COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.985   0.051   1.269  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.959  -0.522   0.399  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.350  -0.249  -0.841  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.348  -0.700   0.466  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.137  -0.158  -1.986  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.100  -0.607  -0.671  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.499  -0.336  -1.896  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.999  -0.122  -0.616  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.753  -0.310   0.730  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.927  -0.560   1.367  1.00  0.00           C  
HETATM   11  F   UNL     1      -8.438  -0.778  -0.604  1.00  0.00           F  
HETATM   12  C   UNL     1      -1.431  -0.255   1.371  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.327  -0.437   2.570  1.00  0.00           O  
HETATM   14  N   UNL     1      -0.333  -0.004   0.631  1.00  0.00           N  
HETATM   15  C   UNL     1       1.271   1.466   1.815  1.00  0.00           C  
HETATM   16  C   UNL     1       1.991   2.185   0.694  1.00  0.00           C  
HETATM   17  C   UNL     1       2.471   1.265  -0.218  1.00  0.00           C  
HETATM   18  C   UNL     1       2.108  -0.135   0.227  1.00  0.00           C  
HETATM   19  C   UNL     1       2.208   3.537   0.489  1.00  0.00           C  
HETATM   20  C   UNL     1       2.903   3.969  -0.623  1.00  0.00           C  
HETATM   21  C   UNL     1       3.384   3.049  -1.536  1.00  0.00           C  
HETATM   22  C   UNL     1       3.168   1.699  -1.334  1.00  0.00           C  
HETATM   23  C   UNL     1       3.317  -0.820   0.866  1.00  0.00           C  
HETATM   24  C   UNL     1       4.368  -1.108  -0.208  1.00  0.00           C  
HETATM   25  C   UNL     1       5.577  -1.793   0.431  1.00  0.00           C  
HETATM   26  C   UNL     1       6.612  -2.076  -0.627  1.00  0.00           C  
HETATM   27  O   UNL     1       6.403  -1.762  -1.776  1.00  0.00           O  
HETATM   28  O   UNL     1       7.765  -2.677  -0.295  1.00  0.00           O  
HETATM   29  H   UNL     1       1.061  -0.693   2.062  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.822  -0.910   1.413  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.680   0.052  -2.941  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.108  -0.266  -2.786  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.329   0.067  -1.291  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.051  -0.747   2.424  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.415   0.140  -0.325  1.00  0.00           H  
HETATM   36  H   UNL     1       0.338   1.975   2.054  1.00  0.00           H  
HETATM   37  H   UNL     1       1.908   1.409   2.698  1.00  0.00           H  
HETATM   38  H   UNL     1       1.745  -0.719  -0.619  1.00  0.00           H  
HETATM   39  H   UNL     1       1.833   4.257   1.202  1.00  0.00           H  
HETATM   40  H   UNL     1       3.070   5.024  -0.780  1.00  0.00           H  
HETATM   41  H   UNL     1       3.927   3.384  -2.407  1.00  0.00           H  
HETATM   42  H   UNL     1       3.544   0.981  -2.047  1.00  0.00           H  
HETATM   43  H   UNL     1       3.745  -0.167   1.627  1.00  0.00           H  
HETATM   44  H   UNL     1       3.003  -1.757   1.327  1.00  0.00           H  
HETATM   45  H   UNL     1       3.940  -1.762  -0.969  1.00  0.00           H  
HETATM   46  H   UNL     1       4.682  -0.171  -0.669  1.00  0.00           H  
HETATM   47  H   UNL     1       6.005  -1.139   1.191  1.00  0.00           H  
HETATM   48  H   UNL     1       5.263  -2.729   0.892  1.00  0.00           H  
HETATM   49  H   UNL     1       8.398  -2.838  -1.008  1.00  0.00           H  
CONECT    1   14   15   18   29                                       
CONECT    2    3    3    4   10                                       
CONECT    3    2    2    5    8                                       
CONECT    4    2    6    6   30                                       
CONECT    5    3    7    7   31                                       
CONECT    6    4    4    7   11                                       
CONECT    7    5    5    6   32                                       
CONECT    8    3    9   33                                            
CONECT    9    8   10   10   12                                       
CONECT   10    2    9    9   34                                       
CONECT   11    6                                                      
CONECT   12    9   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14    1   12   35                                            
CONECT   15    1   16   36   37                                       
CONECT   16   15   17   17   19                                       
CONECT   17   16   16   18   22                                       
CONECT   18    1   17   23   38                                       
CONECT   19   16   20   20   39                                       
CONECT   20   19   19   21   40                                       
CONECT   21   20   22   22   41                                       
CONECT   22   17   21   21   42                                       
CONECT   23   18   24   43   44                                       
CONECT   24   23   25   45   46                                       
CONECT   25   24   26   47   48                                       
CONECT   26   25   27   27   28                                       
CONECT   27   26   26                                                 
CONECT   28   26   49                                                 
CONECT   29    1                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
