COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.502   2.427  -0.255  1.00  0.00           O  
HETATM    2  C   UNL     1       2.572   1.852  -0.226  1.00  0.00           C  
HETATM    3  N   UNL     1       3.545   2.264  -1.055  1.00  0.00           N  
HETATM    4  C   UNL     1       4.755   1.664  -1.068  1.00  0.00           C  
HETATM    5  O   UNL     1       5.631   2.043  -1.822  1.00  0.00           O  
HETATM    6  C   UNL     1       4.987   0.539  -0.144  1.00  0.00           C  
HETATM    7  C   UNL     1       6.207  -0.131  -0.098  1.00  0.00           C  
HETATM    8  C   UNL     1       6.374  -1.178   0.784  1.00  0.00           C  
HETATM    9  C   UNL     1       5.337  -1.564   1.619  1.00  0.00           C  
HETATM   10  C   UNL     1       4.122  -0.908   1.583  1.00  0.00           C  
HETATM   11  C   UNL     1       3.936   0.147   0.703  1.00  0.00           C  
HETATM   12  N   UNL     1       2.734   0.836   0.638  1.00  0.00           N  
HETATM   13  C   UNL     1       1.627   0.448   1.516  1.00  0.00           C  
HETATM   14  C   UNL     1       0.785  -0.597   0.831  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.276  -0.213   0.037  1.00  0.00           C  
HETATM   16  C   UNL     1       1.081  -1.939   0.995  1.00  0.00           C  
HETATM   17  C   UNL     1       0.315  -2.906   0.371  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.755  -2.536  -0.424  1.00  0.00           C  
HETATM   19  F   UNL     1      -1.503  -3.481  -1.035  1.00  0.00           F  
HETATM   20  C   UNL     1      -1.056  -1.182  -0.598  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.193  -0.777  -1.450  1.00  0.00           C  
HETATM   22  O   UNL     1      -2.305  -1.234  -2.571  1.00  0.00           O  
HETATM   23  N   UNL     1      -3.106   0.097  -0.984  1.00  0.00           N  
HETATM   24  C   UNL     1      -4.300   0.451  -1.771  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.538   0.030  -0.977  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.955   0.732   0.334  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.289   0.734   1.030  1.00  0.00           C  
HETATM   28  O   UNL     1      -4.325   1.000   2.212  1.00  0.00           O  
HETATM   29  N   UNL     1      -5.431   0.457   0.411  1.00  0.00           N  
HETATM   30  C   UNL     1      -6.671   0.588   1.180  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.213   2.012   1.035  1.00  0.00           C  
HETATM   32  H   UNL     1       3.375   3.006  -1.656  1.00  0.00           H  
HETATM   33  H   UNL     1       7.016   0.167  -0.748  1.00  0.00           H  
HETATM   34  H   UNL     1       7.318  -1.701   0.824  1.00  0.00           H  
HETATM   35  H   UNL     1       5.480  -2.386   2.305  1.00  0.00           H  
HETATM   36  H   UNL     1       3.320  -1.216   2.237  1.00  0.00           H  
HETATM   37  H   UNL     1       2.026   0.041   2.445  1.00  0.00           H  
HETATM   38  H   UNL     1       1.014   1.322   1.736  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.502   0.835  -0.093  1.00  0.00           H  
HETATM   40  H   UNL     1       1.916  -2.233   1.614  1.00  0.00           H  
HETATM   41  H   UNL     1       0.552  -3.951   0.504  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.321   1.527  -1.942  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.279  -0.074  -2.726  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.422   0.482  -1.425  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.634  -1.056  -1.011  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.234   0.171   0.929  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.606   1.757   0.208  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.409  -0.121   0.804  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.471   0.382   2.231  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.476   2.721   1.410  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.414   2.218  -0.017  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.136   2.109   1.607  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   12                                       
CONECT    3    4    2   32                                            
CONECT    4    5    5    3    6                                       
CONECT    5    4    4                                                 
CONECT    6    4    7    7   11                                       
CONECT    7    6    6    8   33                                       
CONECT    8    7    9    9   34                                       
CONECT    9    8    8   10   35                                       
CONECT   10   11   11    9   36                                       
CONECT   11    6   12   10   10                                       
CONECT   12    2   11   13                                            
CONECT   13   12   14   37   38                                       
CONECT   14   13   15   16   16                                       
CONECT   15   14   20   20   39                                       
CONECT   16   14   14   17   40                                       
CONECT   17   16   18   18   41                                       
CONECT   18   20   17   17   19                                       
CONECT   19   18                                                      
CONECT   20   15   15   21   18                                       
CONECT   21   23   20   22   22                                       
CONECT   22   21   21                                                 
CONECT   23   24   26   21                                            
CONECT   24   23   25   42   43                                       
CONECT   25   24   29   44   45                                       
CONECT   26   27   23   46   47                                       
CONECT   27   28   28   26   29                                       
CONECT   28   27   27                                                 
CONECT   29   27   30   25                                            
CONECT   30   29   31   48   49                                       
CONECT   31   30   50   51   52                                       
CONECT   32    3                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   30                                                      
CONECT   49   30                                                      
CONECT   50   31                                                      
CONECT   51   31                                                      
CONECT   52   31                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
