COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.762   1.753  -0.036  1.00  0.00           N  
HETATM    2  CA  UNL     1       4.491   0.409   0.491  1.00  0.00           C  
HETATM    3  C   UNL     1       3.169  -0.106  -0.083  1.00  0.00           C  
HETATM    4  C   UNL     1       2.019   0.767   0.424  1.00  0.00           C  
HETATM    5  C   UNL     1       0.717   0.261  -0.141  1.00  0.00           C  
HETATM    6  O   UNL     1       0.710  -0.701  -0.873  1.00  0.00           O  
HETATM    7  O   UNL     1      -0.435   0.877   0.169  1.00  0.00           O  
HETATM    8  C   UNL     1       5.607  -0.522   0.093  1.00  0.00           C  
HETATM    9  O   UNL     1       6.329  -0.237  -0.833  1.00  0.00           O  
HETATM   10  O   UNL     1      -3.385  -3.452   0.083  1.00  0.00           O  
HETATM   11  C   UNL     1      -3.892  -2.243  -0.484  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.397  -1.049   0.335  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.976  -0.924   0.202  1.00  0.00           O  
HETATM   14  C   UNL     1      -1.650   0.334  -0.411  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.853   1.259  -0.101  1.00  0.00           C  
HETATM   16  F   UNL     1      -2.972   2.270  -1.061  1.00  0.00           F  
HETATM   17  C   UNL     1      -4.032   0.253  -0.200  1.00  0.00           C  
HETATM   18  O   UNL     1      -5.122   0.664   0.627  1.00  0.00           O  
HETATM   19  OXT UNL     1       5.799  -1.666   0.767  1.00  0.00           O  
HETATM   20  O   UNL     1      -2.754   1.811   1.213  1.00  0.00           O  
HETATM   21  H1  UNL     1       4.830   1.740  -1.043  1.00  0.00           H  
HETATM   22  H2  UNL     1       4.061   2.410   0.271  1.00  0.00           H  
HETATM   23  HA  UNL     1       4.423   0.451   1.578  1.00  0.00           H  
HETATM   24  H   UNL     1       3.204  -0.064  -1.171  1.00  0.00           H  
HETATM   25  H   UNL     1       3.011  -1.136   0.237  1.00  0.00           H  
HETATM   26  H   UNL     1       1.983   0.726   1.512  1.00  0.00           H  
HETATM   27  H   UNL     1       2.177   1.798   0.104  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.659  -4.252  -0.387  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.542  -2.148  -1.512  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.982  -2.264  -0.472  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.659  -1.186   1.384  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.532   0.211  -1.488  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.353   0.131  -1.234  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.555   1.477   0.333  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.971   2.361   1.351  1.00  0.00           H  
HETATM   36  HXT UNL     1       6.528  -2.231   0.475  1.00  0.00           H  
CONECT    1    2   21   22                                            
CONECT    2    1    3    8   23                                       
CONECT    3    2    4   24   25                                       
CONECT    4    3    5   26   27                                       
CONECT    5    4    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    5   14                                                 
CONECT    8    2    9    9   19                                       
CONECT    9    8    8                                                 
CONECT   10   11   28                                                 
CONECT   11   10   12   29   30                                       
CONECT   12   11   13   17   31                                       
CONECT   13   12   14                                                 
CONECT   14    7   13   15   32                                       
CONECT   15   14   16   17   20                                       
CONECT   16   15                                                      
CONECT   17   12   15   18   33                                       
CONECT   18   17   34                                                 
CONECT   19    8   36                                                 
CONECT   20   15   35                                                 
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   14                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   20                                                      
CONECT   36   19                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
