COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.047   2.244   0.055  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.230   2.762   0.157  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.328   1.938  -0.023  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.149   0.594  -0.305  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.875   0.072  -0.407  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.347  -0.301  -0.500  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.181   0.214  -1.674  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.201  -0.292   0.772  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.466  -1.108   1.846  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.897  -2.604   0.095  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.896  -1.661  -0.783  1.00  0.00           N  
HETATM   12  C   UNL     1       0.228   0.897  -0.227  1.00  0.00           C  
HETATM   13  F   UNL     1      -3.576   2.446   0.077  1.00  0.00           F  
HETATM   14  O   UNL     1      -3.321  -2.447   1.362  1.00  0.00           O  
HETATM   15  F   UNL     1      -5.446  -0.873   0.509  1.00  0.00           F  
HETATM   16  N   UNL     1      -2.439  -3.842  -0.285  1.00  0.00           N  
HETATM   17  N   UNL     1       1.520   0.372  -0.336  1.00  0.00           N  
HETATM   18  C   UNL     1       2.516   0.869   0.425  1.00  0.00           C  
HETATM   19  C   UNL     1       3.906   0.395   0.228  1.00  0.00           C  
HETATM   20  O   UNL     1       2.273   1.705   1.272  1.00  0.00           O  
HETATM   21  N   UNL     1       4.162  -0.515  -0.705  1.00  0.00           N  
HETATM   22  C   UNL     1       5.377  -0.965  -0.917  1.00  0.00           C  
HETATM   23  C   UNL     1       6.456  -0.496  -0.159  1.00  0.00           C  
HETATM   24  C   UNL     1       6.223   0.463   0.833  1.00  0.00           C  
HETATM   25  C   UNL     1       4.928   0.915   1.020  1.00  0.00           C  
HETATM   26  C   UNL     1       7.779  -0.992  -0.394  1.00  0.00           C  
HETATM   27  N   UNL     1       8.828  -1.384  -0.580  1.00  0.00           N  
HETATM   28  F   UNL     1      -4.611   1.518  -1.405  1.00  0.00           F  
HETATM   29  H   UNL     1       0.903   2.888   0.192  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.372   3.810   0.377  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.736  -0.976  -0.626  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.574   0.212  -2.580  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.047  -0.432  -1.816  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.338   0.732   1.117  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.483  -0.674   2.030  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.046  -1.110   2.769  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.127  -3.986  -1.192  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.428  -4.572   0.353  1.00  0.00           H  
HETATM   39  H   UNL     1       1.700  -0.350  -0.959  1.00  0.00           H  
HETATM   40  H   UNL     1       5.546  -1.706  -1.685  1.00  0.00           H  
HETATM   41  H   UNL     1       7.034   0.845   1.435  1.00  0.00           H  
HETATM   42  H   UNL     1       4.712   1.658   1.773  1.00  0.00           H  
CONECT    1    2   12   12   29                                       
CONECT    2    3    3    1   30                                       
CONECT    3   13    2    2    4                                       
CONECT    4    3    6    5    5                                       
CONECT    5    4    4   12   31                                       
CONECT    6    8    7    4   11                                       
CONECT    7   28    6   32   33                                       
CONECT    8   15    9    6   34                                       
CONECT    9    8   14   35   36                                       
CONECT   10   14   11   11   16                                       
CONECT   11    6   10   10                                            
CONECT   12    1    1    5   17                                       
CONECT   13    3                                                      
CONECT   14    9   10                                                 
CONECT   15    8                                                      
CONECT   16   10   37   38                                            
CONECT   17   12   18   39                                            
CONECT   18   20   20   17   19                                       
CONECT   19   18   25   25   21                                       
CONECT   20   18   18                                                 
CONECT   21   19   22   22                                            
CONECT   22   21   21   23   40                                       
CONECT   23   24   24   22   26                                       
CONECT   24   25   23   23   41                                       
CONECT   25   19   19   24   42                                       
CONECT   26   23   27   27   27                                       
CONECT   27   26   26   26                                            
CONECT   28    7                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   22                                                      
CONECT   41   24                                                      
CONECT   42   25                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
