COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.427  -1.958  -0.089  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.255  -0.555   0.098  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.065  -1.643   0.460  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.477  -2.931   0.542  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.364  -1.141   0.674  1.00  0.00           C  
HETATM    6  N   UNL     1       0.906  -2.115  -0.373  1.00  0.00           N  
HETATM    7  C   UNL     1      -2.639   1.910  -0.226  1.00  0.00           C  
HETATM    8  C   UNL     1       3.162  -1.222  -0.416  1.00  0.00           C  
HETATM    9  C   UNL     1       1.717  -0.954  -0.748  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.956  -0.758  -0.164  1.00  0.00           N  
HETATM   11  N   UNL     1      -1.161  -3.054   0.257  1.00  0.00           N  
HETATM   12  N   UNL     1      -3.057   0.543   0.095  1.00  0.00           N  
HETATM   13  N   UNL     1      -4.348   0.145   0.461  1.00  0.00           N  
HETATM   14  O   UNL     1       3.574  -2.362  -0.380  1.00  0.00           O  
HETATM   15  O   UNL     1      -3.142  -3.903   0.853  1.00  0.00           O  
HETATM   16  C   UNL     1      -2.959   2.851   0.953  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.400   4.172   0.276  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.210   3.675  -0.948  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.434   2.434  -1.435  1.00  0.00           C  
HETATM   20  C   UNL     1       1.577  -0.697  -2.250  1.00  0.00           C  
HETATM   21  N   UNL     1       3.996  -0.195  -0.159  1.00  0.00           N  
HETATM   22  C   UNL     1       5.448  -0.305   0.075  1.00  0.00           C  
HETATM   23  C   UNL     1       5.813   0.953   0.901  1.00  0.00           C  
HETATM   24  C   UNL     1       4.885   2.023   0.266  1.00  0.00           C  
HETATM   25  C   UNL     1       3.611   1.221  -0.073  1.00  0.00           C  
HETATM   26  F   UNL     1       4.604   3.041   1.184  1.00  0.00           F  
HETATM   27  H   UNL     1      -5.227  -1.723   0.965  1.00  0.00           H  
HETATM   28  H   UNL     1       1.311  -2.995  -0.326  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.571   1.932  -0.444  1.00  0.00           H  
HETATM   30  H   UNL     1       1.374  -0.078  -0.196  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.738  -3.925   0.299  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.768   2.444   1.558  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.071   3.012   1.565  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.032   4.757   0.945  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.534   4.751  -0.044  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.221   3.400  -0.650  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.234   4.439  -1.725  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.752   2.711  -2.239  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.131   1.671  -1.782  1.00  0.00           H  
HETATM   40  H   UNL     1       2.228   0.127  -2.539  1.00  0.00           H  
HETATM   41  H   UNL     1       1.860  -1.595  -2.799  1.00  0.00           H  
HETATM   42  H   UNL     1       0.543  -0.441  -2.480  1.00  0.00           H  
HETATM   43  H   UNL     1       5.673  -1.209   0.640  1.00  0.00           H  
HETATM   44  H   UNL     1       5.986  -0.307  -0.873  1.00  0.00           H  
HETATM   45  H   UNL     1       5.576   0.807   1.955  1.00  0.00           H  
HETATM   46  H   UNL     1       6.862   1.219   0.772  1.00  0.00           H  
HETATM   47  H   UNL     1       5.333   2.434  -0.638  1.00  0.00           H  
HETATM   48  H   UNL     1       3.203   1.559  -1.026  1.00  0.00           H  
HETATM   49  H   UNL     1       2.870   1.351   0.717  1.00  0.00           H  
CONECT    1   10   10    6   11                                       
CONECT    2   10   12    3    3                                       
CONECT    3    2    2    5    4                                       
CONECT    4   11    3   15   15                                       
CONECT    5   13   13    3   27                                       
CONECT    6    9    1   28                                            
CONECT    7   16   19   12   29                                       
CONECT    8   21   14   14    9                                       
CONECT    9    8   20    6   30                                       
CONECT   10    1    1    2                                            
CONECT   11    1    4   31                                            
CONECT   12    7    2   13                                            
CONECT   13   12    5    5                                            
CONECT   14    8    8                                                 
CONECT   15    4    4                                                 
CONECT   16   17    7   32   33                                       
CONECT   17   18   16   34   35                                       
CONECT   18   17   19   36   37                                       
CONECT   19   18    7   38   39                                       
CONECT   20    9   40   41   42                                       
CONECT   21   22   25    8                                            
CONECT   22   23   21   43   44                                       
CONECT   23   24   22   45   46                                       
CONECT   24   23   26   25   47                                       
CONECT   25   24   21   48   49                                       
CONECT   26   24                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    9                                                      
CONECT   31   11                                                      
CONECT   32   16                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
