COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -1.901  -3.877  -0.819  1.00  0.00           F  
HETATM    2  C   UNL     1      -2.633  -2.912  -0.220  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.400  -3.215   0.892  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.149  -2.228   1.504  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.132  -0.938   1.006  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.366  -0.635  -0.104  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.612  -1.619  -0.714  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.348   0.772  -0.645  1.00  0.00           C  
HETATM    9  CA  UNL     1      -2.226   1.563   0.028  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.285   3.001  -0.421  1.00  0.00           C  
HETATM   11  OXT UNL     1      -3.385   3.733  -0.184  1.00  0.00           O  
HETATM   12  O   UNL     1      -1.342   3.494  -0.994  1.00  0.00           O  
HETATM   13  N   UNL     1      -0.931   0.988  -0.345  1.00  0.00           N  
HETATM   14  C   UNL     1       0.136   1.150   0.463  1.00  0.00           C  
HETATM   15  O   UNL     1       0.024   1.773   1.501  1.00  0.00           O  
HETATM   16  C   UNL     1       1.442   0.570   0.087  1.00  0.00           C  
HETATM   17  C   UNL     1       2.535   0.739   0.921  1.00  0.00           C  
HETATM   18  C   UNL     1       3.772   0.186   0.558  1.00  0.00           C  
HETATM   19  C   UNL     1       3.884  -0.538  -0.657  1.00  0.00           C  
HETATM   20  C   UNL     1       2.755  -0.692  -1.482  1.00  0.00           C  
HETATM   21  C   UNL     1       1.564  -0.155  -1.112  1.00  0.00           C  
HETATM   22  C   UNL     1       4.905   0.336   1.378  1.00  0.00           C  
HETATM   23  C   UNL     1       6.090  -0.213   0.996  1.00  0.00           C  
HETATM   24  C   UNL     1       6.200  -0.924  -0.198  1.00  0.00           C  
HETATM   25  C   UNL     1       5.125  -1.090  -1.016  1.00  0.00           C  
HETATM   26  H   UNL     1      -3.414  -4.223   1.280  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.748  -2.464   2.371  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.718  -0.167   1.485  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.010  -1.380  -1.579  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.178   0.745  -1.722  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.305   1.252  -0.440  1.00  0.00           H  
HETATM   32  HA  UNL     1      -2.346   1.516   1.111  1.00  0.00           H  
HETATM   33  HXT UNL     1      -3.376   4.650  -0.491  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.841   0.491  -1.173  1.00  0.00           H  
HETATM   35  H   UNL     1       2.436   1.293   1.843  1.00  0.00           H  
HETATM   36  H   UNL     1       2.834  -1.242  -2.408  1.00  0.00           H  
HETATM   37  H   UNL     1       0.702  -0.278  -1.751  1.00  0.00           H  
HETATM   38  H   UNL     1       4.834   0.885   2.305  1.00  0.00           H  
HETATM   39  H   UNL     1       6.959  -0.095   1.627  1.00  0.00           H  
HETATM   40  H   UNL     1       7.152  -1.349  -0.477  1.00  0.00           H  
HETATM   41  H   UNL     1       5.226  -1.643  -1.938  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3    7                                       
CONECT    3    2    2    4   26                                       
CONECT    4    3    5    5   27                                       
CONECT    5    4    4    6   28                                       
CONECT    6    5    7    7    8                                       
CONECT    7    2    6    6   29                                       
CONECT    8    6    9   30   31                                       
CONECT    9    8   13   10   32                                       
CONECT   10    9   12   12   11                                       
CONECT   11   10   33                                                 
CONECT   12   10   10                                                 
CONECT   13    9   14   34                                            
CONECT   14   13   16   15   15                                       
CONECT   15   14   14                                                 
CONECT   16   14   21   21   17                                       
CONECT   17   16   18   18   35                                       
CONECT   18   17   17   22   19                                       
CONECT   19   18   25   20   20                                       
CONECT   20   19   19   21   36                                       
CONECT   21   16   16   20   37                                       
CONECT   22   18   23   23   38                                       
CONECT   23   22   22   24   39                                       
CONECT   24   23   25   25   40                                       
CONECT   25   19   24   24   41                                       
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   11                                                      
CONECT   34   13                                                      
CONECT   35   17                                                      
CONECT   36   20                                                      
CONECT   37   21                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   24                                                      
CONECT   41   25                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
