.162  1.00  0.00           C  
HETATM   15  C   UNL     1       2.126   2.196  -1.033  1.00  0.00           C  
HETATM   16  N   UNL     1       1.915   1.428   1.578  1.00  0.00           N  
HETATM   17  N   UNL     1      -2.585  -0.292   0.460  1.00  0.00           N  
HETATM   18  N   UNL     1      -0.958   1.369   0.697  1.00  0.00           N  
HETATM   19  N   UNL     1      -3.110   1.904  -0.039  1.00  0.00           N  
HETATM   20  S   UNL     1       2.143  -1.653  -1.019  1.00  0.00           S  
HETATM   21  N   UNL     1       4.225  -4.870  -1.511  1.00  0.00           N  
HETATM   22  N   UNL     1       4.070   2.274   1.948  1.00  0.00           N  
HETATM   23  C   UNL     1       3.534  -2.444   0.973  1.00  0.00           C  
HETATM   24  O   UNL     1       2.197   2.622  -2.166  1.00  0.00           O  
HETATM   25  F   UNL     1      -6.006  -0.117  -0.594  1.00  0.00           F  
HETATM   26  C   UNL     1       4.057   3.583  -0.552  1.00  0.00           C  
HETATM   27  O   UNL     1      -4.153  -2.001   0.248  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.328   2.633  -0.813  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.138  -2.905   0.689  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.705  -4.325   0.738  1.00  0.00           C  
HETATM   31  H   UNL     1      -0.530  -0.706   0.657  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.164   0.112   2.206  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.065   3.053  -0.209  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.927   1.965  -1.329  1.00  0.00           H  
HETATM   35  H   UNL     1       2.984  -0.877   2.351  1.00  0.00           H  
HETATM   36  H   UNL     1       0.882   0.527  -1.515  1.00  0.00           H  
HETATM   37  H   UNL     1       4.851   2.754   1.631  1.00  0.00           H  
HETATM   38  H   UNL     1       4.199  -2.996   1.621  1.00  0.00           H  
HETATM   39  H   UNL     1       4.716   3.793   0.290  1.00  0.00           H  
HETATM   40  H   UNL     1       4.640   3.178  -1.378  1.00  0.00           H  
HETATM   41  H   UNL     1       3.568   4.504  -0.869  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.854   3.037   0.052  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.787   3.434  -1.316  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.047   2.191  -1.502  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.297  -2.873  -0.003  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.800  -2.615   1.684  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.546  -4.357   1.431  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.043  -4.616  -0.257  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.931  -5.015   1.074  1.00  0.00           H  
HETATM   50  H   UNL     1       1.551   1.556   2.468  1.00  0.00           H  
CONECT    1    7    7   20   12                                       
CONECT    2    5    5   17   27                                       
CONECT    3   12   18   31   32                                       
CONECT    4   18   13   33   34                                       
CONECT    5    6   25    2    2                                       
CONECT    6   28   19   19    5                                       
CONECT    7   23    1    1   35                                       
CONECT    8   15   14   26                                            
CONECT    9   23   23   10   20                                       
CONECT   10   21   21   21    9                                       
CONECT   11   19   18   17   17                                       
CONECT   12    1    3   13   16                                       
CONECT   13   12    4   15   36                                       
CONECT   14   16    8   22   22                                       
CONECT   15   13   24   24    8                                       
CONECT   16   12   14   50                                            
CONECT   17   11   11    2                                            
CONECT   18    3   11    4                                            
CONECT   19    6    6   11                                            
CONECT   20    9    1                                                 
CONECT   21   10   10   10                                            
CONECT   22   14   14   37                                            
CONECT   23    7    9    9   38                                       
CONECT   24   15   15                                                 
CONECT   25    5                                                      
CONECT   26    8   39   40   41                                       
CONECT   27    2   29                                                 
CONECT   28    6   42   43   44                                       
CONECT   29   27   30   45   46                                       
CONECT   30   29   47   48   49                                       
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    7                                                      
CONECT   36   13                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   26                                                      
CONECT   40   26                                                      
CONECT   41   26                                                      
CONECT   42   28                                                      
CONECT   43   28                                                      
CONECT   44   28                                                      
CONECT   45   29                                                      
CONECT   46   29                                                      
CONECT   47   30                                                      
CONECT   48   30                                                      
CONECT   49   30                                                      
CONECT   50   16                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
