COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       5.448  -2.041  -0.605  1.00  0.00           F  
HETATM    2  C   UNL     1       5.190  -0.783  -0.185  1.00  0.00           C  
HETATM    3  C   UNL     1       6.216   0.137  -0.083  1.00  0.00           C  
HETATM    4  C   UNL     1       5.954   1.426   0.347  1.00  0.00           C  
HETATM    5  C   UNL     1       4.662   1.805   0.678  1.00  0.00           C  
HETATM    6  F   UNL     1       4.417   3.066   1.097  1.00  0.00           F  
HETATM    7  C   UNL     1       3.626   0.898   0.581  1.00  0.00           C  
HETATM    8  C   UNL     1       3.881  -0.406   0.142  1.00  0.00           C  
HETATM    9  C   UNL     1       2.783  -1.378   0.036  1.00  0.00           C  
HETATM   10  CA  UNL     1       1.541  -0.961  -0.307  1.00  0.00           C  
HETATM   11  C   UNL     1       0.411  -1.903  -0.284  1.00  0.00           C  
HETATM   12  O   UNL     1       0.612  -3.101  -0.220  1.00  0.00           O  
HETATM   13  N   UNL     1      -0.851  -1.426  -0.334  1.00  0.00           N  
HETATM   14  N   UNL     1       1.321   0.368  -0.679  1.00  0.00           N  
HETATM   15  C   UNL     1       0.058   0.841  -0.740  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.149   1.997  -1.062  1.00  0.00           O  
HETATM   17  CA  UNL     1      -1.062  -0.044  -0.405  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.297   0.473  -0.169  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.324  -0.354   0.354  1.00  0.00           C  
HETATM   20  N   UNL     1      -3.167  -1.572   0.986  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.400  -2.007   1.319  1.00  0.00           C  
HETATM   22  N   UNL     1      -5.290  -1.132   0.928  1.00  0.00           N  
HETATM   23  C   UNL     1      -4.681  -0.101   0.338  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.354   1.113  -0.247  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.024   1.210  -1.738  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.868   0.994  -0.067  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.852   2.369   0.468  1.00  0.00           C  
HETATM   28  H   UNL     1       7.225  -0.151  -0.339  1.00  0.00           H  
HETATM   29  H   UNL     1       6.760   2.140   0.424  1.00  0.00           H  
HETATM   30  H   UNL     1       2.620   1.195   0.840  1.00  0.00           H  
HETATM   31  H   UNL     1       2.968  -2.424   0.231  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.605  -2.036  -0.322  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.497   1.513  -0.380  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.329  -2.028   1.159  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.618  -2.934   1.827  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.381   0.315  -2.248  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.510   2.088  -2.162  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.945   1.294  -1.867  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.103   0.926   0.995  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.355   1.873  -0.491  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.226   0.100  -0.576  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.773   2.454   0.339  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.339   3.248   0.044  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.087   2.301   1.530  1.00  0.00           H  
HETATM   45  H   UNL     1       2.070   0.947  -0.892  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    8    1    3    3                                       
CONECT    3    2    2    4   28                                       
CONECT    4    5    5    3   29                                       
CONECT    5    7    6    4    4                                       
CONECT    6    5                                                      
CONECT    7    8    8    5   30                                       
CONECT    8    9    7    7    2                                       
CONECT    9   10   10    8   31                                       
CONECT   10   11   14    9    9                                       
CONECT   11   13   12   12   10                                       
CONECT   12   11   11                                                 
CONECT   13   17   11   32                                            
CONECT   14   15   10   45                                            
CONECT   15   17   16   16   14                                       
CONECT   16   15   15                                                 
CONECT   17   18   18   13   15                                       
CONECT   18   19   17   17   33                                       
CONECT   19   23   23   20   18                                       
CONECT   20   21   19   34                                            
CONECT   21   22   22   20   35                                       
CONECT   22   21   21   23                                            
CONECT   23   22   24   19   19                                       
CONECT   24   25   23   26   27                                       
CONECT   25   24   36   37   38                                       
CONECT   26   24   39   40   41                                       
CONECT   27   24   42   43   44                                       
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    7                                                      
CONECT   31    9                                                      
CONECT   32   13                                                      
CONECT   33   18                                                      
CONECT   34   20                                                      
CONECT   35   21                                                      
CONECT   36   25                                                      
CONECT   37   25                                                      
CONECT   38   25                                                      
CONECT   39   26                                                      
CONECT   40   26                                                      
CONECT   41   26                                                      
CONECT   42   27                                                      
CONECT   43   27                                                      
CONECT   44   27                                                      
CONECT   45   14                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
